data_4X0L # _entry.id 4X0L # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.279 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 4X0L WWPDB D_1000204871 # _pdbx_database_status.status_code REL _pdbx_database_status.status_code_sf REL _pdbx_database_status.status_code_mr ? _pdbx_database_status.entry_id 4X0L _pdbx_database_status.recvd_initial_deposition_date 2014-11-21 _pdbx_database_status.SG_entry N _pdbx_database_status.deposit_site RCSB _pdbx_database_status.process_site PDBE _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 'Lane-Serff, H.' 1 'MacGregor, P.' 2 'Lowe, E.D.' 3 'Carrington, M.' 4 'Higgins, M.K.' 5 # _citation.abstract ? _citation.abstract_id_CAS ? _citation.book_id_ISBN ? _citation.book_publisher ? _citation.book_publisher_city ? _citation.book_title ? _citation.coordinate_linkage ? _citation.country US _citation.database_id_Medline ? _citation.details ? _citation.id primary _citation.journal_abbrev Elife _citation.journal_id_ASTM ? _citation.journal_id_CSD ? _citation.journal_id_ISSN 2050-084X _citation.journal_full ? _citation.journal_issue ? _citation.journal_volume 3 _citation.language ? _citation.page_first e05553 _citation.page_last e05553 _citation.title 'Structural basis for ligand and innate immunity factor uptake by the trypanosome haptoglobin-haemoglobin receptor.' _citation.year 2014 _citation.database_id_CSD ? _citation.pdbx_database_id_DOI 10.7554/eLife.05553 _citation.pdbx_database_id_PubMed 25497229 _citation.unpublished_flag ? # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Lane-Serff, H.' 1 primary 'MacGregor, P.' 2 primary 'Lowe, E.D.' 3 primary 'Carrington, M.' 4 primary 'Higgins, M.K.' 5 # _cell.angle_alpha 90.00 _cell.angle_alpha_esd ? _cell.angle_beta 90.00 _cell.angle_beta_esd ? _cell.angle_gamma 120.00 _cell.angle_gamma_esd ? _cell.entry_id 4X0L _cell.details ? _cell.formula_units_Z ? _cell.length_a 96.599 _cell.length_a_esd ? _cell.length_b 96.599 _cell.length_b_esd ? _cell.length_c 132.771 _cell.length_c_esd ? _cell.volume ? _cell.volume_esd ? _cell.Z_PDB 6 _cell.reciprocal_angle_alpha ? _cell.reciprocal_angle_beta ? _cell.reciprocal_angle_gamma ? _cell.reciprocal_angle_alpha_esd ? _cell.reciprocal_angle_beta_esd ? _cell.reciprocal_angle_gamma_esd ? _cell.reciprocal_length_a ? _cell.reciprocal_length_b ? _cell.reciprocal_length_c ? _cell.reciprocal_length_a_esd ? _cell.reciprocal_length_b_esd ? _cell.reciprocal_length_c_esd ? _cell.pdbx_unique_axis ? # _symmetry.entry_id 4X0L _symmetry.cell_setting ? _symmetry.Int_Tables_number 152 _symmetry.space_group_name_Hall ? _symmetry.space_group_name_H-M 'P 31 2 1' _symmetry.pdbx_full_space_group_name_H-M ? # 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 'Hemoglobin subunit alpha' 15150.353 1 ? ? ? ? 2 polymer man 'Hemoglobin subunit beta' 15890.198 1 ? ? ? ? 3 polymer man Haptoglobin 28790.809 1 ? ? ? ? 4 non-polymer man 'PROTOPORPHYRIN IX CONTAINING FE' 616.487 2 ? ? ? ? 5 non-polymer man 'OXYGEN MOLECULE' 31.999 2 ? ? ? ? 6 non-polymer syn GLYCEROL 92.094 2 ? ? ? ? 7 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 1 ? ? ? ? 8 non-polymer man ALPHA-L-FUCOSE 164.156 1 ? ? ? ? 9 non-polymer syn 'SULFATE ION' 96.063 1 ? ? ? ? 10 non-polymer syn 'CACODYLATE ION' 136.989 1 ? ? ? ? 11 water nat water 18.015 217 ? ? ? ? # loop_ _entity_name_com.entity_id _entity_name_com.name 1 'Alpha-globin,Hemoglobin alpha chain' 2 'Beta-globin,Hemoglobin beta chain' 3 Zonulin # loop_ _entity_poly.entity_id _entity_poly.type _entity_poly.nstd_linkage _entity_poly.nstd_monomer _entity_poly.pdbx_seq_one_letter_code _entity_poly.pdbx_seq_one_letter_code_can _entity_poly.pdbx_strand_id _entity_poly.pdbx_target_identifier 1 'polypeptide(L)' no no ;VLSPADKTNVKAAWGKVGAHAGEYGAEALERMFLSFPTTKTYFPHFDLSHGSAQVKGHGKKVADALTNAVAHVDDMPNAL SALSDLHAHKLRVDPVNFKLLSHCLLVTLAAHLPAEFTPAVHASLDKFLASVSTVLTSKYR ; ;VLSPADKTNVKAAWGKVGAHAGEYGAEALERMFLSFPTTKTYFPHFDLSHGSAQVKGHGKKVADALTNAVAHVDDMPNAL SALSDLHAHKLRVDPVNFKLLSHCLLVTLAAHLPAEFTPAVHASLDKFLASVSTVLTSKYR ; A ? 2 'polypeptide(L)' no no ;VHLTPEEKSAVTALWGKVNVDEVGGEALGRLLVVYPWTQRFFESFGDLSTPDAVMGNPKVKAHGKKVLGAFSDGLAHLDN LKGTFATLSELHCDKLHVDPENFRLLGNVLVCVLAHHFGKEFTPPVQAAYQKVVAGVANALAHKYH ; ;VHLTPEEKSAVTALWGKVNVDEVGGEALGRLLVVYPWTQRFFESFGDLSTPDAVMGNPKVKAHGKKVLGAFSDGLAHLDN LKGTFATLSELHCDKLHVDPENFRLLGNVLVCVLAHHFGKEFTPPVQAAYQKVVAGVANALAHKYH ; B ? 3 'polypeptide(L)' no no ;VCGKPKNPANPVQRILGGHLDAKGSFPWQAKMVSHHNLTTGATLINEQWLLTTAKNLFLNHSENATAKDIAPTLTLYVGK KQLVEIEKVVLHPNYSQVDIGLIKLKQKVSVNERVMPICLPSKDYAEVGRVGYVSGWGRNANFKFTDHLKYVMLPVADQD QCIRHYEGSTVPEKKTPKSPVGVQPILNEHTFCAGMSKYQEDTCYGDAGSAFAVHDLEEDTWYATGILSFDKSCAVAEYG VYVKVTSIQDWVQKTIAEN ; ;VCGKPKNPANPVQRILGGHLDAKGSFPWQAKMVSHHNLTTGATLINEQWLLTTAKNLFLNHSENATAKDIAPTLTLYVGK KQLVEIEKVVLHPNYSQVDIGLIKLKQKVSVNERVMPICLPSKDYAEVGRVGYVSGWGRNANFKFTDHLKYVMLPVADQD QCIRHYEGSTVPEKKTPKSPVGVQPILNEHTFCAGMSKYQEDTCYGDAGSAFAVHDLEEDTWYATGILSFDKSCAVAEYG VYVKVTSIQDWVQKTIAEN ; C ? # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 VAL n 1 2 LEU n 1 3 SER n 1 4 PRO n 1 5 ALA n 1 6 ASP n 1 7 LYS n 1 8 THR n 1 9 ASN n 1 10 VAL n 1 11 LYS n 1 12 ALA n 1 13 ALA n 1 14 TRP n 1 15 GLY n 1 16 LYS n 1 17 VAL n 1 18 GLY n 1 19 ALA n 1 20 HIS n 1 21 ALA n 1 22 GLY n 1 23 GLU n 1 24 TYR n 1 25 GLY n 1 26 ALA n 1 27 GLU n 1 28 ALA n 1 29 LEU n 1 30 GLU n 1 31 ARG n 1 32 MET n 1 33 PHE n 1 34 LEU n 1 35 SER n 1 36 PHE n 1 37 PRO n 1 38 THR n 1 39 THR n 1 40 LYS n 1 41 THR n 1 42 TYR n 1 43 PHE n 1 44 PRO n 1 45 HIS n 1 46 PHE n 1 47 ASP n 1 48 LEU n 1 49 SER n 1 50 HIS n 1 51 GLY n 1 52 SER n 1 53 ALA n 1 54 GLN n 1 55 VAL n 1 56 LYS n 1 57 GLY n 1 58 HIS n 1 59 GLY n 1 60 LYS n 1 61 LYS n 1 62 VAL n 1 63 ALA n 1 64 ASP n 1 65 ALA n 1 66 LEU n 1 67 THR n 1 68 ASN n 1 69 ALA n 1 70 VAL n 1 71 ALA n 1 72 HIS n 1 73 VAL n 1 74 ASP n 1 75 ASP n 1 76 MET n 1 77 PRO n 1 78 ASN n 1 79 ALA n 1 80 LEU n 1 81 SER n 1 82 ALA n 1 83 LEU n 1 84 SER n 1 85 ASP n 1 86 LEU n 1 87 HIS n 1 88 ALA n 1 89 HIS n 1 90 LYS n 1 91 LEU n 1 92 ARG n 1 93 VAL n 1 94 ASP n 1 95 PRO n 1 96 VAL n 1 97 ASN n 1 98 PHE n 1 99 LYS n 1 100 LEU n 1 101 LEU n 1 102 SER n 1 103 HIS n 1 104 CYS n 1 105 LEU n 1 106 LEU n 1 107 VAL n 1 108 THR n 1 109 LEU n 1 110 ALA n 1 111 ALA n 1 112 HIS n 1 113 LEU n 1 114 PRO n 1 115 ALA n 1 116 GLU n 1 117 PHE n 1 118 THR n 1 119 PRO n 1 120 ALA n 1 121 VAL n 1 122 HIS n 1 123 ALA n 1 124 SER n 1 125 LEU n 1 126 ASP n 1 127 LYS n 1 128 PHE n 1 129 LEU n 1 130 ALA n 1 131 SER n 1 132 VAL n 1 133 SER n 1 134 THR n 1 135 VAL n 1 136 LEU n 1 137 THR n 1 138 SER n 1 139 LYS n 1 140 TYR n 1 141 ARG n 2 1 VAL n 2 2 HIS n 2 3 LEU n 2 4 THR n 2 5 PRO n 2 6 GLU n 2 7 GLU n 2 8 LYS n 2 9 SER n 2 10 ALA n 2 11 VAL n 2 12 THR n 2 13 ALA n 2 14 LEU n 2 15 TRP n 2 16 GLY n 2 17 LYS n 2 18 VAL n 2 19 ASN n 2 20 VAL n 2 21 ASP n 2 22 GLU n 2 23 VAL n 2 24 GLY n 2 25 GLY n 2 26 GLU n 2 27 ALA n 2 28 LEU n 2 29 GLY n 2 30 ARG n 2 31 LEU n 2 32 LEU n 2 33 VAL n 2 34 VAL n 2 35 TYR n 2 36 PRO n 2 37 TRP n 2 38 THR n 2 39 GLN n 2 40 ARG n 2 41 PHE n 2 42 PHE n 2 43 GLU n 2 44 SER n 2 45 PHE n 2 46 GLY n 2 47 ASP n 2 48 LEU n 2 49 SER n 2 50 THR n 2 51 PRO n 2 52 ASP n 2 53 ALA n 2 54 VAL n 2 55 MET n 2 56 GLY n 2 57 ASN n 2 58 PRO n 2 59 LYS n 2 60 VAL n 2 61 LYS n 2 62 ALA n 2 63 HIS n 2 64 GLY n 2 65 LYS n 2 66 LYS n 2 67 VAL n 2 68 LEU n 2 69 GLY n 2 70 ALA n 2 71 PHE n 2 72 SER n 2 73 ASP n 2 74 GLY n 2 75 LEU n 2 76 ALA n 2 77 HIS n 2 78 LEU n 2 79 ASP n 2 80 ASN n 2 81 LEU n 2 82 LYS n 2 83 GLY n 2 84 THR n 2 85 PHE n 2 86 ALA n 2 87 THR n 2 88 LEU n 2 89 SER n 2 90 GLU n 2 91 LEU n 2 92 HIS n 2 93 CYS n 2 94 ASP n 2 95 LYS n 2 96 LEU n 2 97 HIS n 2 98 VAL n 2 99 ASP n 2 100 PRO n 2 101 GLU n 2 102 ASN n 2 103 PHE n 2 104 ARG n 2 105 LEU n 2 106 LEU n 2 107 GLY n 2 108 ASN n 2 109 VAL n 2 110 LEU n 2 111 VAL n 2 112 CYS n 2 113 VAL n 2 114 LEU n 2 115 ALA n 2 116 HIS n 2 117 HIS n 2 118 PHE n 2 119 GLY n 2 120 LYS n 2 121 GLU n 2 122 PHE n 2 123 THR n 2 124 PRO n 2 125 PRO n 2 126 VAL n 2 127 GLN n 2 128 ALA n 2 129 ALA n 2 130 TYR n 2 131 GLN n 2 132 LYS n 2 133 VAL n 2 134 VAL n 2 135 ALA n 2 136 GLY n 2 137 VAL n 2 138 ALA n 2 139 ASN n 2 140 ALA n 2 141 LEU n 2 142 ALA n 2 143 HIS n 2 144 LYS n 2 145 TYR n 2 146 HIS n 3 1 VAL n 3 2 CYS n 3 3 GLY n 3 4 LYS n 3 5 PRO n 3 6 LYS n 3 7 ASN n 3 8 PRO n 3 9 ALA n 3 10 ASN n 3 11 PRO n 3 12 VAL n 3 13 GLN n 3 14 ARG n 3 15 ILE n 3 16 LEU n 3 17 GLY n 3 18 GLY n 3 19 HIS n 3 20 LEU n 3 21 ASP n 3 22 ALA n 3 23 LYS n 3 24 GLY n 3 25 SER n 3 26 PHE n 3 27 PRO n 3 28 TRP n 3 29 GLN n 3 30 ALA n 3 31 LYS n 3 32 MET n 3 33 VAL n 3 34 SER n 3 35 HIS n 3 36 HIS n 3 37 ASN n 3 38 LEU n 3 39 THR n 3 40 THR n 3 41 GLY n 3 42 ALA n 3 43 THR n 3 44 LEU n 3 45 ILE n 3 46 ASN n 3 47 GLU n 3 48 GLN n 3 49 TRP n 3 50 LEU n 3 51 LEU n 3 52 THR n 3 53 THR n 3 54 ALA n 3 55 LYS n 3 56 ASN n 3 57 LEU n 3 58 PHE n 3 59 LEU n 3 60 ASN n 3 61 HIS n 3 62 SER n 3 63 GLU n 3 64 ASN n 3 65 ALA n 3 66 THR n 3 67 ALA n 3 68 LYS n 3 69 ASP n 3 70 ILE n 3 71 ALA n 3 72 PRO n 3 73 THR n 3 74 LEU n 3 75 THR n 3 76 LEU n 3 77 TYR n 3 78 VAL n 3 79 GLY n 3 80 LYS n 3 81 LYS n 3 82 GLN n 3 83 LEU n 3 84 VAL n 3 85 GLU n 3 86 ILE n 3 87 GLU n 3 88 LYS n 3 89 VAL n 3 90 VAL n 3 91 LEU n 3 92 HIS n 3 93 PRO n 3 94 ASN n 3 95 TYR n 3 96 SER n 3 97 GLN n 3 98 VAL n 3 99 ASP n 3 100 ILE n 3 101 GLY n 3 102 LEU n 3 103 ILE n 3 104 LYS n 3 105 LEU n 3 106 LYS n 3 107 GLN n 3 108 LYS n 3 109 VAL n 3 110 SER n 3 111 VAL n 3 112 ASN n 3 113 GLU n 3 114 ARG n 3 115 VAL n 3 116 MET n 3 117 PRO n 3 118 ILE n 3 119 CYS n 3 120 LEU n 3 121 PRO n 3 122 SER n 3 123 LYS n 3 124 ASP n 3 125 TYR n 3 126 ALA n 3 127 GLU n 3 128 VAL n 3 129 GLY n 3 130 ARG n 3 131 VAL n 3 132 GLY n 3 133 TYR n 3 134 VAL n 3 135 SER n 3 136 GLY n 3 137 TRP n 3 138 GLY n 3 139 ARG n 3 140 ASN n 3 141 ALA n 3 142 ASN n 3 143 PHE n 3 144 LYS n 3 145 PHE n 3 146 THR n 3 147 ASP n 3 148 HIS n 3 149 LEU n 3 150 LYS n 3 151 TYR n 3 152 VAL n 3 153 MET n 3 154 LEU n 3 155 PRO n 3 156 VAL n 3 157 ALA n 3 158 ASP n 3 159 GLN n 3 160 ASP n 3 161 GLN n 3 162 CYS n 3 163 ILE n 3 164 ARG n 3 165 HIS n 3 166 TYR n 3 167 GLU n 3 168 GLY n 3 169 SER n 3 170 THR n 3 171 VAL n 3 172 PRO n 3 173 GLU n 3 174 LYS n 3 175 LYS n 3 176 THR n 3 177 PRO n 3 178 LYS n 3 179 SER n 3 180 PRO n 3 181 VAL n 3 182 GLY n 3 183 VAL n 3 184 GLN n 3 185 PRO n 3 186 ILE n 3 187 LEU n 3 188 ASN n 3 189 GLU n 3 190 HIS n 3 191 THR n 3 192 PHE n 3 193 CYS n 3 194 ALA n 3 195 GLY n 3 196 MET n 3 197 SER n 3 198 LYS n 3 199 TYR n 3 200 GLN n 3 201 GLU n 3 202 ASP n 3 203 THR n 3 204 CYS n 3 205 TYR n 3 206 GLY n 3 207 ASP n 3 208 ALA n 3 209 GLY n 3 210 SER n 3 211 ALA n 3 212 PHE n 3 213 ALA n 3 214 VAL n 3 215 HIS n 3 216 ASP n 3 217 LEU n 3 218 GLU n 3 219 GLU n 3 220 ASP n 3 221 THR n 3 222 TRP n 3 223 TYR n 3 224 ALA n 3 225 THR n 3 226 GLY n 3 227 ILE n 3 228 LEU n 3 229 SER n 3 230 PHE n 3 231 ASP n 3 232 LYS n 3 233 SER n 3 234 CYS n 3 235 ALA n 3 236 VAL n 3 237 ALA n 3 238 GLU n 3 239 TYR n 3 240 GLY n 3 241 VAL n 3 242 TYR n 3 243 VAL n 3 244 LYS n 3 245 VAL n 3 246 THR n 3 247 SER n 3 248 ILE n 3 249 GLN n 3 250 ASP n 3 251 TRP n 3 252 VAL n 3 253 GLN n 3 254 LYS n 3 255 THR n 3 256 ILE n 3 257 ALA n 3 258 GLU n 3 259 ASN n # loop_ _entity_src_gen.entity_id _entity_src_gen.pdbx_src_id _entity_src_gen.pdbx_alt_source_flag _entity_src_gen.pdbx_seq_type _entity_src_gen.pdbx_beg_seq_num _entity_src_gen.pdbx_end_seq_num _entity_src_gen.gene_src_common_name _entity_src_gen.gene_src_genus _entity_src_gen.pdbx_gene_src_gene _entity_src_gen.gene_src_species _entity_src_gen.gene_src_strain _entity_src_gen.gene_src_tissue _entity_src_gen.gene_src_tissue_fraction _entity_src_gen.gene_src_details _entity_src_gen.pdbx_gene_src_fragment _entity_src_gen.pdbx_gene_src_scientific_name _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id _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 _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id _entity_src_gen.host_org_genus _entity_src_gen.pdbx_host_org_gene _entity_src_gen.pdbx_host_org_organ _entity_src_gen.host_org_species _entity_src_gen.pdbx_host_org_tissue _entity_src_gen.pdbx_host_org_tissue_fraction _entity_src_gen.pdbx_host_org_strain _entity_src_gen.pdbx_host_org_variant _entity_src_gen.pdbx_host_org_cell_line _entity_src_gen.pdbx_host_org_atcc _entity_src_gen.pdbx_host_org_culture_collection _entity_src_gen.pdbx_host_org_cell _entity_src_gen.pdbx_host_org_organelle _entity_src_gen.pdbx_host_org_cellular_location _entity_src_gen.pdbx_host_org_vector_type _entity_src_gen.pdbx_host_org_vector _entity_src_gen.host_org_details _entity_src_gen.expression_system_id _entity_src_gen.plasmid_name _entity_src_gen.plasmid_details _entity_src_gen.pdbx_description 1 1 sample 'Biological sequence' 1 141 Human ? 'HBA1, HBA2' ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? human 'Homo sapiens' 9606 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 2 1 sample 'Biological sequence' 1 146 Human ? HBB ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? human 'Homo sapiens' 9606 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 3 1 sample 'Biological sequence' 1 259 Human ? HP ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? 'fall armyworm' 'Spodoptera frugiperda' 7108 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 4 1 sample ? ? ? human ? ? ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? human 'Homo sapiens' 9606 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? 5 1 sample ? ? ? human ? ? ? ? ? ? ? ? 'Homo sapiens' 9606 ? ? ? ? ? ? ? human 'Homo sapiens' 9606 ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? ? # loop_ _struct_ref.id _struct_ref.db_name _struct_ref.db_code _struct_ref.pdbx_db_accession _struct_ref.pdbx_db_isoform _struct_ref.entity_id _struct_ref.pdbx_seq_one_letter_code _struct_ref.pdbx_align_begin 1 UNP HBA_HUMAN P69905 ? 1 ;VLSPADKTNVKAAWGKVGAHAGEYGAEALERMFLSFPTTKTYFPHFDLSHGSAQVKGHGKKVADALTNAVAHVDDMPNAL SALSDLHAHKLRVDPVNFKLLSHCLLVTLAAHLPAEFTPAVHASLDKFLASVSTVLTSKYR ; 2 2 UNP HBB_HUMAN P68871 ? 2 ;VHLTPEEKSAVTALWGKVNVDEVGGEALGRLLVVYPWTQRFFESFGDLSTPDAVMGNPKVKAHGKKVLGAFSDGLAHLDN LKGTFATLSELHCDKLHVDPENFRLLGNVLVCVLAHHFGKEFTPPVQAAYQKVVAGVANALAHKYH ; 2 3 UNP HPT_HUMAN P00738 ? 3 ;VCGKPKNPANPVQRILGGHLDAKGSFPWQAKMVSHHNLTTGATLINEQWLLTTAKNLFLNHSENATAKDIAPTLTLYVGK KQLVEIEKVVLHPNYSQVDIGLIKLKQKVSVNERVMPICLPSKDYAEVGRVGYVSGWGRNANFKFTDHLKYVMLPVADQD QCIRHYEGSTVPEKKTPKSPVGVQPILNEHTFCAGMSKYQEDTCYGDAGSAFAVHDLEEDTWYATGILSFDKSCAVAEYG VYVKVTSIQDWVQKTIAEN ; 148 # 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 4X0L A 1 ? 141 ? P69905 2 ? 142 ? 2 142 2 2 4X0L B 1 ? 146 ? P68871 2 ? 147 ? 2 147 3 3 4X0L C 1 ? 259 ? P00738 148 ? 406 ? 148 406 # 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 CAC non-polymer . 'CACODYLATE ION' dimethylarsinate 'C2 H6 As O2 -1' 136.989 CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 FUC saccharide . ALPHA-L-FUCOSE ? 'C6 H12 O5' 164.156 GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 GOL non-polymer . GLYCEROL 'GLYCERIN; PROPANE-1,2,3-TRIOL' 'C3 H8 O3' 92.094 HEM non-polymer . 'PROTOPORPHYRIN IX CONTAINING FE' HEME 'C34 H32 Fe N4 O4' 616.487 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 OXY non-polymer . 'OXYGEN MOLECULE' ? O2 31.999 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 SO4 non-polymer . 'SULFATE ION' ? 'O4 S -2' 96.063 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 4X0L _exptl.crystals_number ? _exptl.details ? _exptl.method 'X-RAY DIFFRACTION' _exptl.method_details ? # _exptl_crystal.colour ? _exptl_crystal.density_diffrn ? _exptl_crystal.density_Matthews 2.92 _exptl_crystal.density_method ? _exptl_crystal.density_percent_sol 57.88 _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 ? _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 '0.2 M NaCl, 0.1 M sodium cacodylate pH 6.5 and 2 M ammonium sulphate' _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 PIXEL _diffrn_detector.diffrn_id 1 _diffrn_detector.type 'DECTRIS PILATUS 6M' _diffrn_detector.area_resol_mean ? _diffrn_detector.dtime ? _diffrn_detector.pdbx_frames_total ? _diffrn_detector.pdbx_collection_time_total ? _diffrn_detector.pdbx_collection_date 2013-01-31 # _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 0.916 _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 'DIAMOND BEAMLINE I04-1' _diffrn_source.voltage ? _diffrn_source.take-off_angle ? _diffrn_source.pdbx_wavelength_list 0.916 _diffrn_source.pdbx_wavelength ? _diffrn_source.pdbx_synchrotron_beamline I04-1 _diffrn_source.pdbx_synchrotron_site Diamond # _reflns.B_iso_Wilson_estimate ? _reflns.entry_id 4X0L _reflns.data_reduction_details ? _reflns.data_reduction_method ? _reflns.d_resolution_high 2.05 _reflns.d_resolution_low 39.93 _reflns.details ? _reflns.limit_h_max ? _reflns.limit_h_min ? _reflns.limit_k_max ? _reflns.limit_k_min ? _reflns.limit_l_max ? _reflns.limit_l_min ? _reflns.number_all ? _reflns.number_obs 43170 _reflns.observed_criterion ? _reflns.observed_criterion_F_max ? _reflns.observed_criterion_F_min ? _reflns.observed_criterion_I_max ? _reflns.observed_criterion_I_min ? _reflns.observed_criterion_sigma_F ? _reflns.observed_criterion_sigma_I ? _reflns.percent_possible_obs 99.8 _reflns.R_free_details ? _reflns.Rmerge_F_all ? _reflns.Rmerge_F_obs ? _reflns.Friedel_coverage ? _reflns.number_gt ? _reflns.threshold_expression ? _reflns.pdbx_redundancy 9.6 _reflns.pdbx_Rmerge_I_obs ? _reflns.pdbx_Rmerge_I_all ? _reflns.pdbx_Rsym_value ? _reflns.pdbx_netI_over_av_sigmaI ? _reflns.pdbx_netI_over_sigmaI 8.7 _reflns.pdbx_res_netI_over_av_sigmaI_2 ? _reflns.pdbx_res_netI_over_sigmaI_2 ? _reflns.pdbx_chi_squared ? _reflns.pdbx_scaling_rejects ? _reflns.pdbx_d_res_high_opt ? _reflns.pdbx_d_res_low_opt ? _reflns.pdbx_d_res_opt_method ? _reflns.phase_calculation_details ? _reflns.pdbx_Rrim_I_all ? _reflns.pdbx_Rpim_I_all ? _reflns.pdbx_d_opt ? _reflns.pdbx_number_measured_all ? _reflns.pdbx_diffrn_id 1 _reflns.pdbx_ordinal 1 _reflns.pdbx_CC_half ? _reflns.pdbx_R_split ? # _reflns_shell.Rmerge_F_all ? _reflns_shell.Rmerge_F_gt ? _reflns_shell.Rmerge_F_obs ? _reflns_shell.Rmerge_I_all ? _reflns_shell.Rmerge_I_gt ? _reflns_shell.Rmerge_I_obs 0.374 _reflns_shell.d_res_high 2.05 _reflns_shell.d_res_low 2.16 _reflns_shell.meanI_over_sigI_all ? _reflns_shell.meanI_over_sigI_gt ? _reflns_shell.meanI_over_sigI_obs 2.3 _reflns_shell.meanI_over_uI_all ? _reflns_shell.meanI_over_uI_gt ? _reflns_shell.number_measured_all ? _reflns_shell.number_measured_gt ? _reflns_shell.number_measured_obs ? _reflns_shell.number_possible ? _reflns_shell.number_unique_all ? _reflns_shell.number_unique_gt ? _reflns_shell.number_unique_obs ? _reflns_shell.pdbx_CC_half ? _reflns_shell.pdbx_R_split ? _reflns_shell.pdbx_Rpim_I_all ? _reflns_shell.pdbx_Rrim_I_all ? _reflns_shell.pdbx_Rsym_value ? _reflns_shell.pdbx_chi_squared ? _reflns_shell.pdbx_diffrn_id ? _reflns_shell.pdbx_netI_over_sigmaI_all ? _reflns_shell.pdbx_netI_over_sigmaI_obs ? _reflns_shell.pdbx_ordinal 1 _reflns_shell.pdbx_redundancy 10.2 _reflns_shell.pdbx_rejects ? _reflns_shell.percent_possible_all 100.0 _reflns_shell.percent_possible_gt ? _reflns_shell.percent_possible_obs ? # _refine.aniso_B[1][1] 0.08 _refine.aniso_B[1][2] 0.08 _refine.aniso_B[1][3] 0.00 _refine.aniso_B[2][2] 0.08 _refine.aniso_B[2][3] 0.00 _refine.aniso_B[3][3] -0.26 _refine.B_iso_max ? _refine.B_iso_mean 24.445 _refine.B_iso_min ? _refine.correlation_coeff_Fo_to_Fc 0.950 _refine.correlation_coeff_Fo_to_Fc_free 0.929 _refine.details 'HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS' _refine.diff_density_max ? _refine.diff_density_max_esd ? _refine.diff_density_min ? _refine.diff_density_min_esd ? _refine.diff_density_rms ? _refine.diff_density_rms_esd ? _refine.entry_id 4X0L _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.ls_abs_structure_details ? _refine.ls_abs_structure_Flack ? _refine.ls_abs_structure_Flack_esd ? _refine.ls_abs_structure_Rogers ? _refine.ls_abs_structure_Rogers_esd ? _refine.ls_d_res_high 2.05 _refine.ls_d_res_low 39.93 _refine.ls_extinction_coef ? _refine.ls_extinction_coef_esd ? _refine.ls_extinction_expression ? _refine.ls_extinction_method ? _refine.ls_goodness_of_fit_all ? _refine.ls_goodness_of_fit_all_esd ? _refine.ls_goodness_of_fit_obs ? _refine.ls_goodness_of_fit_obs_esd ? _refine.ls_hydrogen_treatment ? _refine.ls_matrix_type ? _refine.ls_number_constraints ? _refine.ls_number_parameters ? _refine.ls_number_reflns_all ? _refine.ls_number_reflns_obs 43170 _refine.ls_number_reflns_R_free 2295 _refine.ls_number_reflns_R_work ? _refine.ls_number_restraints ? _refine.ls_percent_reflns_obs 99.83 _refine.ls_percent_reflns_R_free 5.0 _refine.ls_R_factor_all ? _refine.ls_R_factor_obs 0.18200 _refine.ls_R_factor_R_free 0.22364 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_R_factor_R_work 0.17980 _refine.ls_R_Fsqd_factor_obs ? _refine.ls_R_I_factor_obs ? _refine.ls_redundancy_reflns_all ? _refine.ls_redundancy_reflns_obs ? _refine.ls_restrained_S_all ? _refine.ls_restrained_S_obs ? _refine.ls_shift_over_esd_max ? _refine.ls_shift_over_esd_mean ? _refine.ls_structure_factor_coef ? _refine.ls_weighting_details ? _refine.ls_weighting_scheme ? _refine.ls_wR_factor_all ? _refine.ls_wR_factor_obs ? _refine.ls_wR_factor_R_free ? _refine.ls_wR_factor_R_work ? _refine.occupancy_max ? _refine.occupancy_min ? _refine.solvent_model_details MASK _refine.solvent_model_param_bsol ? _refine.solvent_model_param_ksol ? _refine.ls_R_factor_gt ? _refine.ls_goodness_of_fit_gt ? _refine.ls_goodness_of_fit_ref ? _refine.ls_shift_over_su_max ? _refine.ls_shift_over_su_max_lt ? _refine.ls_shift_over_su_mean ? _refine.ls_shift_over_su_mean_lt ? _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F ? _refine.pdbx_ls_sigma_Fsqd ? _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_isotropic_thermal_model ? _refine.pdbx_ls_cross_valid_method THROUGHOUT _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_starting_model 4F4O _refine.pdbx_stereochemistry_target_values 'MAXIMUM LIKELIHOOD' _refine.pdbx_R_Free_selection_details RANDOM _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_overall_ESU_R 0.160 _refine.pdbx_overall_ESU_R_Free 0.152 _refine.pdbx_solvent_vdw_probe_radii 1.20 _refine.pdbx_solvent_ion_probe_radii 0.80 _refine.pdbx_solvent_shrinkage_radii 0.80 _refine.pdbx_real_space_R ? _refine.pdbx_density_correlation ? _refine.pdbx_pd_number_of_powder_patterns ? _refine.pdbx_pd_number_of_points ? _refine.pdbx_pd_meas_number_of_points ? _refine.pdbx_pd_proc_ls_prof_R_factor ? _refine.pdbx_pd_proc_ls_prof_wR_factor ? _refine.pdbx_pd_Marquardt_correlation_coeff ? _refine.pdbx_pd_Fsqrd_R_factor ? _refine.pdbx_pd_ls_matrix_band_width ? _refine.pdbx_overall_phase_error ? _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_TLS_residual_ADP_flag ? _refine.pdbx_diffrn_id 1 _refine.overall_SU_B 3.800 _refine.overall_SU_ML 0.103 _refine.overall_SU_R_Cruickshank_DPI ? _refine.overall_SU_R_free ? _refine.overall_FOM_free_R_set ? _refine.overall_FOM_work_R_set ? _refine.pdbx_average_fsc_overall ? _refine.pdbx_average_fsc_work ? _refine.pdbx_average_fsc_free ? # _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.cycle_id 1 _refine_hist.pdbx_number_atoms_protein 4298 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 36 _refine_hist.number_atoms_solvent 217 _refine_hist.number_atoms_total 4551 _refine_hist.d_res_high 2.05 _refine_hist.d_res_low 39.93 # loop_ _refine_ls_restr.pdbx_refine_id _refine_ls_restr.criterion _refine_ls_restr.dev_ideal _refine_ls_restr.dev_ideal_target _refine_ls_restr.number _refine_ls_restr.rejects _refine_ls_restr.type _refine_ls_restr.weight _refine_ls_restr.pdbx_restraint_function 'X-RAY DIFFRACTION' ? 0.020 0.019 4453 ? r_bond_refined_d ? ? 'X-RAY DIFFRACTION' ? 0.002 0.020 4225 ? r_bond_other_d ? ? 'X-RAY DIFFRACTION' ? 1.990 1.985 6082 ? r_angle_refined_deg ? ? 'X-RAY DIFFRACTION' ? 0.933 3.001 9710 ? r_angle_other_deg ? ? 'X-RAY DIFFRACTION' ? 6.671 5.000 541 ? r_dihedral_angle_1_deg ? ? 'X-RAY DIFFRACTION' ? 36.897 24.607 178 ? r_dihedral_angle_2_deg ? ? 'X-RAY DIFFRACTION' ? 15.298 15.000 702 ? r_dihedral_angle_3_deg ? ? 'X-RAY DIFFRACTION' ? 13.724 15.000 11 ? r_dihedral_angle_4_deg ? ? 'X-RAY DIFFRACTION' ? 0.140 0.200 678 ? r_chiral_restr ? ? 'X-RAY DIFFRACTION' ? 0.010 0.021 4991 ? r_gen_planes_refined ? ? 'X-RAY DIFFRACTION' ? 0.004 0.020 1010 ? r_gen_planes_other ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_nbd_refined ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_nbd_other ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_nbtor_refined ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_nbtor_other ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_xyhbond_nbd_refined ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_xyhbond_nbd_other ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_metal_ion_refined ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_metal_ion_other ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_symmetry_vdw_refined ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_symmetry_vdw_other ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_symmetry_hbond_refined ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_symmetry_hbond_other ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_symmetry_metal_ion_refined ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_symmetry_metal_ion_other ? ? 'X-RAY DIFFRACTION' ? 2.060 2.175 2173 ? r_mcbond_it ? ? 'X-RAY DIFFRACTION' ? 2.045 2.174 2172 ? r_mcbond_other ? ? 'X-RAY DIFFRACTION' ? 2.832 3.248 2711 ? r_mcangle_it ? ? 'X-RAY DIFFRACTION' ? 2.832 3.249 2712 ? r_mcangle_other ? ? 'X-RAY DIFFRACTION' ? 3.276 2.563 2276 ? r_scbond_it ? ? 'X-RAY DIFFRACTION' ? 3.275 2.568 2277 ? r_scbond_other ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_scangle_it ? ? 'X-RAY DIFFRACTION' ? 5.053 3.690 3368 ? r_scangle_other ? ? 'X-RAY DIFFRACTION' ? 8.053 18.590 5228 ? r_long_range_B_refined ? ? 'X-RAY DIFFRACTION' ? 8.053 18.501 5176 ? r_long_range_B_other ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_rigid_bond_restr ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_sphericity_free ? ? 'X-RAY DIFFRACTION' ? ? ? ? ? r_sphericity_bonded ? ? # _refine_ls_shell.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_ls_shell.d_res_high 2.050 _refine_ls_shell.d_res_low 2.103 _refine_ls_shell.number_reflns_all ? _refine_ls_shell.number_reflns_obs ? _refine_ls_shell.number_reflns_R_free 178 _refine_ls_shell.number_reflns_R_work 3137 _refine_ls_shell.percent_reflns_obs 100.00 _refine_ls_shell.percent_reflns_R_free ? _refine_ls_shell.R_factor_all ? _refine_ls_shell.R_factor_obs ? _refine_ls_shell.R_factor_R_free 0.301 _refine_ls_shell.R_factor_R_free_error ? _refine_ls_shell.R_factor_R_work 0.243 _refine_ls_shell.redundancy_reflns_all ? _refine_ls_shell.redundancy_reflns_obs ? _refine_ls_shell.wR_factor_all ? _refine_ls_shell.wR_factor_obs ? _refine_ls_shell.wR_factor_R_free ? _refine_ls_shell.wR_factor_R_work ? _refine_ls_shell.pdbx_total_number_of_bins_used 20 _refine_ls_shell.pdbx_phase_error ? _refine_ls_shell.pdbx_fsc_work ? _refine_ls_shell.pdbx_fsc_free ? # _struct.entry_id 4X0L _struct.title 'Human haptoglobin-haemoglobin complex' _struct.pdbx_descriptor 'Human haemoglobin alpha subunit, Human haemoglobin beta subunit, Human haptoglobin' _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 4X0L _struct_keywords.text 'Haptoglobin-haemoglobin complex, oxygen transport' _struct_keywords.pdbx_keywords 'OXYGEN TRANSPORT' # loop_ _struct_asym.id _struct_asym.pdbx_blank_PDB_chainid_flag _struct_asym.pdbx_modified _struct_asym.entity_id _struct_asym.details A N N 1 ? B N N 2 ? C N N 3 ? D N N 4 ? E N N 5 ? F N N 4 ? G N N 5 ? H N N 6 ? I N N 7 ? J N N 8 ? K N N 9 ? L N N 6 ? M N N 10 ? N N N 11 ? O N N 11 ? P N N 11 ? # loop_ _struct_conf.conf_type_id _struct_conf.id _struct_conf.pdbx_PDB_helix_id _struct_conf.beg_label_comp_id _struct_conf.beg_label_asym_id _struct_conf.beg_label_seq_id _struct_conf.pdbx_beg_PDB_ins_code _struct_conf.end_label_comp_id _struct_conf.end_label_asym_id _struct_conf.end_label_seq_id _struct_conf.pdbx_end_PDB_ins_code _struct_conf.beg_auth_comp_id _struct_conf.beg_auth_asym_id _struct_conf.beg_auth_seq_id _struct_conf.end_auth_comp_id _struct_conf.end_auth_asym_id _struct_conf.end_auth_seq_id _struct_conf.pdbx_PDB_helix_class _struct_conf.details _struct_conf.pdbx_PDB_helix_length HELX_P HELX_P1 AA1 SER A 3 ? GLY A 18 ? SER A 4 GLY A 19 1 ? 16 HELX_P HELX_P2 AA2 HIS A 20 ? PHE A 36 ? HIS A 21 PHE A 37 1 ? 17 HELX_P HELX_P3 AA3 PRO A 37 ? PHE A 43 ? PRO A 38 PHE A 44 5 ? 7 HELX_P HELX_P4 AA4 SER A 52 ? HIS A 72 ? SER A 53 HIS A 73 1 ? 21 HELX_P HELX_P5 AA5 ASP A 75 ? LEU A 80 ? ASP A 76 LEU A 81 1 ? 6 HELX_P HELX_P6 AA6 LEU A 80 ? HIS A 89 ? LEU A 81 HIS A 90 1 ? 10 HELX_P HELX_P7 AA7 PRO A 95 ? LEU A 113 ? PRO A 96 LEU A 114 1 ? 19 HELX_P HELX_P8 AA8 THR A 118 ? LEU A 136 ? THR A 119 LEU A 137 1 ? 19 HELX_P HELX_P9 AA9 THR B 4 ? GLY B 16 ? THR B 5 GLY B 17 1 ? 13 HELX_P HELX_P10 AB1 GLU B 22 ? TYR B 35 ? GLU B 23 TYR B 36 1 ? 14 HELX_P HELX_P11 AB2 PRO B 36 ? GLY B 46 ? PRO B 37 GLY B 47 5 ? 11 HELX_P HELX_P12 AB3 THR B 50 ? ASN B 57 ? THR B 51 ASN B 58 1 ? 8 HELX_P HELX_P13 AB4 ASN B 57 ? ALA B 76 ? ASN B 58 ALA B 77 1 ? 20 HELX_P HELX_P14 AB5 ASN B 80 ? LYS B 95 ? ASN B 81 LYS B 96 1 ? 16 HELX_P HELX_P15 AB6 PRO B 100 ? GLY B 119 ? PRO B 101 GLY B 120 1 ? 20 HELX_P HELX_P16 AB7 LYS B 120 ? PHE B 122 ? LYS B 121 PHE B 123 5 ? 3 HELX_P HELX_P17 AB8 THR B 123 ? ALA B 142 ? THR B 124 ALA B 143 1 ? 20 HELX_P HELX_P18 AB9 THR C 53 ? PHE C 58 ? THR C 200 PHE C 205 1 ? 6 HELX_P HELX_P19 AC1 THR C 66 ? ALA C 71 ? THR C 213 ALA C 218 1 ? 6 HELX_P HELX_P20 AC2 PRO C 72 ? LEU C 74 ? PRO C 219 LEU C 221 5 ? 3 HELX_P HELX_P21 AC3 ASP C 158 ? GLY C 168 ? ASP C 305 GLY C 315 1 ? 11 HELX_P HELX_P22 AC4 VAL C 171 ? LYS C 175 ? VAL C 318 LYS C 322 5 ? 5 HELX_P HELX_P23 AC5 ILE C 248 ? ASN C 259 ? ILE C 395 ASN C 406 1 ? 12 # _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 ? ? C CYS 2 SG ? ? ? 1_555 C CYS 119 SG ? ? C CYS 149 C CYS 266 1_555 ? ? ? ? ? ? ? 2.124 ? disulf2 disulf ? ? C CYS 162 SG ? ? ? 1_555 C CYS 193 SG ? ? C CYS 309 C CYS 340 1_555 ? ? ? ? ? ? ? 2.040 ? disulf3 disulf ? ? C CYS 204 SG ? ? ? 1_555 C CYS 234 SG ? ? C CYS 351 C CYS 381 1_555 ? ? ? ? ? ? ? 2.035 ? metalc1 metalc ? ? A HIS 87 NE2 ? ? ? 1_555 D HEM . FE ? ? A HIS 88 A HEM 201 1_555 ? ? ? ? ? ? ? 2.141 ? metalc2 metalc ? ? B HIS 92 NE2 ? ? ? 1_555 F HEM . FE ? ? B HIS 93 B HEM 201 1_555 ? ? ? ? ? ? ? 2.092 ? covale1 covale one ? C ASN 94 ND2 ? ? ? 1_555 I NAG . C1 ? ? C ASN 241 C NAG 501 1_555 ? ? ? ? ? ? ? 1.432 ? metalc3 metalc ? ? D HEM . FE ? ? ? 1_555 E OXY . O1 ? ? A HEM 201 A OXY 202 1_555 ? ? ? ? ? ? ? 2.029 ? metalc4 metalc ? ? D HEM . FE ? ? ? 1_555 E OXY . O2 ? ? A HEM 201 A OXY 202 1_555 ? ? ? ? ? ? ? 2.652 ? metalc5 metalc ? ? F HEM . FE ? ? ? 1_555 G OXY . O2 ? ? B HEM 201 B OXY 202 1_555 ? ? ? ? ? ? ? 2.463 ? covale2 covale one ? I NAG . O6 ? ? ? 1_555 J FUC . C1 ? ? C NAG 501 C FUC 502 1_555 ? ? ? ? ? ? ? 1.441 ? # loop_ _struct_conn_type.id _struct_conn_type.criteria _struct_conn_type.reference disulf ? ? metalc ? ? covale ? ? # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details AA1 ? 7 ? AA2 ? 7 ? # loop_ _struct_sheet_order.sheet_id _struct_sheet_order.range_id_1 _struct_sheet_order.range_id_2 _struct_sheet_order.offset _struct_sheet_order.sense AA1 1 2 ? anti-parallel AA1 2 3 ? anti-parallel AA1 3 4 ? anti-parallel AA1 4 5 ? anti-parallel AA1 5 6 ? anti-parallel AA1 6 7 ? anti-parallel AA2 1 2 ? anti-parallel AA2 2 3 ? anti-parallel AA2 3 4 ? anti-parallel AA2 4 5 ? anti-parallel AA2 5 6 ? anti-parallel AA2 6 7 ? anti-parallel # loop_ _struct_sheet_range.sheet_id _struct_sheet_range.id _struct_sheet_range.beg_label_comp_id _struct_sheet_range.beg_label_asym_id _struct_sheet_range.beg_label_seq_id _struct_sheet_range.pdbx_beg_PDB_ins_code _struct_sheet_range.end_label_comp_id _struct_sheet_range.end_label_asym_id _struct_sheet_range.end_label_seq_id _struct_sheet_range.pdbx_end_PDB_ins_code _struct_sheet_range.beg_auth_comp_id _struct_sheet_range.beg_auth_asym_id _struct_sheet_range.beg_auth_seq_id _struct_sheet_range.end_auth_comp_id _struct_sheet_range.end_auth_asym_id _struct_sheet_range.end_auth_seq_id AA1 1 GLY C 17 ? LEU C 20 ? GLY C 164 LEU C 167 AA1 2 LYS C 150 ? PRO C 155 ? LYS C 297 PRO C 302 AA1 3 VAL C 131 ? GLY C 136 ? VAL C 278 GLY C 283 AA1 4 ALA C 211 ? ASP C 216 ? ALA C 358 ASP C 363 AA1 5 THR C 221 ? PHE C 230 ? THR C 368 PHE C 377 AA1 6 GLY C 240 ? LYS C 244 ? GLY C 387 LYS C 391 AA1 7 THR C 191 ? ALA C 194 ? THR C 338 ALA C 341 AA2 1 GLN C 82 ? VAL C 84 ? GLN C 229 VAL C 231 AA2 2 THR C 75 ? VAL C 78 ? THR C 222 VAL C 225 AA2 3 GLN C 29 ? VAL C 33 ? GLN C 176 VAL C 180 AA2 4 THR C 39 ? ASN C 46 ? THR C 186 ASN C 193 AA2 5 TRP C 49 ? THR C 52 ? TRP C 196 THR C 199 AA2 6 GLY C 101 ? LEU C 105 ? GLY C 248 LEU C 252 AA2 7 ILE C 86 ? LEU C 91 ? ILE C 233 LEU C 238 # loop_ _pdbx_struct_sheet_hbond.sheet_id _pdbx_struct_sheet_hbond.range_id_1 _pdbx_struct_sheet_hbond.range_id_2 _pdbx_struct_sheet_hbond.range_1_label_atom_id _pdbx_struct_sheet_hbond.range_1_label_comp_id _pdbx_struct_sheet_hbond.range_1_label_asym_id _pdbx_struct_sheet_hbond.range_1_label_seq_id _pdbx_struct_sheet_hbond.range_1_PDB_ins_code _pdbx_struct_sheet_hbond.range_1_auth_atom_id _pdbx_struct_sheet_hbond.range_1_auth_comp_id _pdbx_struct_sheet_hbond.range_1_auth_asym_id _pdbx_struct_sheet_hbond.range_1_auth_seq_id _pdbx_struct_sheet_hbond.range_2_label_atom_id _pdbx_struct_sheet_hbond.range_2_label_comp_id _pdbx_struct_sheet_hbond.range_2_label_asym_id _pdbx_struct_sheet_hbond.range_2_label_seq_id _pdbx_struct_sheet_hbond.range_2_PDB_ins_code _pdbx_struct_sheet_hbond.range_2_auth_atom_id _pdbx_struct_sheet_hbond.range_2_auth_comp_id _pdbx_struct_sheet_hbond.range_2_auth_asym_id _pdbx_struct_sheet_hbond.range_2_auth_seq_id AA1 1 2 N HIS C 19 ? N HIS C 166 O TYR C 151 ? O TYR C 298 AA1 2 3 O VAL C 152 ? O VAL C 299 N VAL C 134 ? N VAL C 281 AA1 3 4 N TYR C 133 ? N TYR C 280 O ALA C 213 ? O ALA C 360 AA1 4 5 N VAL C 214 ? N VAL C 361 O TYR C 223 ? O TYR C 370 AA1 5 6 N SER C 229 ? N SER C 376 O VAL C 241 ? O VAL C 388 AA1 6 7 O TYR C 242 ? O TYR C 389 N PHE C 192 ? N PHE C 339 AA2 1 2 O GLN C 82 ? O GLN C 229 N VAL C 78 ? N VAL C 225 AA2 2 3 O THR C 75 ? O THR C 222 N VAL C 33 ? N VAL C 180 AA2 3 4 N MET C 32 ? N MET C 179 O THR C 40 ? O THR C 187 AA2 4 5 N THR C 43 ? N THR C 190 O LEU C 51 ? O LEU C 198 AA2 5 6 N LEU C 50 ? N LEU C 197 O ILE C 103 ? O ILE C 250 AA2 6 7 O LYS C 104 ? O LYS C 251 N LYS C 88 ? N LYS C 235 # 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 HEM 201 ? 13 'binding site for residue HEM A 201' AC2 Software A OXY 202 ? 3 'binding site for residue OXY A 202' AC3 Software B HEM 201 ? 11 'binding site for residue HEM B 201' AC4 Software B OXY 202 ? 4 'binding site for residue OXY B 202' AC5 Software B GOL 203 ? 9 'binding site for residue GOL B 203' AC6 Software C SO4 503 ? 9 'binding site for residue SO4 C 503' AC7 Software C GOL 504 ? 7 'binding site for residue GOL C 504' AC8 Software C CAC 505 ? 7 'binding site for residue CAC C 505' AC9 Software C ASN 241 ? 8 'binding site for Poly-Saccharide residues NAG C 501 through FUC C 502 bound to ASN C 241' # 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 13 TYR A 42 ? TYR A 43 . ? 1_555 ? 2 AC1 13 PHE A 43 ? PHE A 44 . ? 1_555 ? 3 AC1 13 HIS A 45 ? HIS A 46 . ? 1_555 ? 4 AC1 13 HIS A 58 ? HIS A 59 . ? 1_555 ? 5 AC1 13 LYS A 61 ? LYS A 62 . ? 1_555 ? 6 AC1 13 LEU A 83 ? LEU A 84 . ? 1_555 ? 7 AC1 13 HIS A 87 ? HIS A 88 . ? 1_555 ? 8 AC1 13 LEU A 91 ? LEU A 92 . ? 1_555 ? 9 AC1 13 VAL A 93 ? VAL A 94 . ? 1_555 ? 10 AC1 13 ASN A 97 ? ASN A 98 . ? 1_555 ? 11 AC1 13 PHE A 98 ? PHE A 99 . ? 1_555 ? 12 AC1 13 LEU A 101 ? LEU A 102 . ? 1_555 ? 13 AC1 13 OXY E . ? OXY A 202 . ? 1_555 ? 14 AC2 3 HIS A 58 ? HIS A 59 . ? 1_555 ? 15 AC2 3 VAL A 62 ? VAL A 63 . ? 1_555 ? 16 AC2 3 HEM D . ? HEM A 201 . ? 1_555 ? 17 AC3 11 PHE B 41 ? PHE B 42 . ? 1_555 ? 18 AC3 11 PHE B 42 ? PHE B 43 . ? 1_555 ? 19 AC3 11 HIS B 63 ? HIS B 64 . ? 1_555 ? 20 AC3 11 LYS B 66 ? LYS B 67 . ? 1_555 ? 21 AC3 11 PHE B 71 ? PHE B 72 . ? 1_555 ? 22 AC3 11 HIS B 92 ? HIS B 93 . ? 1_555 ? 23 AC3 11 LEU B 96 ? LEU B 97 . ? 1_555 ? 24 AC3 11 ASN B 102 ? ASN B 103 . ? 1_555 ? 25 AC3 11 PHE B 103 ? PHE B 104 . ? 1_555 ? 26 AC3 11 LEU B 141 ? LEU B 142 . ? 1_555 ? 27 AC3 11 OXY G . ? OXY B 202 . ? 1_555 ? 28 AC4 4 HIS B 63 ? HIS B 64 . ? 1_555 ? 29 AC4 4 VAL B 67 ? VAL B 68 . ? 1_555 ? 30 AC4 4 HIS B 92 ? HIS B 93 . ? 1_555 ? 31 AC4 4 HEM F . ? HEM B 201 . ? 1_555 ? 32 AC5 9 ARG B 40 ? ARG B 41 . ? 1_555 ? 33 AC5 9 PHE B 41 ? PHE B 42 . ? 1_555 ? 34 AC5 9 LEU B 96 ? LEU B 97 . ? 1_555 ? 35 AC5 9 HIS B 97 ? HIS B 98 . ? 1_555 ? 36 AC5 9 HOH O . ? HOH B 302 . ? 1_555 ? 37 AC5 9 HOH O . ? HOH B 310 . ? 1_555 ? 38 AC5 9 VAL C 12 ? VAL C 159 . ? 1_555 ? 39 AC5 9 GLN C 13 ? GLN C 160 . ? 1_555 ? 40 AC5 9 SO4 K . ? SO4 C 503 . ? 1_555 ? 41 AC6 9 ARG B 40 ? ARG B 41 . ? 1_555 ? 42 AC6 9 HIS B 97 ? HIS B 98 . ? 1_555 ? 43 AC6 9 GOL H . ? GOL B 203 . ? 1_555 ? 44 AC6 9 HOH O . ? HOH B 309 . ? 1_555 ? 45 AC6 9 PRO C 11 ? PRO C 158 . ? 1_555 ? 46 AC6 9 VAL C 12 ? VAL C 159 . ? 1_555 ? 47 AC6 9 GLN C 13 ? GLN C 160 . ? 1_555 ? 48 AC6 9 HIS C 19 ? HIS C 166 . ? 1_555 ? 49 AC6 9 HOH P . ? HOH C 682 . ? 1_555 ? 50 AC7 7 HIS A 45 ? HIS A 46 . ? 3_654 ? 51 AC7 7 ASP A 47 ? ASP A 48 . ? 3_654 ? 52 AC7 7 GLN A 54 ? GLN A 55 . ? 3_654 ? 53 AC7 7 PRO C 93 ? PRO C 240 . ? 1_555 ? 54 AC7 7 ASN C 94 ? ASN C 241 . ? 1_555 ? 55 AC7 7 TYR C 95 ? TYR C 242 . ? 1_555 ? 56 AC7 7 SER C 96 ? SER C 243 . ? 1_555 ? 57 AC8 7 MET C 196 ? MET C 343 . ? 1_555 ? 58 AC8 7 SER C 197 ? SER C 344 . ? 1_555 ? 59 AC8 7 SER C 197 ? SER C 344 . ? 5_554 ? 60 AC8 7 GLU C 238 ? GLU C 385 . ? 1_555 ? 61 AC8 7 GLU C 238 ? GLU C 385 . ? 5_554 ? 62 AC8 7 TYR C 239 ? TYR C 386 . ? 1_555 ? 63 AC8 7 HOH P . ? HOH C 615 . ? 5_554 ? 64 AC9 8 PRO A 44 ? PRO A 45 . ? 3_654 ? 65 AC9 8 HIS A 45 ? HIS A 46 . ? 3_654 ? 66 AC9 8 HOH N . ? HOH A 301 . ? 3_654 ? 67 AC9 8 HIS C 92 ? HIS C 239 . ? 1_555 ? 68 AC9 8 ASN C 94 ? ASN C 241 . ? 1_555 ? 69 AC9 8 HOH P . ? HOH C 606 . ? 1_555 ? 70 AC9 8 HOH P . ? HOH C 607 . ? 1_555 ? 71 AC9 8 HOH P . ? HOH C 639 . ? 1_555 ? # _atom_sites.entry_id 4X0L _atom_sites.fract_transf_matrix[1][1] 0.010352 _atom_sites.fract_transf_matrix[1][2] 0.005977 _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] 0.011954 _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] 0.007532 _atom_sites.fract_transf_vector[1] 0.00000 _atom_sites.fract_transf_vector[2] 0.00000 _atom_sites.fract_transf_vector[3] 0.00000 # loop_ _atom_type.symbol AS C FE 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 . VAL A 1 1 ? 43.835 -6.066 -12.978 1.00 19.69 ? 2 VAL A N 1 ATOM 2 C CA . VAL A 1 1 ? 45.295 -5.940 -12.740 1.00 22.51 ? 2 VAL A CA 1 ATOM 3 C C . VAL A 1 1 ? 45.454 -4.716 -11.792 1.00 22.88 ? 2 VAL A C 1 ATOM 4 O O . VAL A 1 1 ? 44.567 -3.886 -11.677 1.00 22.77 ? 2 VAL A O 1 ATOM 5 C CB . VAL A 1 1 ? 46.124 -5.822 -14.057 1.00 24.94 ? 2 VAL A CB 1 ATOM 6 C CG1 . VAL A 1 1 ? 45.513 -6.626 -15.185 1.00 24.27 ? 2 VAL A CG1 1 ATOM 7 C CG2 . VAL A 1 1 ? 46.269 -4.391 -14.556 1.00 26.41 ? 2 VAL A CG2 1 ATOM 8 N N . LEU A 1 2 ? 46.521 -4.689 -11.033 1.00 23.53 ? 3 LEU A N 1 ATOM 9 C CA . LEU A 1 2 ? 46.734 -3.631 -10.036 1.00 23.24 ? 3 LEU A CA 1 ATOM 10 C C . LEU A 1 2 ? 47.165 -2.368 -10.788 1.00 20.83 ? 3 LEU A C 1 ATOM 11 O O . LEU A 1 2 ? 47.927 -2.450 -11.707 1.00 21.22 ? 3 LEU A O 1 ATOM 12 C CB . LEU A 1 2 ? 47.845 -4.044 -9.076 1.00 25.67 ? 3 LEU A CB 1 ATOM 13 C CG . LEU A 1 2 ? 47.633 -5.233 -8.123 1.00 33.10 ? 3 LEU A CG 1 ATOM 14 C CD1 . LEU A 1 2 ? 48.783 -5.348 -7.145 1.00 33.85 ? 3 LEU A CD1 1 ATOM 15 C CD2 . LEU A 1 2 ? 46.398 -5.011 -7.312 1.00 35.05 ? 3 LEU A CD2 1 ATOM 16 N N . SER A 1 3 ? 46.627 -1.240 -10.416 1.00 20.01 ? 4 SER A N 1 ATOM 17 C CA . SER A 1 3 ? 47.157 0.014 -10.859 1.00 21.06 ? 4 SER A CA 1 ATOM 18 C C . SER A 1 3 ? 48.534 0.340 -10.250 1.00 23.42 ? 4 SER A C 1 ATOM 19 O O . SER A 1 3 ? 48.955 -0.233 -9.219 1.00 21.15 ? 4 SER A O 1 ATOM 20 C CB . SER A 1 3 ? 46.175 1.125 -10.456 1.00 22.56 ? 4 SER A CB 1 ATOM 21 O OG . SER A 1 3 ? 46.243 1.445 -9.079 1.00 22.63 ? 4 SER A OG 1 ATOM 22 N N . PRO A 1 4 ? 49.242 1.295 -10.880 1.00 25.00 ? 5 PRO A N 1 ATOM 23 C CA . PRO A 1 4 ? 50.495 1.805 -10.381 1.00 21.37 ? 5 PRO A CA 1 ATOM 24 C C . PRO A 1 4 ? 50.370 2.217 -8.953 1.00 20.97 ? 5 PRO A C 1 ATOM 25 O O . PRO A 1 4 ? 51.205 1.818 -8.156 1.00 22.40 ? 5 PRO A O 1 ATOM 26 C CB . PRO A 1 4 ? 50.778 2.958 -11.310 1.00 23.30 ? 5 PRO A CB 1 ATOM 27 C CG . PRO A 1 4 ? 50.221 2.443 -12.625 1.00 24.44 ? 5 PRO A CG 1 ATOM 28 C CD . PRO A 1 4 ? 48.968 1.744 -12.259 1.00 23.14 ? 5 PRO A CD 1 ATOM 29 N N . ALA A 1 5 ? 49.282 2.890 -8.608 1.00 20.55 ? 6 ALA A N 1 ATOM 30 C CA . ALA A 1 5 ? 49.051 3.377 -7.271 1.00 21.93 ? 6 ALA A CA 1 ATOM 31 C C . ALA A 1 5 ? 48.860 2.210 -6.311 1.00 23.01 ? 6 ALA A C 1 ATOM 32 O O . ALA A 1 5 ? 49.316 2.244 -5.203 1.00 22.30 ? 6 ALA A O 1 ATOM 33 C CB . ALA A 1 5 ? 47.817 4.290 -7.247 1.00 23.85 ? 6 ALA A CB 1 ATOM 34 N N . ASP A 1 6 ? 48.152 1.173 -6.726 1.00 21.77 ? 7 ASP A N 1 ATOM 35 C CA . ASP A 1 6 ? 48.091 -0.001 -5.870 1.00 21.97 ? 7 ASP A CA 1 ATOM 36 C C . ASP A 1 6 ? 49.425 -0.619 -5.625 1.00 17.41 ? 7 ASP A C 1 ATOM 37 O O . ASP A 1 6 ? 49.745 -1.070 -4.519 1.00 18.79 ? 7 ASP A O 1 ATOM 38 C CB . ASP A 1 6 ? 47.251 -1.084 -6.528 1.00 22.51 ? 7 ASP A CB 1 ATOM 39 C CG . ASP A 1 6 ? 45.775 -0.738 -6.563 1.00 23.48 ? 7 ASP A CG 1 ATOM 40 O OD1 . ASP A 1 6 ? 45.192 -0.292 -5.585 1.00 24.09 ? 7 ASP A OD1 1 ATOM 41 O OD2 . ASP A 1 6 ? 45.189 -1.040 -7.590 1.00 27.51 ? 7 ASP A OD2 1 ATOM 42 N N . LYS A 1 7 ? 50.182 -0.797 -6.666 1.00 15.79 ? 8 LYS A N 1 ATOM 43 C CA . LYS A 1 7 ? 51.474 -1.403 -6.506 1.00 15.84 ? 8 LYS A CA 1 ATOM 44 C C . LYS A 1 7 ? 52.352 -0.639 -5.539 1.00 17.45 ? 8 LYS A C 1 ATOM 45 O O . LYS A 1 7 ? 53.080 -1.233 -4.715 1.00 18.02 ? 8 LYS A O 1 ATOM 46 C CB . LYS A 1 7 ? 52.200 -1.470 -7.807 1.00 17.97 ? 8 LYS A CB 1 ATOM 47 C CG . LYS A 1 7 ? 51.590 -2.481 -8.770 1.00 23.80 ? 8 LYS A CG 1 ATOM 48 C CD . LYS A 1 7 ? 52.258 -2.460 -10.146 1.00 24.35 ? 8 LYS A CD 1 ATOM 49 C CE . LYS A 1 7 ? 51.371 -3.139 -11.157 1.00 29.50 ? 8 LYS A CE 1 ATOM 50 N NZ . LYS A 1 7 ? 51.990 -3.061 -12.508 1.00 31.89 ? 8 LYS A NZ 1 ATOM 51 N N . THR A 1 8 ? 52.328 0.673 -5.648 1.00 17.57 ? 9 THR A N 1 ATOM 52 C CA . THR A 1 8 ? 53.072 1.535 -4.691 1.00 20.29 ? 9 THR A CA 1 ATOM 53 C C . THR A 1 8 ? 52.595 1.335 -3.249 1.00 17.95 ? 9 THR A C 1 ATOM 54 O O . THR A 1 8 ? 53.431 1.179 -2.348 1.00 19.02 ? 9 THR A O 1 ATOM 55 C CB . THR A 1 8 ? 53.002 3.029 -5.119 1.00 21.36 ? 9 THR A CB 1 ATOM 56 O OG1 . THR A 1 8 ? 53.510 3.156 -6.451 1.00 21.30 ? 9 THR A OG1 1 ATOM 57 C CG2 . THR A 1 8 ? 53.834 3.896 -4.212 1.00 21.90 ? 9 THR A CG2 1 ATOM 58 N N . ASN A 1 9 ? 51.277 1.249 -3.040 1.00 19.63 ? 10 ASN A N 1 ATOM 59 C CA . ASN A 1 9 ? 50.710 0.982 -1.712 1.00 20.96 ? 10 ASN A CA 1 ATOM 60 C C . ASN A 1 9 ? 51.196 -0.354 -1.145 1.00 21.70 ? 10 ASN A C 1 ATOM 61 O O . ASN A 1 9 ? 51.661 -0.484 -0.021 1.00 20.63 ? 10 ASN A O 1 ATOM 62 C CB . ASN A 1 9 ? 49.199 0.981 -1.755 1.00 23.30 ? 10 ASN A CB 1 ATOM 63 C CG . ASN A 1 9 ? 48.620 2.386 -1.755 1.00 26.64 ? 10 ASN A CG 1 ATOM 64 O OD1 . ASN A 1 9 ? 49.278 3.328 -1.339 1.00 28.86 ? 10 ASN A OD1 1 ATOM 65 N ND2 . ASN A 1 9 ? 47.407 2.528 -2.228 1.00 23.52 ? 10 ASN A ND2 1 ATOM 66 N N . VAL A 1 10 ? 51.186 -1.347 -1.995 1.00 21.00 ? 11 VAL A N 1 ATOM 67 C CA . VAL A 1 10 ? 51.628 -2.695 -1.589 1.00 19.28 ? 11 VAL A CA 1 ATOM 68 C C . VAL A 1 10 ? 53.087 -2.784 -1.276 1.00 19.59 ? 11 VAL A C 1 ATOM 69 O O . VAL A 1 10 ? 53.500 -3.348 -0.236 1.00 20.11 ? 11 VAL A O 1 ATOM 70 C CB . VAL A 1 10 ? 51.195 -3.713 -2.661 1.00 18.42 ? 11 VAL A CB 1 ATOM 71 C CG1 . VAL A 1 10 ? 51.802 -5.075 -2.407 1.00 18.63 ? 11 VAL A CG1 1 ATOM 72 C CG2 . VAL A 1 10 ? 49.690 -3.766 -2.648 1.00 18.30 ? 11 VAL A CG2 1 ATOM 73 N N . LYS A 1 11 ? 53.903 -2.265 -2.168 1.00 17.65 ? 12 LYS A N 1 ATOM 74 C CA . LYS A 1 11 ? 55.337 -2.197 -1.906 1.00 18.52 ? 12 LYS A CA 1 ATOM 75 C C . LYS A 1 11 ? 55.707 -1.433 -0.654 1.00 16.77 ? 12 LYS A C 1 ATOM 76 O O . LYS A 1 11 ? 56.521 -1.889 0.117 1.00 17.55 ? 12 LYS A O 1 ATOM 77 C CB . LYS A 1 11 ? 56.074 -1.591 -3.065 1.00 20.66 ? 12 LYS A CB 1 ATOM 78 C CG . LYS A 1 11 ? 55.977 -2.479 -4.306 1.00 24.64 ? 12 LYS A CG 1 ATOM 79 C CD . LYS A 1 11 ? 56.606 -1.792 -5.495 1.00 29.26 ? 12 LYS A CD 1 ATOM 80 C CE . LYS A 1 11 ? 56.337 -2.562 -6.777 1.00 35.41 ? 12 LYS A CE 1 ATOM 81 N NZ . LYS A 1 11 ? 57.282 -3.709 -6.882 1.00 37.39 ? 12 LYS A NZ 1 ATOM 82 N N . ALA A 1 12 ? 55.071 -0.332 -0.399 1.00 16.47 ? 13 ALA A N 1 ATOM 83 C CA . ALA A 1 12 ? 55.392 0.412 0.815 1.00 17.98 ? 13 ALA A CA 1 ATOM 84 C C . ALA A 1 12 ? 54.890 -0.337 2.086 1.00 19.43 ? 13 ALA A C 1 ATOM 85 O O . ALA A 1 12 ? 55.616 -0.461 3.096 1.00 18.66 ? 13 ALA A O 1 ATOM 86 C CB . ALA A 1 12 ? 54.719 1.779 0.715 1.00 19.77 ? 13 ALA A CB 1 ATOM 87 N N . ALA A 1 13 ? 53.621 -0.752 2.085 1.00 18.11 ? 14 ALA A N 1 ATOM 88 C CA . ALA A 1 13 ? 53.084 -1.448 3.254 1.00 19.45 ? 14 ALA A CA 1 ATOM 89 C C . ALA A 1 13 ? 53.881 -2.681 3.542 1.00 20.83 ? 14 ALA A C 1 ATOM 90 O O . ALA A 1 13 ? 54.198 -2.950 4.688 1.00 19.38 ? 14 ALA A O 1 ATOM 91 C CB . ALA A 1 13 ? 51.633 -1.798 3.098 1.00 21.98 ? 14 ALA A CB 1 ATOM 92 N N . TRP A 1 14 ? 54.310 -3.404 2.520 1.00 21.89 ? 15 TRP A N 1 ATOM 93 C CA . TRP A 1 14 ? 55.004 -4.639 2.758 1.00 24.60 ? 15 TRP A CA 1 ATOM 94 C C . TRP A 1 14 ? 56.504 -4.454 3.102 1.00 26.85 ? 15 TRP A C 1 ATOM 95 O O . TRP A 1 14 ? 57.094 -5.304 3.819 1.00 25.17 ? 15 TRP A O 1 ATOM 96 C CB . TRP A 1 14 ? 54.798 -5.597 1.582 1.00 26.48 ? 15 TRP A CB 1 ATOM 97 C CG . TRP A 1 14 ? 55.079 -7.044 1.873 1.00 26.07 ? 15 TRP A CG 1 ATOM 98 C CD1 . TRP A 1 14 ? 56.196 -7.811 1.471 1.00 25.67 ? 15 TRP A CD1 1 ATOM 99 C CD2 . TRP A 1 14 ? 54.213 -7.935 2.602 1.00 22.18 ? 15 TRP A CD2 1 ATOM 100 N NE1 . TRP A 1 14 ? 56.043 -9.124 1.970 1.00 26.80 ? 15 TRP A NE1 1 ATOM 101 C CE2 . TRP A 1 14 ? 54.837 -9.215 2.635 1.00 22.61 ? 15 TRP A CE2 1 ATOM 102 C CE3 . TRP A 1 14 ? 52.939 -7.786 3.180 1.00 23.73 ? 15 TRP A CE3 1 ATOM 103 C CZ2 . TRP A 1 14 ? 54.260 -10.315 3.310 1.00 23.27 ? 15 TRP A CZ2 1 ATOM 104 C CZ3 . TRP A 1 14 ? 52.360 -8.880 3.849 1.00 22.33 ? 15 TRP A CZ3 1 ATOM 105 C CH2 . TRP A 1 14 ? 53.029 -10.125 3.915 1.00 22.80 ? 15 TRP A CH2 1 ATOM 106 N N . GLY A 1 15 ? 57.115 -3.382 2.575 1.00 23.24 ? 16 GLY A N 1 ATOM 107 C CA . GLY A 1 15 ? 58.393 -2.903 3.066 1.00 22.27 ? 16 GLY A CA 1 ATOM 108 C C . GLY A 1 15 ? 58.408 -2.573 4.574 1.00 22.43 ? 16 GLY A C 1 ATOM 109 O O . GLY A 1 15 ? 59.378 -2.816 5.248 1.00 25.96 ? 16 GLY A O 1 ATOM 110 N N . LYS A 1 16 ? 57.348 -2.021 5.113 1.00 22.88 ? 17 LYS A N 1 ATOM 111 C CA . LYS A 1 16 ? 57.254 -1.785 6.565 1.00 24.61 ? 17 LYS A CA 1 ATOM 112 C C . LYS A 1 16 ? 57.090 -3.081 7.398 1.00 25.65 ? 17 LYS A C 1 ATOM 113 O O . LYS A 1 16 ? 57.748 -3.282 8.457 1.00 23.25 ? 17 LYS A O 1 ATOM 114 C CB . LYS A 1 16 ? 56.099 -0.848 6.857 1.00 23.48 ? 17 LYS A CB 1 ATOM 115 C CG . LYS A 1 16 ? 56.334 0.525 6.271 1.00 23.69 ? 17 LYS A CG 1 ATOM 116 C CD . LYS A 1 16 ? 55.063 1.290 6.479 1.00 25.44 ? 17 LYS A CD 1 ATOM 117 C CE . LYS A 1 16 ? 55.246 2.769 6.440 1.00 28.44 ? 17 LYS A CE 1 ATOM 118 N NZ . LYS A 1 16 ? 54.917 3.256 5.110 1.00 30.14 ? 17 LYS A NZ 1 ATOM 119 N N . VAL A 1 17 ? 56.224 -3.959 6.903 1.00 21.32 ? 18 VAL A N 1 ATOM 120 C CA . VAL A 1 17 ? 56.105 -5.282 7.465 1.00 20.15 ? 18 VAL A CA 1 ATOM 121 C C . VAL A 1 17 ? 57.511 -5.860 7.651 1.00 22.79 ? 18 VAL A C 1 ATOM 122 O O . VAL A 1 17 ? 57.838 -6.421 8.729 1.00 19.12 ? 18 VAL A O 1 ATOM 123 C CB . VAL A 1 17 ? 55.241 -6.186 6.569 1.00 19.61 ? 18 VAL A CB 1 ATOM 124 C CG1 . VAL A 1 17 ? 55.300 -7.626 7.059 1.00 21.34 ? 18 VAL A CG1 1 ATOM 125 C CG2 . VAL A 1 17 ? 53.800 -5.704 6.575 1.00 20.03 ? 18 VAL A CG2 1 ATOM 126 N N . GLY A 1 18 ? 58.351 -5.712 6.619 1.00 20.24 ? 19 GLY A N 1 ATOM 127 C CA . GLY A 1 18 ? 59.729 -6.164 6.701 1.00 20.78 ? 19 GLY A CA 1 ATOM 128 C C . GLY A 1 18 ? 59.946 -7.485 7.389 1.00 21.26 ? 19 GLY A C 1 ATOM 129 O O . GLY A 1 18 ? 59.363 -8.504 6.961 1.00 20.45 ? 19 GLY A O 1 ATOM 130 N N . ALA A 1 19 ? 60.793 -7.505 8.423 1.00 19.94 ? 20 ALA A N 1 ATOM 131 C CA . ALA A 1 19 ? 61.123 -8.768 9.093 1.00 21.81 ? 20 ALA A CA 1 ATOM 132 C C . ALA A 1 19 ? 60.021 -9.419 9.947 1.00 22.44 ? 20 ALA A C 1 ATOM 133 O O . ALA A 1 19 ? 60.259 -10.498 10.484 1.00 22.56 ? 20 ALA A O 1 ATOM 134 C CB . ALA A 1 19 ? 62.364 -8.619 9.941 1.00 23.96 ? 20 ALA A CB 1 ATOM 135 N N . HIS A 1 20 ? 58.853 -8.779 10.100 1.00 21.13 ? 21 HIS A N 1 ATOM 136 C CA . HIS A 1 20 ? 57.717 -9.357 10.789 1.00 22.99 ? 21 HIS A CA 1 ATOM 137 C C . HIS A 1 20 ? 56.917 -10.380 9.900 1.00 23.26 ? 21 HIS A C 1 ATOM 138 O O . HIS A 1 20 ? 55.978 -10.947 10.375 1.00 20.30 ? 21 HIS A O 1 ATOM 139 C CB . HIS A 1 20 ? 56.734 -8.255 11.217 1.00 25.59 ? 21 HIS A CB 1 ATOM 140 C CG . HIS A 1 20 ? 57.275 -7.324 12.252 1.00 26.45 ? 21 HIS A CG 1 ATOM 141 N ND1 . HIS A 1 20 ? 57.894 -6.126 11.934 1.00 29.02 ? 21 HIS A ND1 1 ATOM 142 C CD2 . HIS A 1 20 ? 57.281 -7.404 13.598 1.00 26.24 ? 21 HIS A CD2 1 ATOM 143 C CE1 . HIS A 1 20 ? 58.289 -5.528 13.043 1.00 26.66 ? 21 HIS A CE1 1 ATOM 144 N NE2 . HIS A 1 20 ? 57.943 -6.285 14.062 1.00 30.88 ? 21 HIS A NE2 1 ATOM 145 N N . ALA A 1 21 ? 57.296 -10.543 8.623 1.00 22.78 ? 22 ALA A N 1 ATOM 146 C CA . ALA A 1 21 ? 56.445 -11.140 7.603 1.00 21.69 ? 22 ALA A CA 1 ATOM 147 C C . ALA A 1 21 ? 56.154 -12.565 7.974 1.00 20.00 ? 22 ALA A C 1 ATOM 148 O O . ALA A 1 21 ? 55.036 -12.985 7.933 1.00 17.59 ? 22 ALA A O 1 ATOM 149 C CB . ALA A 1 21 ? 57.115 -11.040 6.186 1.00 22.23 ? 22 ALA A CB 1 ATOM 150 N N . GLY A 1 22 ? 57.177 -13.294 8.369 1.00 20.22 ? 23 GLY A N 1 ATOM 151 C CA . GLY A 1 22 ? 57.013 -14.653 8.919 1.00 21.53 ? 23 GLY A CA 1 ATOM 152 C C . GLY A 1 22 ? 56.034 -14.863 10.041 1.00 22.88 ? 23 GLY A C 1 ATOM 153 O O . GLY A 1 22 ? 55.147 -15.781 9.969 1.00 19.96 ? 23 GLY A O 1 ATOM 154 N N . GLU A 1 23 ? 56.203 -14.038 11.085 1.00 22.64 ? 24 GLU A N 1 ATOM 155 C CA . GLU A 1 23 ? 55.290 -14.029 12.242 1.00 22.10 ? 24 GLU A CA 1 ATOM 156 C C . GLU A 1 23 ? 53.923 -13.702 11.790 1.00 17.22 ? 24 GLU A C 1 ATOM 157 O O . GLU A 1 23 ? 52.948 -14.267 12.306 1.00 14.95 ? 24 GLU A O 1 ATOM 158 C CB . GLU A 1 23 ? 55.659 -12.960 13.288 1.00 26.36 ? 24 GLU A CB 1 ATOM 159 C CG . GLU A 1 23 ? 56.995 -13.128 13.950 1.00 36.61 ? 24 GLU A CG 1 ATOM 160 C CD . GLU A 1 23 ? 57.577 -11.822 14.592 1.00 48.64 ? 24 GLU A CD 1 ATOM 161 O OE1 . GLU A 1 23 ? 56.894 -10.738 14.728 1.00 53.35 ? 24 GLU A OE1 1 ATOM 162 O OE2 . GLU A 1 23 ? 58.788 -11.885 14.937 1.00 51.70 ? 24 GLU A OE2 1 ATOM 163 N N . TYR A 1 24 ? 53.779 -12.740 10.872 1.00 16.44 ? 25 TYR A N 1 ATOM 164 C CA . TYR A 1 24 ? 52.415 -12.360 10.473 1.00 17.39 ? 25 TYR A CA 1 ATOM 165 C C . TYR A 1 24 ? 51.790 -13.505 9.641 1.00 14.92 ? 25 TYR A C 1 ATOM 166 O O . TYR A 1 24 ? 50.617 -13.802 9.757 1.00 14.69 ? 25 TYR A O 1 ATOM 167 C CB . TYR A 1 24 ? 52.343 -11.024 9.707 1.00 16.66 ? 25 TYR A CB 1 ATOM 168 C CG . TYR A 1 24 ? 52.745 -9.778 10.492 1.00 18.51 ? 25 TYR A CG 1 ATOM 169 C CD1 . TYR A 1 24 ? 53.027 -9.799 11.889 1.00 19.63 ? 25 TYR A CD1 1 ATOM 170 C CD2 . TYR A 1 24 ? 52.813 -8.581 9.860 1.00 19.67 ? 25 TYR A CD2 1 ATOM 171 C CE1 . TYR A 1 24 ? 53.422 -8.647 12.569 1.00 19.77 ? 25 TYR A CE1 1 ATOM 172 C CE2 . TYR A 1 24 ? 53.197 -7.417 10.536 1.00 22.79 ? 25 TYR A CE2 1 ATOM 173 C CZ . TYR A 1 24 ? 53.495 -7.441 11.877 1.00 21.57 ? 25 TYR A CZ 1 ATOM 174 O OH . TYR A 1 24 ? 53.830 -6.239 12.473 1.00 24.21 ? 25 TYR A OH 1 ATOM 175 N N . GLY A 1 25 ? 52.581 -14.101 8.786 1.00 14.75 ? 26 GLY A N 1 ATOM 176 C CA . GLY A 1 25 ? 52.169 -15.262 8.058 1.00 15.60 ? 26 GLY A CA 1 ATOM 177 C C . GLY A 1 25 ? 51.686 -16.370 8.940 1.00 15.63 ? 26 GLY A C 1 ATOM 178 O O . GLY A 1 25 ? 50.650 -16.952 8.669 1.00 15.96 ? 26 GLY A O 1 ATOM 179 N N . ALA A 1 26 ? 52.470 -16.674 9.976 1.00 17.52 ? 27 ALA A N 1 ATOM 180 C CA . ALA A 1 26 ? 52.143 -17.731 10.916 1.00 16.96 ? 27 ALA A CA 1 ATOM 181 C C . ALA A 1 26 ? 50.828 -17.455 11.636 1.00 16.97 ? 27 ALA A C 1 ATOM 182 O O . ALA A 1 26 ? 50.010 -18.372 11.848 1.00 15.52 ? 27 ALA A O 1 ATOM 183 C CB . ALA A 1 26 ? 53.262 -17.919 11.953 1.00 16.07 ? 27 ALA A CB 1 ATOM 184 N N . GLU A 1 27 ? 50.619 -16.199 12.051 1.00 15.89 ? 28 GLU A N 1 ATOM 185 C CA . GLU A 1 27 ? 49.394 -15.840 12.773 1.00 15.37 ? 28 GLU A CA 1 ATOM 186 C C . GLU A 1 27 ? 48.172 -15.926 11.850 1.00 13.66 ? 28 GLU A C 1 ATOM 187 O O . GLU A 1 27 ? 47.094 -16.308 12.284 1.00 14.26 ? 28 GLU A O 1 ATOM 188 C CB . GLU A 1 27 ? 49.477 -14.402 13.323 1.00 14.87 ? 28 GLU A CB 1 ATOM 189 C CG . GLU A 1 27 ? 48.244 -13.989 14.109 1.00 15.28 ? 28 GLU A CG 1 ATOM 190 C CD . GLU A 1 27 ? 48.361 -12.630 14.833 1.00 17.62 ? 28 GLU A CD 1 ATOM 191 O OE1 . GLU A 1 27 ? 49.488 -12.306 15.318 1.00 15.63 ? 28 GLU A OE1 1 ATOM 192 O OE2 . GLU A 1 27 ? 47.350 -11.804 14.804 1.00 17.84 ? 28 GLU A OE2 1 ATOM 193 N N . ALA A 1 28 ? 48.334 -15.482 10.603 1.00 14.55 ? 29 ALA A N 1 ATOM 194 C CA . ALA A 1 28 ? 47.262 -15.568 9.612 1.00 13.85 ? 29 ALA A CA 1 ATOM 195 C C . ALA A 1 28 ? 46.827 -17.043 9.441 1.00 13.54 ? 29 ALA A C 1 ATOM 196 O O . ALA A 1 28 ? 45.674 -17.307 9.421 1.00 14.62 ? 29 ALA A O 1 ATOM 197 C CB . ALA A 1 28 ? 47.662 -14.928 8.250 1.00 14.12 ? 29 ALA A CB 1 ATOM 198 N N . LEU A 1 29 ? 47.765 -17.962 9.323 1.00 14.32 ? 30 LEU A N 1 ATOM 199 C CA . LEU A 1 29 ? 47.431 -19.420 9.234 1.00 15.76 ? 30 LEU A CA 1 ATOM 200 C C . LEU A 1 29 ? 46.695 -19.871 10.496 1.00 17.20 ? 30 LEU A C 1 ATOM 201 O O . LEU A 1 29 ? 45.675 -20.600 10.414 1.00 14.79 ? 30 LEU A O 1 ATOM 202 C CB . LEU A 1 29 ? 48.699 -20.253 9.094 1.00 14.33 ? 30 LEU A CB 1 ATOM 203 C CG . LEU A 1 29 ? 49.477 -20.030 7.800 1.00 15.86 ? 30 LEU A CG 1 ATOM 204 C CD1 . LEU A 1 29 ? 50.937 -20.528 7.806 1.00 18.86 ? 30 LEU A CD1 1 ATOM 205 C CD2 . LEU A 1 29 ? 48.769 -20.726 6.672 1.00 15.97 ? 30 LEU A CD2 1 ATOM 206 N N . GLU A 1 30 ? 47.200 -19.431 11.661 1.00 16.59 ? 31 GLU A N 1 ATOM 207 C CA . GLU A 1 30 ? 46.586 -19.821 12.921 1.00 18.29 ? 31 GLU A CA 1 ATOM 208 C C . GLU A 1 30 ? 45.159 -19.319 13.003 1.00 16.59 ? 31 GLU A C 1 ATOM 209 O O . GLU A 1 30 ? 44.292 -20.051 13.363 1.00 16.94 ? 31 GLU A O 1 ATOM 210 C CB . GLU A 1 30 ? 47.397 -19.304 14.152 1.00 21.14 ? 31 GLU A CB 1 ATOM 211 C CG . GLU A 1 30 ? 46.691 -19.690 15.449 1.00 27.52 ? 31 GLU A CG 1 ATOM 212 C CD . GLU A 1 30 ? 47.381 -19.196 16.707 1.00 33.45 ? 31 GLU A CD 1 ATOM 213 O OE1 . GLU A 1 30 ? 46.872 -19.439 17.791 1.00 43.32 ? 31 GLU A OE1 1 ATOM 214 O OE2 . GLU A 1 30 ? 48.438 -18.592 16.632 1.00 37.59 ? 31 GLU A OE2 1 ATOM 215 N N . ARG A 1 31 ? 44.915 -18.061 12.621 1.00 16.98 ? 32 ARG A N 1 ATOM 216 C CA . ARG A 1 31 ? 43.547 -17.572 12.522 1.00 18.82 ? 32 ARG A CA 1 ATOM 217 C C . ARG A 1 31 ? 42.705 -18.361 11.533 1.00 18.27 ? 32 ARG A C 1 ATOM 218 O O . ARG A 1 31 ? 41.533 -18.674 11.831 1.00 18.76 ? 32 ARG A O 1 ATOM 219 C CB . ARG A 1 31 ? 43.479 -16.087 12.195 1.00 20.02 ? 32 ARG A CB 1 ATOM 220 C CG . ARG A 1 31 ? 43.970 -15.204 13.346 1.00 20.35 ? 32 ARG A CG 1 ATOM 221 C CD . ARG A 1 31 ? 44.308 -13.794 12.818 1.00 20.69 ? 32 ARG A CD 1 ATOM 222 N NE . ARG A 1 31 ? 44.753 -12.960 13.881 1.00 19.62 ? 32 ARG A NE 1 ATOM 223 C CZ . ARG A 1 31 ? 43.981 -12.487 14.893 1.00 19.98 ? 32 ARG A CZ 1 ATOM 224 N NH1 . ARG A 1 31 ? 42.676 -12.679 15.020 1.00 16.31 ? 32 ARG A NH1 1 ATOM 225 N NH2 . ARG A 1 31 ? 44.582 -11.785 15.827 1.00 19.79 ? 32 ARG A NH2 1 ATOM 226 N N . MET A 1 32 ? 43.287 -18.693 10.383 1.00 16.46 ? 33 MET A N 1 ATOM 227 C CA . MET A 1 32 ? 42.515 -19.413 9.389 1.00 16.38 ? 33 MET A CA 1 ATOM 228 C C . MET A 1 32 ? 42.078 -20.780 9.975 1.00 15.37 ? 33 MET A C 1 ATOM 229 O O . MET A 1 32 ? 40.932 -21.154 9.874 1.00 13.62 ? 33 MET A O 1 ATOM 230 C CB . MET A 1 32 ? 43.287 -19.576 8.104 1.00 16.80 ? 33 MET A CB 1 ATOM 231 C CG . MET A 1 32 ? 42.472 -20.195 6.968 1.00 18.09 ? 33 MET A CG 1 ATOM 232 S SD . MET A 1 32 ? 43.563 -20.590 5.613 1.00 19.35 ? 33 MET A SD 1 ATOM 233 C CE . MET A 1 32 ? 44.608 -21.854 6.326 1.00 19.94 ? 33 MET A CE 1 ATOM 234 N N . PHE A 1 33 ? 43.022 -21.508 10.549 1.00 16.28 ? 34 PHE A N 1 ATOM 235 C CA . PHE A 1 33 ? 42.743 -22.871 11.080 1.00 18.09 ? 34 PHE A CA 1 ATOM 236 C C . PHE A 1 33 ? 41.625 -22.902 12.136 1.00 18.52 ? 34 PHE A C 1 ATOM 237 O O . PHE A 1 33 ? 40.733 -23.750 12.090 1.00 16.10 ? 34 PHE A O 1 ATOM 238 C CB . PHE A 1 33 ? 44.023 -23.516 11.634 1.00 15.85 ? 34 PHE A CB 1 ATOM 239 C CG . PHE A 1 33 ? 45.055 -23.815 10.575 1.00 14.94 ? 34 PHE A CG 1 ATOM 240 C CD1 . PHE A 1 33 ? 44.709 -24.346 9.398 1.00 13.69 ? 34 PHE A CD1 1 ATOM 241 C CD2 . PHE A 1 33 ? 46.349 -23.541 10.797 1.00 14.57 ? 34 PHE A CD2 1 ATOM 242 C CE1 . PHE A 1 33 ? 45.614 -24.643 8.445 1.00 13.48 ? 34 PHE A CE1 1 ATOM 243 C CE2 . PHE A 1 33 ? 47.288 -23.781 9.859 1.00 14.49 ? 34 PHE A CE2 1 ATOM 244 C CZ . PHE A 1 33 ? 46.930 -24.374 8.665 1.00 14.60 ? 34 PHE A CZ 1 ATOM 245 N N . LEU A 1 34 ? 41.639 -21.919 13.018 1.00 19.20 ? 35 LEU A N 1 ATOM 246 C CA . LEU A 1 34 ? 40.676 -21.833 14.084 1.00 21.37 ? 35 LEU A CA 1 ATOM 247 C C . LEU A 1 34 ? 39.357 -21.251 13.644 1.00 21.75 ? 35 LEU A C 1 ATOM 248 O O . LEU A 1 34 ? 38.289 -21.771 14.042 1.00 22.49 ? 35 LEU A O 1 ATOM 249 C CB . LEU A 1 34 ? 41.309 -20.998 15.205 1.00 25.40 ? 35 LEU A CB 1 ATOM 250 C CG . LEU A 1 34 ? 40.669 -21.024 16.585 1.00 33.12 ? 35 LEU A CG 1 ATOM 251 C CD1 . LEU A 1 34 ? 40.518 -22.450 17.205 1.00 30.40 ? 35 LEU A CD1 1 ATOM 252 C CD2 . LEU A 1 34 ? 41.531 -20.106 17.431 1.00 31.65 ? 35 LEU A CD2 1 ATOM 253 N N . SER A 1 35 ? 39.366 -20.219 12.779 1.00 20.66 ? 36 SER A N 1 ATOM 254 C CA . SER A 1 35 ? 38.068 -19.660 12.254 1.00 19.02 ? 36 SER A CA 1 ATOM 255 C C . SER A 1 35 ? 37.375 -20.556 11.279 1.00 19.39 ? 36 SER A C 1 ATOM 256 O O . SER A 1 35 ? 36.097 -20.610 11.284 1.00 19.15 ? 36 SER A O 1 ATOM 257 C CB . SER A 1 35 ? 38.228 -18.275 11.620 1.00 19.05 ? 36 SER A CB 1 ATOM 258 O OG . SER A 1 35 ? 38.657 -17.403 12.635 1.00 23.97 ? 36 SER A OG 1 ATOM 259 N N . PHE A 1 36 ? 38.165 -21.241 10.435 1.00 16.80 ? 37 PHE A N 1 ATOM 260 C CA . PHE A 1 36 ? 37.593 -22.050 9.376 1.00 16.55 ? 37 PHE A CA 1 ATOM 261 C C . PHE A 1 36 ? 38.230 -23.446 9.453 1.00 18.28 ? 37 PHE A C 1 ATOM 262 O O . PHE A 1 36 ? 39.171 -23.799 8.712 1.00 16.48 ? 37 PHE A O 1 ATOM 263 C CB . PHE A 1 36 ? 37.817 -21.376 8.038 1.00 17.65 ? 37 PHE A CB 1 ATOM 264 C CG . PHE A 1 36 ? 37.486 -19.918 8.052 1.00 18.77 ? 37 PHE A CG 1 ATOM 265 C CD1 . PHE A 1 36 ? 36.179 -19.486 7.923 1.00 18.70 ? 37 PHE A CD1 1 ATOM 266 C CD2 . PHE A 1 36 ? 38.456 -18.994 8.150 1.00 18.12 ? 37 PHE A CD2 1 ATOM 267 C CE1 . PHE A 1 36 ? 35.896 -18.133 7.875 1.00 20.43 ? 37 PHE A CE1 1 ATOM 268 C CE2 . PHE A 1 36 ? 38.157 -17.631 8.104 1.00 20.37 ? 37 PHE A CE2 1 ATOM 269 C CZ . PHE A 1 36 ? 36.885 -17.206 8.005 1.00 18.31 ? 37 PHE A CZ 1 ATOM 270 N N . PRO A 1 37 ? 37.704 -24.258 10.378 1.00 18.54 ? 38 PRO A N 1 ATOM 271 C CA . PRO A 1 37 ? 38.304 -25.505 10.700 1.00 20.53 ? 38 PRO A CA 1 ATOM 272 C C . PRO A 1 37 ? 38.471 -26.387 9.483 1.00 20.27 ? 38 PRO A C 1 ATOM 273 O O . PRO A 1 37 ? 39.433 -27.114 9.447 1.00 20.53 ? 38 PRO A O 1 ATOM 274 C CB . PRO A 1 37 ? 37.309 -26.148 11.720 1.00 21.69 ? 38 PRO A CB 1 ATOM 275 C CG . PRO A 1 37 ? 36.546 -24.980 12.309 1.00 23.59 ? 38 PRO A CG 1 ATOM 276 C CD . PRO A 1 37 ? 36.487 -23.972 11.180 1.00 22.73 ? 38 PRO A CD 1 ATOM 277 N N . THR A 1 38 ? 37.598 -26.322 8.472 1.00 21.24 ? 39 THR A N 1 ATOM 278 C CA . THR A 1 38 ? 37.798 -27.181 7.301 1.00 21.70 ? 39 THR A CA 1 ATOM 279 C C . THR A 1 38 ? 39.153 -27.004 6.613 1.00 18.92 ? 39 THR A C 1 ATOM 280 O O . THR A 1 38 ? 39.668 -27.944 5.970 1.00 16.87 ? 39 THR A O 1 ATOM 281 C CB . THR A 1 38 ? 36.654 -27.049 6.260 1.00 26.15 ? 39 THR A CB 1 ATOM 282 O OG1 . THR A 1 38 ? 36.580 -25.693 5.824 1.00 26.82 ? 39 THR A OG1 1 ATOM 283 C CG2 . THR A 1 38 ? 35.351 -27.434 6.888 1.00 26.28 ? 39 THR A CG2 1 ATOM 284 N N . THR A 1 39 ? 39.798 -25.847 6.795 1.00 17.31 ? 40 THR A N 1 ATOM 285 C CA . THR A 1 39 ? 41.096 -25.650 6.165 1.00 16.39 ? 40 THR A CA 1 ATOM 286 C C . THR A 1 39 ? 42.163 -26.560 6.745 1.00 17.15 ? 40 THR A C 1 ATOM 287 O O . THR A 1 39 ? 43.184 -26.801 6.095 1.00 17.23 ? 40 THR A O 1 ATOM 288 C CB . THR A 1 39 ? 41.603 -24.175 6.291 1.00 16.69 ? 40 THR A CB 1 ATOM 289 O OG1 . THR A 1 39 ? 41.715 -23.777 7.646 1.00 15.08 ? 40 THR A OG1 1 ATOM 290 C CG2 . THR A 1 39 ? 40.672 -23.203 5.577 1.00 17.13 ? 40 THR A CG2 1 ATOM 291 N N . LYS A 1 40 ? 41.976 -26.996 8.012 1.00 16.65 ? 41 LYS A N 1 ATOM 292 C CA . LYS A 1 40 ? 42.962 -27.892 8.643 1.00 17.69 ? 41 LYS A CA 1 ATOM 293 C C . LYS A 1 40 ? 43.136 -29.211 7.889 1.00 16.47 ? 41 LYS A C 1 ATOM 294 O O . LYS A 1 40 ? 44.167 -29.833 8.040 1.00 13.96 ? 41 LYS A O 1 ATOM 295 C CB . LYS A 1 40 ? 42.615 -28.201 10.099 1.00 18.14 ? 41 LYS A CB 1 ATOM 296 C CG . LYS A 1 40 ? 42.450 -26.996 11.003 1.00 21.88 ? 41 LYS A CG 1 ATOM 297 C CD . LYS A 1 40 ? 42.411 -27.401 12.479 1.00 23.72 ? 41 LYS A CD 1 ATOM 298 C CE . LYS A 1 40 ? 41.191 -28.209 12.850 1.00 24.67 ? 41 LYS A CE 1 ATOM 299 N NZ . LYS A 1 40 ? 41.061 -28.261 14.345 1.00 23.88 ? 41 LYS A NZ 1 ATOM 300 N N . THR A 1 41 ? 42.137 -29.618 7.089 1.00 16.76 ? 42 THR A N 1 ATOM 301 C CA . THR A 1 41 ? 42.236 -30.858 6.349 1.00 17.66 ? 42 THR A CA 1 ATOM 302 C C . THR A 1 41 ? 43.311 -30.880 5.277 1.00 18.50 ? 42 THR A C 1 ATOM 303 O O . THR A 1 41 ? 43.732 -31.951 4.867 1.00 18.41 ? 42 THR A O 1 ATOM 304 C CB . THR A 1 41 ? 40.931 -31.225 5.693 1.00 20.58 ? 42 THR A CB 1 ATOM 305 O OG1 . THR A 1 41 ? 40.612 -30.199 4.758 1.00 21.50 ? 42 THR A OG1 1 ATOM 306 C CG2 . THR A 1 41 ? 39.844 -31.368 6.713 1.00 20.08 ? 42 THR A CG2 1 ATOM 307 N N . TYR A 1 42 ? 43.834 -29.729 4.868 1.00 16.48 ? 43 TYR A N 1 ATOM 308 C CA . TYR A 1 42 ? 44.945 -29.726 3.919 1.00 16.25 ? 43 TYR A CA 1 ATOM 309 C C . TYR A 1 42 ? 46.304 -29.961 4.601 1.00 16.41 ? 43 TYR A C 1 ATOM 310 O O . TYR A 1 42 ? 47.287 -30.157 3.919 1.00 13.43 ? 43 TYR A O 1 ATOM 311 C CB . TYR A 1 42 ? 44.981 -28.369 3.119 1.00 17.19 ? 43 TYR A CB 1 ATOM 312 C CG . TYR A 1 42 ? 43.832 -28.229 2.192 1.00 15.56 ? 43 TYR A CG 1 ATOM 313 C CD1 . TYR A 1 42 ? 43.832 -28.890 0.993 1.00 15.43 ? 43 TYR A CD1 1 ATOM 314 C CD2 . TYR A 1 42 ? 42.644 -27.604 2.595 1.00 16.52 ? 43 TYR A CD2 1 ATOM 315 C CE1 . TYR A 1 42 ? 42.758 -28.785 0.125 1.00 15.86 ? 43 TYR A CE1 1 ATOM 316 C CE2 . TYR A 1 42 ? 41.546 -27.532 1.737 1.00 15.70 ? 43 TYR A CE2 1 ATOM 317 C CZ . TYR A 1 42 ? 41.602 -28.127 0.521 1.00 15.59 ? 43 TYR A CZ 1 ATOM 318 O OH . TYR A 1 42 ? 40.541 -28.044 -0.370 1.00 17.66 ? 43 TYR A OH 1 ATOM 319 N N . PHE A 1 43 ? 46.330 -29.996 5.937 1.00 17.22 ? 44 PHE A N 1 ATOM 320 C CA . PHE A 1 43 ? 47.532 -30.093 6.700 1.00 18.22 ? 44 PHE A CA 1 ATOM 321 C C . PHE A 1 43 ? 47.433 -31.203 7.773 1.00 19.45 ? 44 PHE A C 1 ATOM 322 O O . PHE A 1 43 ? 47.734 -30.959 8.948 1.00 19.70 ? 44 PHE A O 1 ATOM 323 C CB . PHE A 1 43 ? 47.806 -28.742 7.402 1.00 17.61 ? 44 PHE A CB 1 ATOM 324 C CG . PHE A 1 43 ? 48.106 -27.583 6.462 1.00 18.02 ? 44 PHE A CG 1 ATOM 325 C CD1 . PHE A 1 43 ? 47.088 -26.842 5.926 1.00 17.77 ? 44 PHE A CD1 1 ATOM 326 C CD2 . PHE A 1 43 ? 49.431 -27.187 6.203 1.00 17.85 ? 44 PHE A CD2 1 ATOM 327 C CE1 . PHE A 1 43 ? 47.363 -25.740 5.101 1.00 17.85 ? 44 PHE A CE1 1 ATOM 328 C CE2 . PHE A 1 43 ? 49.725 -26.086 5.391 1.00 17.05 ? 44 PHE A CE2 1 ATOM 329 C CZ . PHE A 1 43 ? 48.682 -25.378 4.820 1.00 17.42 ? 44 PHE A CZ 1 ATOM 330 N N . PRO A 1 44 ? 47.047 -32.429 7.373 1.00 19.50 ? 45 PRO A N 1 ATOM 331 C CA . PRO A 1 44 ? 46.851 -33.460 8.343 1.00 20.60 ? 45 PRO A CA 1 ATOM 332 C C . PRO A 1 44 ? 48.164 -33.943 8.915 1.00 19.82 ? 45 PRO A C 1 ATOM 333 O O . PRO A 1 44 ? 48.147 -34.644 9.863 1.00 26.74 ? 45 PRO A O 1 ATOM 334 C CB . PRO A 1 44 ? 46.173 -34.562 7.500 1.00 20.90 ? 45 PRO A CB 1 ATOM 335 C CG . PRO A 1 44 ? 46.947 -34.469 6.231 1.00 19.57 ? 45 PRO A CG 1 ATOM 336 C CD . PRO A 1 44 ? 46.896 -32.963 6.019 1.00 18.88 ? 45 PRO A CD 1 ATOM 337 N N . HIS A 1 45 ? 49.278 -33.587 8.315 1.00 18.92 ? 46 HIS A N 1 ATOM 338 C CA . HIS A 1 45 ? 50.618 -33.924 8.780 1.00 19.03 ? 46 HIS A CA 1 ATOM 339 C C . HIS A 1 45 ? 51.199 -32.897 9.720 1.00 18.46 ? 46 HIS A C 1 ATOM 340 O O . HIS A 1 45 ? 52.267 -33.098 10.282 1.00 18.27 ? 46 HIS A O 1 ATOM 341 C CB . HIS A 1 45 ? 51.570 -34.119 7.586 1.00 19.66 ? 46 HIS A CB 1 ATOM 342 C CG . HIS A 1 45 ? 51.669 -32.939 6.648 1.00 21.58 ? 46 HIS A CG 1 ATOM 343 N ND1 . HIS A 1 45 ? 50.568 -32.238 6.200 1.00 22.33 ? 46 HIS A ND1 1 ATOM 344 C CD2 . HIS A 1 45 ? 52.743 -32.341 6.076 1.00 21.88 ? 46 HIS A CD2 1 ATOM 345 C CE1 . HIS A 1 45 ? 50.958 -31.214 5.461 1.00 21.75 ? 46 HIS A CE1 1 ATOM 346 N NE2 . HIS A 1 45 ? 52.270 -31.279 5.335 1.00 21.81 ? 46 HIS A NE2 1 ATOM 347 N N . PHE A 1 46 ? 50.523 -31.750 9.894 1.00 19.34 ? 47 PHE A N 1 ATOM 348 C CA . PHE A 1 46 ? 51.054 -30.665 10.765 1.00 16.93 ? 47 PHE A CA 1 ATOM 349 C C . PHE A 1 46 ? 50.679 -30.788 12.237 1.00 16.96 ? 47 PHE A C 1 ATOM 350 O O . PHE A 1 46 ? 49.555 -31.182 12.552 1.00 14.50 ? 47 PHE A O 1 ATOM 351 C CB . PHE A 1 46 ? 50.560 -29.263 10.289 1.00 18.56 ? 47 PHE A CB 1 ATOM 352 C CG . PHE A 1 46 ? 51.474 -28.596 9.283 1.00 20.41 ? 47 PHE A CG 1 ATOM 353 C CD1 . PHE A 1 46 ? 52.216 -29.346 8.364 1.00 20.64 ? 47 PHE A CD1 1 ATOM 354 C CD2 . PHE A 1 46 ? 51.586 -27.201 9.262 1.00 22.36 ? 47 PHE A CD2 1 ATOM 355 C CE1 . PHE A 1 46 ? 53.080 -28.720 7.464 1.00 22.78 ? 47 PHE A CE1 1 ATOM 356 C CE2 . PHE A 1 46 ? 52.417 -26.559 8.354 1.00 21.99 ? 47 PHE A CE2 1 ATOM 357 C CZ . PHE A 1 46 ? 53.157 -27.324 7.443 1.00 22.22 ? 47 PHE A CZ 1 ATOM 358 N N . ASP A 1 47 ? 51.588 -30.330 13.123 1.00 15.71 ? 48 ASP A N 1 ATOM 359 C CA . ASP A 1 47 ? 51.169 -29.781 14.449 1.00 17.73 ? 48 ASP A CA 1 ATOM 360 C C . ASP A 1 47 ? 50.538 -28.413 14.237 1.00 19.61 ? 48 ASP A C 1 ATOM 361 O O . ASP A 1 47 ? 51.249 -27.433 13.813 1.00 19.01 ? 48 ASP A O 1 ATOM 362 C CB . ASP A 1 47 ? 52.368 -29.566 15.310 1.00 19.55 ? 48 ASP A CB 1 ATOM 363 C CG . ASP A 1 47 ? 52.068 -28.937 16.608 1.00 19.60 ? 48 ASP A CG 1 ATOM 364 O OD1 . ASP A 1 47 ? 50.954 -28.694 17.028 1.00 23.18 ? 48 ASP A OD1 1 ATOM 365 O OD2 . ASP A 1 47 ? 53.042 -28.679 17.278 1.00 24.48 ? 48 ASP A OD2 1 ATOM 366 N N . LEU A 1 48 ? 49.245 -28.352 14.519 1.00 17.47 ? 49 LEU A N 1 ATOM 367 C CA . LEU A 1 48 ? 48.480 -27.158 14.324 1.00 19.16 ? 49 LEU A CA 1 ATOM 368 C C . LEU A 1 48 ? 48.111 -26.558 15.652 1.00 21.47 ? 49 LEU A C 1 ATOM 369 O O . LEU A 1 48 ? 47.170 -25.826 15.720 1.00 22.81 ? 49 LEU A O 1 ATOM 370 C CB . LEU A 1 48 ? 47.180 -27.503 13.560 1.00 18.69 ? 49 LEU A CB 1 ATOM 371 C CG . LEU A 1 48 ? 47.408 -28.074 12.144 1.00 18.16 ? 49 LEU A CG 1 ATOM 372 C CD1 . LEU A 1 48 ? 46.085 -28.500 11.460 1.00 19.86 ? 49 LEU A CD1 1 ATOM 373 C CD2 . LEU A 1 48 ? 48.144 -27.067 11.276 1.00 17.55 ? 49 LEU A CD2 1 ATOM 374 N N . SER A 1 49 ? 48.868 -26.833 16.716 1.00 23.90 ? 50 SER A N 1 ATOM 375 C CA . SER A 1 49 ? 48.528 -26.253 18.050 1.00 24.96 ? 50 SER A CA 1 ATOM 376 C C . SER A 1 49 ? 49.015 -24.818 18.099 1.00 24.57 ? 50 SER A C 1 ATOM 377 O O . SER A 1 49 ? 49.948 -24.454 17.375 1.00 24.13 ? 50 SER A O 1 ATOM 378 C CB . SER A 1 49 ? 49.246 -27.047 19.150 1.00 26.34 ? 50 SER A CB 1 ATOM 379 O OG . SER A 1 49 ? 50.673 -26.848 19.055 1.00 28.97 ? 50 SER A OG 1 ATOM 380 N N . HIS A 1 50 ? 48.473 -24.020 19.018 1.00 29.52 ? 51 HIS A N 1 ATOM 381 C CA . HIS A 1 50 ? 48.862 -22.605 19.111 1.00 28.45 ? 51 HIS A CA 1 ATOM 382 C C . HIS A 1 50 ? 50.327 -22.505 19.360 1.00 28.12 ? 51 HIS A C 1 ATOM 383 O O . HIS A 1 50 ? 50.773 -23.093 20.263 1.00 34.18 ? 51 HIS A O 1 ATOM 384 C CB . HIS A 1 50 ? 48.079 -21.869 20.204 1.00 31.42 ? 51 HIS A CB 1 ATOM 385 C CG . HIS A 1 50 ? 48.717 -20.578 20.625 1.00 38.04 ? 51 HIS A CG 1 ATOM 386 N ND1 . HIS A 1 50 ? 48.817 -19.483 19.785 1.00 41.05 ? 51 HIS A ND1 1 ATOM 387 C CD2 . HIS A 1 50 ? 49.315 -20.212 21.785 1.00 36.94 ? 51 HIS A CD2 1 ATOM 388 C CE1 . HIS A 1 50 ? 49.433 -18.496 20.416 1.00 40.70 ? 51 HIS A CE1 1 ATOM 389 N NE2 . HIS A 1 50 ? 49.743 -18.914 21.627 1.00 39.54 ? 51 HIS A NE2 1 ATOM 390 N N . GLY A 1 51 ? 51.069 -21.720 18.602 1.00 26.85 ? 52 GLY A N 1 ATOM 391 C CA . GLY A 1 51 ? 52.530 -21.605 18.782 1.00 28.22 ? 52 GLY A CA 1 ATOM 392 C C . GLY A 1 51 ? 53.341 -22.759 18.163 1.00 29.57 ? 52 GLY A C 1 ATOM 393 O O . GLY A 1 51 ? 54.566 -22.831 18.295 1.00 31.55 ? 52 GLY A O 1 ATOM 394 N N . SER A 1 52 ? 52.695 -23.655 17.433 1.00 29.44 ? 53 SER A N 1 ATOM 395 C CA . SER A 1 52 ? 53.430 -24.723 16.740 1.00 24.20 ? 53 SER A CA 1 ATOM 396 C C . SER A 1 52 ? 54.581 -24.147 15.983 1.00 23.81 ? 53 SER A C 1 ATOM 397 O O . SER A 1 52 ? 54.399 -23.237 15.160 1.00 26.61 ? 53 SER A O 1 ATOM 398 C CB . SER A 1 52 ? 52.520 -25.419 15.749 1.00 24.10 ? 53 SER A CB 1 ATOM 399 O OG . SER A 1 52 ? 53.283 -25.966 14.699 1.00 22.55 ? 53 SER A OG 1 ATOM 400 N N . ALA A 1 53 ? 55.758 -24.717 16.157 1.00 22.01 ? 54 ALA A N 1 ATOM 401 C CA . ALA A 1 53 ? 56.905 -24.311 15.362 1.00 20.93 ? 54 ALA A CA 1 ATOM 402 C C . ALA A 1 53 ? 56.768 -24.701 13.871 1.00 20.34 ? 54 ALA A C 1 ATOM 403 O O . ALA A 1 53 ? 57.268 -24.027 12.946 1.00 17.60 ? 54 ALA A O 1 ATOM 404 C CB . ALA A 1 53 ? 58.180 -24.927 15.976 1.00 23.18 ? 54 ALA A CB 1 ATOM 405 N N . GLN A 1 54 ? 56.026 -25.764 13.585 1.00 23.15 ? 55 GLN A N 1 ATOM 406 C CA . GLN A 1 54 ? 55.858 -26.170 12.189 1.00 21.53 ? 55 GLN A CA 1 ATOM 407 C C . GLN A 1 54 ? 55.004 -25.081 11.430 1.00 18.01 ? 55 GLN A C 1 ATOM 408 O O . GLN A 1 54 ? 55.336 -24.699 10.306 1.00 18.06 ? 55 GLN A O 1 ATOM 409 C CB . GLN A 1 54 ? 55.202 -27.536 12.165 1.00 21.74 ? 55 GLN A CB 1 ATOM 410 C CG . GLN A 1 54 ? 55.234 -28.177 10.813 1.00 24.52 ? 55 GLN A CG 1 ATOM 411 C CD . GLN A 1 54 ? 54.761 -29.632 10.894 1.00 23.67 ? 55 GLN A CD 1 ATOM 412 O OE1 . GLN A 1 54 ? 54.201 -30.074 11.904 1.00 28.36 ? 55 GLN A OE1 1 ATOM 413 N NE2 . GLN A 1 54 ? 55.105 -30.388 9.908 1.00 20.15 ? 55 GLN A NE2 1 ATOM 414 N N . VAL A 1 55 ? 53.969 -24.586 12.085 1.00 16.31 ? 56 VAL A N 1 ATOM 415 C CA . VAL A 1 55 ? 53.187 -23.415 11.595 1.00 18.04 ? 56 VAL A CA 1 ATOM 416 C C . VAL A 1 55 ? 54.044 -22.121 11.394 1.00 18.83 ? 56 VAL A C 1 ATOM 417 O O . VAL A 1 55 ? 53.862 -21.385 10.426 1.00 18.26 ? 56 VAL A O 1 ATOM 418 C CB . VAL A 1 55 ? 51.935 -23.173 12.473 1.00 17.30 ? 56 VAL A CB 1 ATOM 419 C CG1 . VAL A 1 55 ? 51.233 -21.867 12.149 1.00 19.14 ? 56 VAL A CG1 1 ATOM 420 C CG2 . VAL A 1 55 ? 50.952 -24.315 12.310 1.00 17.24 ? 56 VAL A CG2 1 ATOM 421 N N . LYS A 1 56 ? 54.955 -21.822 12.305 1.00 20.39 ? 57 LYS A N 1 ATOM 422 C CA . LYS A 1 56 ? 55.845 -20.655 12.152 1.00 19.74 ? 57 LYS A CA 1 ATOM 423 C C . LYS A 1 56 ? 56.760 -20.847 10.974 1.00 19.71 ? 57 LYS A C 1 ATOM 424 O O . LYS A 1 56 ? 57.017 -19.892 10.211 1.00 18.19 ? 57 LYS A O 1 ATOM 425 C CB . LYS A 1 56 ? 56.695 -20.437 13.400 1.00 22.25 ? 57 LYS A CB 1 ATOM 426 C CG . LYS A 1 56 ? 55.818 -20.068 14.575 1.00 25.15 ? 57 LYS A CG 1 ATOM 427 C CD . LYS A 1 56 ? 56.605 -19.868 15.863 1.00 30.39 ? 57 LYS A CD 1 ATOM 428 C CE . LYS A 1 56 ? 55.655 -19.453 16.974 1.00 35.42 ? 57 LYS A CE 1 ATOM 429 N NZ . LYS A 1 56 ? 56.356 -19.629 18.269 1.00 39.72 ? 57 LYS A NZ 1 ATOM 430 N N . GLY A 1 57 ? 57.233 -22.080 10.785 1.00 16.80 ? 58 GLY A N 1 ATOM 431 C CA . GLY A 1 57 ? 58.054 -22.380 9.631 1.00 18.98 ? 58 GLY A CA 1 ATOM 432 C C . GLY A 1 57 ? 57.296 -22.186 8.299 1.00 18.08 ? 58 GLY A C 1 ATOM 433 O O . GLY A 1 57 ? 57.808 -21.550 7.351 1.00 17.57 ? 58 GLY A O 1 ATOM 434 N N . HIS A 1 58 ? 56.058 -22.676 8.265 1.00 17.19 ? 59 HIS A N 1 ATOM 435 C CA . HIS A 1 58 ? 55.231 -22.564 7.075 1.00 16.44 ? 59 HIS A CA 1 ATOM 436 C C . HIS A 1 58 ? 54.838 -21.062 6.843 1.00 16.34 ? 59 HIS A C 1 ATOM 437 O O . HIS A 1 58 ? 54.855 -20.562 5.734 1.00 16.32 ? 59 HIS A O 1 ATOM 438 C CB . HIS A 1 58 ? 53.972 -23.410 7.204 1.00 17.57 ? 59 HIS A CB 1 ATOM 439 C CG . HIS A 1 58 ? 53.273 -23.608 5.913 1.00 18.27 ? 59 HIS A CG 1 ATOM 440 N ND1 . HIS A 1 58 ? 53.901 -24.216 4.872 1.00 18.43 ? 59 HIS A ND1 1 ATOM 441 C CD2 . HIS A 1 58 ? 52.101 -23.135 5.426 1.00 21.57 ? 59 HIS A CD2 1 ATOM 442 C CE1 . HIS A 1 58 ? 53.145 -24.146 3.793 1.00 19.65 ? 59 HIS A CE1 1 ATOM 443 N NE2 . HIS A 1 58 ? 52.033 -23.518 4.104 1.00 19.87 ? 59 HIS A NE2 1 ATOM 444 N N . GLY A 1 59 ? 54.515 -20.360 7.900 1.00 16.88 ? 60 GLY A N 1 ATOM 445 C CA . GLY A 1 59 ? 54.200 -18.928 7.820 1.00 17.45 ? 60 GLY A CA 1 ATOM 446 C C . GLY A 1 59 ? 55.309 -18.157 7.196 1.00 17.23 ? 60 GLY A C 1 ATOM 447 O O . GLY A 1 59 ? 55.077 -17.200 6.418 1.00 19.91 ? 60 GLY A O 1 ATOM 448 N N . LYS A 1 60 ? 56.542 -18.578 7.462 1.00 19.08 ? 61 LYS A N 1 ATOM 449 C CA . LYS A 1 60 ? 57.711 -17.936 6.854 1.00 20.03 ? 61 LYS A CA 1 ATOM 450 C C . LYS A 1 60 ? 57.810 -18.213 5.340 1.00 19.18 ? 61 LYS A C 1 ATOM 451 O O . LYS A 1 60 ? 58.171 -17.322 4.557 1.00 16.16 ? 61 LYS A O 1 ATOM 452 C CB . LYS A 1 60 ? 59.047 -18.326 7.541 1.00 23.01 ? 61 LYS A CB 1 ATOM 453 C CG . LYS A 1 60 ? 60.262 -17.677 6.892 1.00 27.74 ? 61 LYS A CG 1 ATOM 454 C CD . LYS A 1 60 ? 60.081 -16.133 6.721 1.00 34.21 ? 61 LYS A CD 1 ATOM 455 C CE . LYS A 1 60 ? 61.367 -15.372 6.384 1.00 41.95 ? 61 LYS A CE 1 ATOM 456 N NZ . LYS A 1 60 ? 61.010 -13.921 6.376 1.00 43.79 ? 61 LYS A NZ 1 ATOM 457 N N . LYS A 1 61 ? 57.487 -19.429 4.917 1.00 19.36 ? 62 LYS A N 1 ATOM 458 C CA . LYS A 1 61 ? 57.501 -19.719 3.509 1.00 21.23 ? 62 LYS A CA 1 ATOM 459 C C . LYS A 1 61 ? 56.382 -18.966 2.822 1.00 16.74 ? 62 LYS A C 1 ATOM 460 O O . LYS A 1 61 ? 56.561 -18.508 1.728 1.00 17.12 ? 62 LYS A O 1 ATOM 461 C CB . LYS A 1 61 ? 57.269 -21.205 3.225 1.00 22.51 ? 62 LYS A CB 1 ATOM 462 C CG . LYS A 1 61 ? 58.147 -22.165 3.954 1.00 27.70 ? 62 LYS A CG 1 ATOM 463 C CD . LYS A 1 61 ? 59.461 -22.439 3.257 1.00 34.35 ? 62 LYS A CD 1 ATOM 464 C CE . LYS A 1 61 ? 59.850 -23.888 3.574 1.00 43.51 ? 62 LYS A CE 1 ATOM 465 N NZ . LYS A 1 61 ? 58.867 -24.861 2.954 1.00 46.62 ? 62 LYS A NZ 1 ATOM 466 N N . VAL A 1 62 ? 55.214 -18.905 3.426 1.00 15.69 ? 63 VAL A N 1 ATOM 467 C CA . VAL A 1 62 ? 54.089 -18.153 2.813 1.00 15.25 ? 63 VAL A CA 1 ATOM 468 C C . VAL A 1 62 ? 54.469 -16.689 2.630 1.00 15.90 ? 63 VAL A C 1 ATOM 469 O O . VAL A 1 62 ? 54.285 -16.117 1.539 1.00 16.24 ? 63 VAL A O 1 ATOM 470 C CB . VAL A 1 62 ? 52.800 -18.327 3.619 1.00 15.14 ? 63 VAL A CB 1 ATOM 471 C CG1 . VAL A 1 62 ? 51.697 -17.399 3.164 1.00 16.65 ? 63 VAL A CG1 1 ATOM 472 C CG2 . VAL A 1 62 ? 52.333 -19.771 3.473 1.00 15.95 ? 63 VAL A CG2 1 ATOM 473 N N . ALA A 1 63 ? 55.013 -16.096 3.690 1.00 16.01 ? 64 ALA A N 1 ATOM 474 C CA . ALA A 1 63 ? 55.575 -14.767 3.597 1.00 17.28 ? 64 ALA A CA 1 ATOM 475 C C . ALA A 1 63 ? 56.595 -14.541 2.512 1.00 17.74 ? 64 ALA A C 1 ATOM 476 O O . ALA A 1 63 ? 56.496 -13.531 1.824 1.00 21.41 ? 64 ALA A O 1 ATOM 477 C CB . ALA A 1 63 ? 56.165 -14.356 4.927 1.00 20.19 ? 64 ALA A CB 1 ATOM 478 N N . ASP A 1 64 ? 57.556 -15.437 2.364 1.00 17.22 ? 65 ASP A N 1 ATOM 479 C CA . ASP A 1 64 ? 58.585 -15.296 1.332 1.00 19.66 ? 65 ASP A CA 1 ATOM 480 C C . ASP A 1 64 ? 57.955 -15.330 -0.057 1.00 18.22 ? 65 ASP A C 1 ATOM 481 O O . ASP A 1 64 ? 58.287 -14.540 -0.941 1.00 17.59 ? 65 ASP A O 1 ATOM 482 C CB . ASP A 1 64 ? 59.666 -16.378 1.442 1.00 21.25 ? 65 ASP A CB 1 ATOM 483 C CG . ASP A 1 64 ? 60.595 -16.178 2.673 1.00 25.71 ? 65 ASP A CG 1 ATOM 484 O OD1 . ASP A 1 64 ? 60.519 -15.156 3.332 1.00 25.92 ? 65 ASP A OD1 1 ATOM 485 O OD2 . ASP A 1 64 ? 61.381 -17.071 3.049 1.00 31.05 ? 65 ASP A OD2 1 ATOM 486 N N . ALA A 1 65 ? 57.004 -16.215 -0.233 1.00 16.48 ? 66 ALA A N 1 ATOM 487 C CA . ALA A 1 65 ? 56.304 -16.222 -1.520 1.00 16.84 ? 66 ALA A CA 1 ATOM 488 C C . ALA A 1 65 ? 55.587 -14.870 -1.782 1.00 16.94 ? 66 ALA A C 1 ATOM 489 O O . ALA A 1 65 ? 55.668 -14.313 -2.875 1.00 16.47 ? 66 ALA A O 1 ATOM 490 C CB . ALA A 1 65 ? 55.306 -17.358 -1.572 1.00 15.37 ? 66 ALA A CB 1 ATOM 491 N N . LEU A 1 66 ? 54.892 -14.335 -0.787 1.00 16.82 ? 67 LEU A N 1 ATOM 492 C CA . LEU A 1 66 ? 54.235 -13.036 -1.011 1.00 16.43 ? 67 LEU A CA 1 ATOM 493 C C . LEU A 1 66 ? 55.216 -11.914 -1.287 1.00 18.81 ? 67 LEU A C 1 ATOM 494 O O . LEU A 1 66 ? 54.960 -11.011 -2.143 1.00 17.90 ? 67 LEU A O 1 ATOM 495 C CB . LEU A 1 66 ? 53.416 -12.653 0.168 1.00 17.12 ? 67 LEU A CB 1 ATOM 496 C CG . LEU A 1 66 ? 52.216 -13.555 0.390 1.00 17.02 ? 67 LEU A CG 1 ATOM 497 C CD1 . LEU A 1 66 ? 51.520 -13.147 1.671 1.00 17.36 ? 67 LEU A CD1 1 ATOM 498 C CD2 . LEU A 1 66 ? 51.183 -13.477 -0.762 1.00 16.87 ? 67 LEU A CD2 1 ATOM 499 N N . THR A 1 67 ? 56.341 -11.953 -0.586 1.00 19.30 ? 68 THR A N 1 ATOM 500 C CA . THR A 1 67 ? 57.435 -11.009 -0.853 1.00 20.04 ? 68 THR A CA 1 ATOM 501 C C . THR A 1 67 ? 57.945 -11.097 -2.221 1.00 19.71 ? 68 THR A C 1 ATOM 502 O O . THR A 1 67 ? 58.183 -10.085 -2.857 1.00 19.47 ? 68 THR A O 1 ATOM 503 C CB . THR A 1 67 ? 58.605 -11.338 0.042 1.00 20.37 ? 68 THR A CB 1 ATOM 504 O OG1 . THR A 1 67 ? 58.182 -11.016 1.352 1.00 17.71 ? 68 THR A OG1 1 ATOM 505 C CG2 . THR A 1 67 ? 59.855 -10.532 -0.349 1.00 22.65 ? 68 THR A CG2 1 ATOM 506 N N . ASN A 1 68 ? 58.083 -12.313 -2.718 1.00 20.63 ? 69 ASN A N 1 ATOM 507 C CA . ASN A 1 68 ? 58.498 -12.491 -4.092 1.00 22.45 ? 69 ASN A CA 1 ATOM 508 C C . ASN A 1 68 ? 57.462 -12.011 -5.090 1.00 23.68 ? 69 ASN A C 1 ATOM 509 O O . ASN A 1 68 ? 57.816 -11.482 -6.186 1.00 24.71 ? 69 ASN A O 1 ATOM 510 C CB . ASN A 1 68 ? 58.720 -13.963 -4.385 1.00 25.75 ? 69 ASN A CB 1 ATOM 511 C CG . ASN A 1 68 ? 59.413 -14.168 -5.713 1.00 29.33 ? 69 ASN A CG 1 ATOM 512 O OD1 . ASN A 1 68 ? 60.500 -13.628 -5.943 1.00 35.70 ? 69 ASN A OD1 1 ATOM 513 N ND2 . ASN A 1 68 ? 58.822 -14.924 -6.566 1.00 27.90 ? 69 ASN A ND2 1 ATOM 514 N N . ALA A 1 69 ? 56.181 -12.213 -4.774 1.00 20.48 ? 70 ALA A N 1 ATOM 515 C CA . ALA A 1 69 ? 55.103 -11.676 -5.646 1.00 21.06 ? 70 ALA A CA 1 ATOM 516 C C . ALA A 1 69 ? 55.109 -10.179 -5.702 1.00 21.67 ? 70 ALA A C 1 ATOM 517 O O . ALA A 1 69 ? 54.956 -9.629 -6.784 1.00 22.00 ? 70 ALA A O 1 ATOM 518 C CB . ALA A 1 69 ? 53.708 -12.152 -5.303 1.00 19.01 ? 70 ALA A CB 1 ATOM 519 N N . VAL A 1 70 ? 55.288 -9.554 -4.552 1.00 24.17 ? 71 VAL A N 1 ATOM 520 C CA . VAL A 1 70 ? 55.328 -8.120 -4.416 1.00 23.18 ? 71 VAL A CA 1 ATOM 521 C C . VAL A 1 70 ? 56.528 -7.592 -5.221 1.00 28.29 ? 71 VAL A C 1 ATOM 522 O O . VAL A 1 70 ? 56.410 -6.599 -5.869 1.00 33.81 ? 71 VAL A O 1 ATOM 523 C CB . VAL A 1 70 ? 55.547 -7.697 -2.957 1.00 23.37 ? 71 VAL A CB 1 ATOM 524 C CG1 . VAL A 1 70 ? 55.957 -6.208 -2.856 1.00 24.93 ? 71 VAL A CG1 1 ATOM 525 C CG2 . VAL A 1 70 ? 54.328 -7.908 -2.094 1.00 21.99 ? 71 VAL A CG2 1 ATOM 526 N N . ALA A 1 71 ? 57.659 -8.276 -5.187 1.00 28.60 ? 72 ALA A N 1 ATOM 527 C CA . ALA A 1 71 ? 58.844 -7.861 -5.951 1.00 32.60 ? 72 ALA A CA 1 ATOM 528 C C . ALA A 1 71 ? 58.614 -7.952 -7.472 1.00 37.77 ? 72 ALA A C 1 ATOM 529 O O . ALA A 1 71 ? 59.288 -7.293 -8.220 1.00 36.67 ? 72 ALA A O 1 ATOM 530 C CB . ALA A 1 71 ? 60.027 -8.736 -5.584 1.00 31.08 ? 72 ALA A CB 1 ATOM 531 N N . HIS A 1 72 ? 57.676 -8.787 -7.911 1.00 35.05 ? 73 HIS A N 1 ATOM 532 C CA . HIS A 1 72 ? 57.476 -9.085 -9.325 1.00 31.73 ? 73 HIS A CA 1 ATOM 533 C C . HIS A 1 72 ? 56.013 -8.897 -9.655 1.00 26.51 ? 73 HIS A C 1 ATOM 534 O O . HIS A 1 72 ? 55.480 -9.738 -10.337 1.00 24.63 ? 73 HIS A O 1 ATOM 535 C CB . HIS A 1 72 ? 57.771 -10.578 -9.597 1.00 36.21 ? 73 HIS A CB 1 ATOM 536 C CG . HIS A 1 72 ? 59.216 -10.948 -9.562 1.00 41.77 ? 73 HIS A CG 1 ATOM 537 N ND1 . HIS A 1 72 ? 59.970 -10.901 -8.410 1.00 46.81 ? 73 HIS A ND1 1 ATOM 538 C CD2 . HIS A 1 72 ? 60.042 -11.400 -10.539 1.00 44.04 ? 73 HIS A CD2 1 ATOM 539 C CE1 . HIS A 1 72 ? 61.203 -11.301 -8.675 1.00 47.29 ? 73 HIS A CE1 1 ATOM 540 N NE2 . HIS A 1 72 ? 61.273 -11.607 -9.960 1.00 47.73 ? 73 HIS A NE2 1 ATOM 541 N N . VAL A 1 73 ? 55.365 -7.840 -9.158 1.00 25.68 ? 74 VAL A N 1 ATOM 542 C CA . VAL A 1 73 ? 53.914 -7.636 -9.322 1.00 28.57 ? 74 VAL A CA 1 ATOM 543 C C . VAL A 1 73 ? 53.501 -7.574 -10.776 1.00 31.92 ? 74 VAL A C 1 ATOM 544 O O . VAL A 1 73 ? 52.434 -8.028 -11.094 1.00 29.11 ? 74 VAL A O 1 ATOM 545 C CB . VAL A 1 73 ? 53.371 -6.355 -8.636 1.00 36.07 ? 74 VAL A CB 1 ATOM 546 C CG1 . VAL A 1 73 ? 51.872 -6.432 -8.367 1.00 36.13 ? 74 VAL A CG1 1 ATOM 547 C CG2 . VAL A 1 73 ? 54.010 -6.149 -7.319 1.00 41.02 ? 74 VAL A CG2 1 ATOM 548 N N . ASP A 1 74 ? 54.357 -7.089 -11.688 1.00 32.99 ? 75 ASP A N 1 ATOM 549 C CA . ASP A 1 74 ? 53.964 -7.115 -13.113 1.00 33.15 ? 75 ASP A CA 1 ATOM 550 C C . ASP A 1 74 ? 54.158 -8.472 -13.724 1.00 31.11 ? 75 ASP A C 1 ATOM 551 O O . ASP A 1 74 ? 53.773 -8.684 -14.851 1.00 34.70 ? 75 ASP A O 1 ATOM 552 C CB . ASP A 1 74 ? 54.750 -6.088 -13.925 1.00 36.78 ? 75 ASP A CB 1 ATOM 553 C CG . ASP A 1 74 ? 54.784 -4.744 -13.235 1.00 46.07 ? 75 ASP A CG 1 ATOM 554 O OD1 . ASP A 1 74 ? 53.679 -4.192 -13.031 1.00 47.90 ? 75 ASP A OD1 1 ATOM 555 O OD2 . ASP A 1 74 ? 55.881 -4.297 -12.838 1.00 49.61 ? 75 ASP A OD2 1 ATOM 556 N N . ASP A 1 75 ? 54.772 -9.423 -13.038 1.00 28.37 ? 76 ASP A N 1 ATOM 557 C CA . ASP A 1 75 ? 54.996 -10.725 -13.680 1.00 28.01 ? 76 ASP A CA 1 ATOM 558 C C . ASP A 1 75 ? 54.658 -11.897 -12.713 1.00 23.92 ? 76 ASP A C 1 ATOM 559 O O . ASP A 1 75 ? 55.349 -12.895 -12.653 1.00 20.78 ? 76 ASP A O 1 ATOM 560 C CB . ASP A 1 75 ? 56.429 -10.733 -14.180 1.00 33.05 ? 76 ASP A CB 1 ATOM 561 C CG . ASP A 1 75 ? 56.797 -12.007 -14.934 1.00 42.37 ? 76 ASP A CG 1 ATOM 562 O OD1 . ASP A 1 75 ? 56.014 -12.477 -15.815 1.00 44.92 ? 76 ASP A OD1 1 ATOM 563 O OD2 . ASP A 1 75 ? 57.908 -12.515 -14.615 1.00 49.32 ? 76 ASP A OD2 1 ATOM 564 N N . MET A 1 76 ? 53.554 -11.730 -12.011 1.00 22.22 ? 77 MET A N 1 ATOM 565 C CA . MET A 1 76 ? 53.085 -12.628 -10.934 1.00 23.53 ? 77 MET A CA 1 ATOM 566 C C . MET A 1 76 ? 52.882 -14.063 -11.379 1.00 20.17 ? 77 MET A C 1 ATOM 567 O O . MET A 1 76 ? 53.448 -15.008 -10.801 1.00 20.22 ? 77 MET A O 1 ATOM 568 C CB . MET A 1 76 ? 51.806 -12.000 -10.309 1.00 24.16 ? 77 MET A CB 1 ATOM 569 C CG . MET A 1 76 ? 51.483 -12.587 -8.968 1.00 31.06 ? 77 MET A CG 1 ATOM 570 S SD . MET A 1 76 ? 50.169 -11.686 -8.113 1.00 43.41 ? 77 MET A SD 1 ATOM 571 C CE . MET A 1 76 ? 51.061 -10.180 -7.833 1.00 32.05 ? 77 MET A CE 1 ATOM 572 N N . PRO A 1 77 ? 52.149 -14.265 -12.492 1.00 21.03 ? 78 PRO A N 1 ATOM 573 C CA . PRO A 1 77 ? 51.987 -15.638 -12.997 1.00 20.73 ? 78 PRO A CA 1 ATOM 574 C C . PRO A 1 77 ? 53.325 -16.412 -13.120 1.00 24.33 ? 78 PRO A C 1 ATOM 575 O O . PRO A 1 77 ? 53.477 -17.601 -12.743 1.00 21.51 ? 78 PRO A O 1 ATOM 576 C CB . PRO A 1 77 ? 51.329 -15.418 -14.356 1.00 21.30 ? 78 PRO A CB 1 ATOM 577 C CG . PRO A 1 77 ? 50.647 -14.099 -14.262 1.00 20.96 ? 78 PRO A CG 1 ATOM 578 C CD . PRO A 1 77 ? 51.528 -13.264 -13.383 1.00 20.27 ? 78 PRO A CD 1 ATOM 579 N N . ASN A 1 78 ? 54.314 -15.721 -13.624 1.00 25.41 ? 79 ASN A N 1 ATOM 580 C CA . ASN A 1 78 ? 55.585 -16.339 -13.817 1.00 29.04 ? 79 ASN A CA 1 ATOM 581 C C . ASN A 1 78 ? 56.316 -16.583 -12.549 1.00 28.00 ? 79 ASN A C 1 ATOM 582 O O . ASN A 1 78 ? 56.843 -17.639 -12.347 1.00 26.65 ? 79 ASN A O 1 ATOM 583 C CB . ASN A 1 78 ? 56.451 -15.470 -14.667 1.00 34.03 ? 79 ASN A CB 1 ATOM 584 C CG . ASN A 1 78 ? 56.729 -16.116 -15.927 1.00 42.00 ? 79 ASN A CG 1 ATOM 585 O OD1 . ASN A 1 78 ? 57.494 -17.070 -15.955 1.00 51.84 ? 79 ASN A OD1 1 ATOM 586 N ND2 . ASN A 1 78 ? 56.047 -15.682 -16.986 1.00 48.48 ? 79 ASN A ND2 1 ATOM 587 N N . ALA A 1 79 ? 56.399 -15.549 -11.729 1.00 26.82 ? 80 ALA A N 1 ATOM 588 C CA . ALA A 1 79 ? 56.998 -15.715 -10.448 1.00 27.48 ? 80 ALA A CA 1 ATOM 589 C C . ALA A 1 79 ? 56.298 -16.834 -9.601 1.00 29.21 ? 80 ALA A C 1 ATOM 590 O O . ALA A 1 79 ? 56.966 -17.530 -8.862 1.00 22.48 ? 80 ALA A O 1 ATOM 591 C CB . ALA A 1 79 ? 56.922 -14.405 -9.745 1.00 28.46 ? 80 ALA A CB 1 ATOM 592 N N . LEU A 1 80 ? 54.967 -17.017 -9.739 1.00 25.22 ? 81 LEU A N 1 ATOM 593 C CA . LEU A 1 80 ? 54.256 -18.012 -8.949 1.00 23.27 ? 81 LEU A CA 1 ATOM 594 C C . LEU A 1 80 ? 53.976 -19.333 -9.693 1.00 24.03 ? 81 LEU A C 1 ATOM 595 O O . LEU A 1 80 ? 53.234 -20.181 -9.169 1.00 21.46 ? 81 LEU A O 1 ATOM 596 C CB . LEU A 1 80 ? 52.952 -17.431 -8.418 1.00 23.37 ? 81 LEU A CB 1 ATOM 597 C CG . LEU A 1 80 ? 53.119 -16.275 -7.461 1.00 26.81 ? 81 LEU A CG 1 ATOM 598 C CD1 . LEU A 1 80 ? 51.774 -15.640 -7.125 1.00 26.03 ? 81 LEU A CD1 1 ATOM 599 C CD2 . LEU A 1 80 ? 53.824 -16.670 -6.154 1.00 28.35 ? 81 LEU A CD2 1 ATOM 600 N N . SER A 1 81 ? 54.590 -19.576 -10.861 1.00 22.73 ? 82 SER A N 1 ATOM 601 C CA . SER A 1 81 ? 54.205 -20.778 -11.623 1.00 23.19 ? 82 SER A CA 1 ATOM 602 C C . SER A 1 81 ? 54.373 -22.072 -10.887 1.00 20.38 ? 82 SER A C 1 ATOM 603 O O . SER A 1 81 ? 53.522 -22.954 -10.957 1.00 19.14 ? 82 SER A O 1 ATOM 604 C CB . SER A 1 81 ? 54.906 -20.855 -12.993 1.00 25.00 ? 82 SER A CB 1 ATOM 605 O OG . SER A 1 81 ? 56.196 -20.471 -12.757 1.00 28.57 ? 82 SER A OG 1 ATOM 606 N N . ALA A 1 82 ? 55.446 -22.207 -10.145 1.00 22.25 ? 83 ALA A N 1 ATOM 607 C CA . ALA A 1 82 ? 55.696 -23.484 -9.452 1.00 22.82 ? 83 ALA A CA 1 ATOM 608 C C . ALA A 1 82 ? 54.651 -23.635 -8.370 1.00 20.86 ? 83 ALA A C 1 ATOM 609 O O . ALA A 1 82 ? 54.092 -24.701 -8.191 1.00 18.98 ? 83 ALA A O 1 ATOM 610 C CB . ALA A 1 82 ? 57.106 -23.551 -8.846 1.00 23.15 ? 83 ALA A CB 1 ATOM 611 N N . LEU A 1 83 ? 54.412 -22.558 -7.613 1.00 20.91 ? 84 LEU A N 1 ATOM 612 C CA . LEU A 1 83 ? 53.399 -22.589 -6.556 1.00 21.08 ? 84 LEU A CA 1 ATOM 613 C C . LEU A 1 83 ? 51.979 -22.841 -7.075 1.00 19.08 ? 84 LEU A C 1 ATOM 614 O O . LEU A 1 83 ? 51.110 -23.452 -6.375 1.00 18.66 ? 84 LEU A O 1 ATOM 615 C CB . LEU A 1 83 ? 53.393 -21.270 -5.819 1.00 22.95 ? 84 LEU A CB 1 ATOM 616 C CG . LEU A 1 83 ? 54.515 -21.257 -4.808 1.00 28.11 ? 84 LEU A CG 1 ATOM 617 C CD1 . LEU A 1 83 ? 54.633 -19.848 -4.207 1.00 30.94 ? 84 LEU A CD1 1 ATOM 618 C CD2 . LEU A 1 83 ? 54.317 -22.314 -3.694 1.00 26.22 ? 84 LEU A CD2 1 ATOM 619 N N . SER A 1 84 ? 51.727 -22.319 -8.268 1.00 16.51 ? 85 SER A N 1 ATOM 620 C CA . SER A 1 84 ? 50.362 -22.411 -8.819 1.00 20.96 ? 85 SER A CA 1 ATOM 621 C C . SER A 1 84 ? 50.100 -23.862 -9.210 1.00 19.28 ? 85 SER A C 1 ATOM 622 O O . SER A 1 84 ? 49.030 -24.418 -8.879 1.00 17.42 ? 85 SER A O 1 ATOM 623 C CB . SER A 1 84 ? 50.105 -21.352 -9.926 1.00 24.22 ? 85 SER A CB 1 ATOM 624 O OG . SER A 1 84 ? 50.939 -21.608 -11.001 1.00 31.82 ? 85 SER A OG 1 ATOM 625 N N . ASP A 1 85 ? 51.092 -24.527 -9.807 1.00 18.32 ? 86 ASP A N 1 ATOM 626 C CA . ASP A 1 85 ? 50.949 -25.950 -10.060 1.00 20.91 ? 86 ASP A CA 1 ATOM 627 C C . ASP A 1 85 ? 50.854 -26.716 -8.754 1.00 20.07 ? 86 ASP A C 1 ATOM 628 O O . ASP A 1 85 ? 50.098 -27.661 -8.648 1.00 18.43 ? 86 ASP A O 1 ATOM 629 C CB . ASP A 1 85 ? 52.127 -26.544 -10.808 1.00 23.72 ? 86 ASP A CB 1 ATOM 630 C CG . ASP A 1 85 ? 52.287 -26.000 -12.194 1.00 30.03 ? 86 ASP A CG 1 ATOM 631 O OD1 . ASP A 1 85 ? 51.318 -25.581 -12.864 1.00 28.06 ? 86 ASP A OD1 1 ATOM 632 O OD2 . ASP A 1 85 ? 53.436 -26.032 -12.656 1.00 37.21 ? 86 ASP A OD2 1 ATOM 633 N N . LEU A 1 86 ? 51.659 -26.351 -7.783 1.00 17.73 ? 87 LEU A N 1 ATOM 634 C CA . LEU A 1 86 ? 51.563 -27.041 -6.497 1.00 17.89 ? 87 LEU A CA 1 ATOM 635 C C . LEU A 1 86 ? 50.159 -26.978 -5.889 1.00 18.80 ? 87 LEU A C 1 ATOM 636 O O . LEU A 1 86 ? 49.543 -28.019 -5.548 1.00 19.20 ? 87 LEU A O 1 ATOM 637 C CB . LEU A 1 86 ? 52.547 -26.485 -5.484 1.00 17.72 ? 87 LEU A CB 1 ATOM 638 C CG . LEU A 1 86 ? 52.429 -27.086 -4.048 1.00 17.47 ? 87 LEU A CG 1 ATOM 639 C CD1 . LEU A 1 86 ? 52.702 -28.542 -4.043 1.00 18.20 ? 87 LEU A CD1 1 ATOM 640 C CD2 . LEU A 1 86 ? 53.378 -26.417 -3.112 1.00 16.41 ? 87 LEU A CD2 1 ATOM 641 N N . HIS A 1 87 ? 49.615 -25.766 -5.771 1.00 18.62 ? 88 HIS A N 1 ATOM 642 C CA . HIS A 1 87 ? 48.311 -25.610 -5.176 1.00 15.22 ? 88 HIS A CA 1 ATOM 643 C C . HIS A 1 87 ? 47.145 -26.172 -6.002 1.00 17.48 ? 88 HIS A C 1 ATOM 644 O O . HIS A 1 87 ? 46.174 -26.847 -5.445 1.00 16.01 ? 88 HIS A O 1 ATOM 645 C CB . HIS A 1 87 ? 48.085 -24.150 -4.776 1.00 14.70 ? 88 HIS A CB 1 ATOM 646 C CG . HIS A 1 87 ? 48.943 -23.716 -3.603 1.00 15.47 ? 88 HIS A CG 1 ATOM 647 N ND1 . HIS A 1 87 ? 50.260 -23.391 -3.745 1.00 18.27 ? 88 HIS A ND1 1 ATOM 648 C CD2 . HIS A 1 87 ? 48.676 -23.598 -2.283 1.00 16.20 ? 88 HIS A CD2 1 ATOM 649 C CE1 . HIS A 1 87 ? 50.784 -23.104 -2.562 1.00 19.80 ? 88 HIS A CE1 1 ATOM 650 N NE2 . HIS A 1 87 ? 49.829 -23.196 -1.660 1.00 18.62 ? 88 HIS A NE2 1 ATOM 651 N N . ALA A 1 88 ? 47.158 -25.873 -7.285 1.00 16.34 ? 89 ALA A N 1 ATOM 652 C CA . ALA A 1 88 ? 45.961 -26.232 -8.087 1.00 18.76 ? 89 ALA A CA 1 ATOM 653 C C . ALA A 1 88 ? 45.918 -27.722 -8.479 1.00 20.51 ? 89 ALA A C 1 ATOM 654 O O . ALA A 1 88 ? 44.882 -28.359 -8.335 1.00 21.40 ? 89 ALA A O 1 ATOM 655 C CB . ALA A 1 88 ? 45.861 -25.385 -9.328 1.00 19.20 ? 89 ALA A CB 1 ATOM 656 N N . HIS A 1 89 ? 47.074 -28.258 -8.864 1.00 21.02 ? 90 HIS A N 1 ATOM 657 C CA . HIS A 1 89 ? 47.134 -29.571 -9.446 1.00 26.64 ? 90 HIS A CA 1 ATOM 658 C C . HIS A 1 89 ? 47.468 -30.586 -8.350 1.00 26.96 ? 90 HIS A C 1 ATOM 659 O O . HIS A 1 89 ? 46.698 -31.491 -8.147 1.00 30.96 ? 90 HIS A O 1 ATOM 660 C CB . HIS A 1 89 ? 48.146 -29.677 -10.629 1.00 23.32 ? 90 HIS A CB 1 ATOM 661 C CG . HIS A 1 89 ? 47.737 -28.921 -11.847 1.00 25.11 ? 90 HIS A CG 1 ATOM 662 N ND1 . HIS A 1 89 ? 48.645 -28.293 -12.671 1.00 29.71 ? 90 HIS A ND1 1 ATOM 663 C CD2 . HIS A 1 89 ? 46.522 -28.721 -12.406 1.00 27.54 ? 90 HIS A CD2 1 ATOM 664 C CE1 . HIS A 1 89 ? 48.012 -27.733 -13.684 1.00 29.99 ? 90 HIS A CE1 1 ATOM 665 N NE2 . HIS A 1 89 ? 46.721 -27.972 -13.547 1.00 32.93 ? 90 HIS A NE2 1 ATOM 666 N N . LYS A 1 90 ? 48.563 -30.400 -7.624 1.00 23.39 ? 91 LYS A N 1 ATOM 667 C CA . LYS A 1 90 ? 49.006 -31.443 -6.757 1.00 26.66 ? 91 LYS A CA 1 ATOM 668 C C . LYS A 1 90 ? 48.215 -31.529 -5.459 1.00 23.77 ? 91 LYS A C 1 ATOM 669 O O . LYS A 1 90 ? 47.773 -32.576 -5.052 1.00 23.08 ? 91 LYS A O 1 ATOM 670 C CB . LYS A 1 90 ? 50.491 -31.329 -6.499 1.00 29.40 ? 91 LYS A CB 1 ATOM 671 C CG . LYS A 1 90 ? 50.859 -32.289 -5.393 1.00 35.98 ? 91 LYS A CG 1 ATOM 672 C CD . LYS A 1 90 ? 52.324 -32.584 -5.366 1.00 41.52 ? 91 LYS A CD 1 ATOM 673 C CE . LYS A 1 90 ? 52.520 -33.948 -4.745 1.00 48.20 ? 91 LYS A CE 1 ATOM 674 N NZ . LYS A 1 90 ? 53.952 -34.075 -4.412 1.00 56.38 ? 91 LYS A NZ 1 ATOM 675 N N . LEU A 1 91 ? 48.052 -30.410 -4.790 1.00 22.95 ? 92 LEU A N 1 ATOM 676 C CA . LEU A 1 91 ? 47.331 -30.341 -3.525 1.00 21.07 ? 92 LEU A CA 1 ATOM 677 C C . LEU A 1 91 ? 45.814 -30.236 -3.703 1.00 20.82 ? 92 LEU A C 1 ATOM 678 O O . LEU A 1 91 ? 45.041 -30.529 -2.818 1.00 21.32 ? 92 LEU A O 1 ATOM 679 C CB . LEU A 1 91 ? 47.856 -29.118 -2.754 1.00 20.68 ? 92 LEU A CB 1 ATOM 680 C CG . LEU A 1 91 ? 49.328 -29.186 -2.347 1.00 22.96 ? 92 LEU A CG 1 ATOM 681 C CD1 . LEU A 1 91 ? 49.767 -27.981 -1.537 1.00 23.46 ? 92 LEU A CD1 1 ATOM 682 C CD2 . LEU A 1 91 ? 49.583 -30.487 -1.576 1.00 24.58 ? 92 LEU A CD2 1 ATOM 683 N N . ARG A 1 92 ? 45.377 -29.792 -4.861 1.00 21.35 ? 93 ARG A N 1 ATOM 684 C CA . ARG A 1 92 ? 43.953 -29.424 -5.120 1.00 23.02 ? 93 ARG A CA 1 ATOM 685 C C . ARG A 1 92 ? 43.230 -28.570 -4.086 1.00 18.88 ? 93 ARG A C 1 ATOM 686 O O . ARG A 1 92 ? 42.112 -28.854 -3.717 1.00 17.45 ? 93 ARG A O 1 ATOM 687 C CB . ARG A 1 92 ? 43.095 -30.664 -5.558 1.00 26.00 ? 93 ARG A CB 1 ATOM 688 C CG . ARG A 1 92 ? 43.619 -31.316 -6.858 1.00 31.85 ? 93 ARG A CG 1 ATOM 689 C CD . ARG A 1 92 ? 42.583 -32.132 -7.647 1.00 36.22 ? 93 ARG A CD 1 ATOM 690 N NE . ARG A 1 92 ? 41.445 -31.321 -8.156 1.00 37.34 ? 93 ARG A NE 1 ATOM 691 C CZ . ARG A 1 92 ? 40.196 -31.311 -7.644 1.00 42.01 ? 93 ARG A CZ 1 ATOM 692 N NH1 . ARG A 1 92 ? 39.840 -32.033 -6.559 1.00 42.47 ? 93 ARG A NH1 1 ATOM 693 N NH2 . ARG A 1 92 ? 39.265 -30.557 -8.224 1.00 40.00 ? 93 ARG A NH2 1 ATOM 694 N N . VAL A 1 93 ? 43.833 -27.450 -3.712 1.00 18.46 ? 94 VAL A N 1 ATOM 695 C CA . VAL A 1 93 ? 43.234 -26.571 -2.763 1.00 16.69 ? 94 VAL A CA 1 ATOM 696 C C . VAL A 1 93 ? 42.060 -25.817 -3.391 1.00 16.79 ? 94 VAL A C 1 ATOM 697 O O . VAL A 1 93 ? 42.235 -25.001 -4.306 1.00 18.02 ? 94 VAL A O 1 ATOM 698 C CB . VAL A 1 93 ? 44.253 -25.575 -2.194 1.00 18.07 ? 94 VAL A CB 1 ATOM 699 C CG1 . VAL A 1 93 ? 43.555 -24.720 -1.126 1.00 18.74 ? 94 VAL A CG1 1 ATOM 700 C CG2 . VAL A 1 93 ? 45.514 -26.325 -1.676 1.00 17.70 ? 94 VAL A CG2 1 ATOM 701 N N . ASP A 1 94 ? 40.870 -26.049 -2.873 1.00 16.54 ? 95 ASP A N 1 ATOM 702 C CA . ASP A 1 94 ? 39.709 -25.317 -3.339 1.00 17.98 ? 95 ASP A CA 1 ATOM 703 C C . ASP A 1 94 ? 39.896 -23.809 -3.256 1.00 17.36 ? 95 ASP A C 1 ATOM 704 O O . ASP A 1 94 ? 40.337 -23.276 -2.234 1.00 15.24 ? 95 ASP A O 1 ATOM 705 C CB . ASP A 1 94 ? 38.415 -25.711 -2.661 1.00 19.58 ? 95 ASP A CB 1 ATOM 706 C CG . ASP A 1 94 ? 37.201 -25.172 -3.410 1.00 23.49 ? 95 ASP A CG 1 ATOM 707 O OD1 . ASP A 1 94 ? 36.755 -25.836 -4.401 1.00 28.15 ? 95 ASP A OD1 1 ATOM 708 O OD2 . ASP A 1 94 ? 36.718 -24.065 -3.063 1.00 23.08 ? 95 ASP A OD2 1 ATOM 709 N N . PRO A 1 95 ? 39.497 -23.088 -4.341 1.00 19.17 ? 96 PRO A N 1 ATOM 710 C CA . PRO A 1 95 ? 39.634 -21.615 -4.345 1.00 18.18 ? 96 PRO A CA 1 ATOM 711 C C . PRO A 1 95 ? 39.108 -20.882 -3.155 1.00 17.73 ? 96 PRO A C 1 ATOM 712 O O . PRO A 1 95 ? 39.729 -19.884 -2.783 1.00 16.37 ? 96 PRO A O 1 ATOM 713 C CB . PRO A 1 95 ? 38.858 -21.215 -5.600 1.00 19.03 ? 96 PRO A CB 1 ATOM 714 C CG . PRO A 1 95 ? 39.289 -22.303 -6.556 1.00 17.91 ? 96 PRO A CG 1 ATOM 715 C CD . PRO A 1 95 ? 39.161 -23.587 -5.701 1.00 18.52 ? 96 PRO A CD 1 ATOM 716 N N . VAL A 1 96 ? 37.990 -21.327 -2.571 1.00 16.91 ? 97 VAL A N 1 ATOM 717 C CA . VAL A 1 96 ? 37.405 -20.630 -1.397 1.00 16.60 ? 97 VAL A CA 1 ATOM 718 C C . VAL A 1 96 ? 38.462 -20.370 -0.308 1.00 15.88 ? 97 VAL A C 1 ATOM 719 O O . VAL A 1 96 ? 38.463 -19.327 0.345 1.00 14.86 ? 97 VAL A O 1 ATOM 720 C CB . VAL A 1 96 ? 36.298 -21.427 -0.603 1.00 20.20 ? 97 VAL A CB 1 ATOM 721 C CG1 . VAL A 1 96 ? 35.011 -21.552 -1.317 1.00 23.77 ? 97 VAL A CG1 1 ATOM 722 C CG2 . VAL A 1 96 ? 36.758 -22.815 -0.186 1.00 20.30 ? 97 VAL A CG2 1 ATOM 723 N N . ASN A 1 97 ? 39.335 -21.337 -0.082 1.00 14.55 ? 98 ASN A N 1 ATOM 724 C CA . ASN A 1 97 ? 40.360 -21.232 0.961 1.00 14.32 ? 98 ASN A CA 1 ATOM 725 C C . ASN A 1 97 ? 41.306 -20.051 0.842 1.00 14.77 ? 98 ASN A C 1 ATOM 726 O O . ASN A 1 97 ? 41.811 -19.559 1.850 1.00 14.04 ? 98 ASN A O 1 ATOM 727 C CB . ASN A 1 97 ? 41.188 -22.503 1.009 1.00 13.82 ? 98 ASN A CB 1 ATOM 728 C CG . ASN A 1 97 ? 40.301 -23.737 1.311 1.00 14.97 ? 98 ASN A CG 1 ATOM 729 O OD1 . ASN A 1 97 ? 39.691 -23.762 2.309 1.00 16.55 ? 98 ASN A OD1 1 ATOM 730 N ND2 . ASN A 1 97 ? 40.147 -24.628 0.359 1.00 13.75 ? 98 ASN A ND2 1 ATOM 731 N N . PHE A 1 98 ? 41.592 -19.659 -0.388 1.00 14.51 ? 99 PHE A N 1 ATOM 732 C CA . PHE A 1 98 ? 42.482 -18.547 -0.624 1.00 15.00 ? 99 PHE A CA 1 ATOM 733 C C . PHE A 1 98 ? 41.896 -17.234 -0.135 1.00 14.54 ? 99 PHE A C 1 ATOM 734 O O . PHE A 1 98 ? 42.677 -16.420 0.361 1.00 11.65 ? 99 PHE A O 1 ATOM 735 C CB . PHE A 1 98 ? 42.918 -18.454 -2.082 1.00 14.90 ? 99 PHE A CB 1 ATOM 736 C CG . PHE A 1 98 ? 43.805 -19.581 -2.486 1.00 15.23 ? 99 PHE A CG 1 ATOM 737 C CD1 . PHE A 1 98 ? 43.236 -20.808 -2.854 1.00 16.11 ? 99 PHE A CD1 1 ATOM 738 C CD2 . PHE A 1 98 ? 45.193 -19.493 -2.382 1.00 15.06 ? 99 PHE A CD2 1 ATOM 739 C CE1 . PHE A 1 98 ? 44.012 -21.890 -3.164 1.00 14.62 ? 99 PHE A CE1 1 ATOM 740 C CE2 . PHE A 1 98 ? 45.969 -20.580 -2.705 1.00 15.41 ? 99 PHE A CE2 1 ATOM 741 C CZ . PHE A 1 98 ? 45.387 -21.746 -3.154 1.00 15.23 ? 99 PHE A CZ 1 ATOM 742 N N . LYS A 1 99 ? 40.562 -17.083 -0.239 1.00 14.83 ? 100 LYS A N 1 ATOM 743 C CA . LYS A 1 99 ? 39.848 -15.938 0.340 1.00 16.27 ? 100 LYS A CA 1 ATOM 744 C C . LYS A 1 99 ? 39.818 -15.929 1.827 1.00 15.06 ? 100 LYS A C 1 ATOM 745 O O . LYS A 1 99 ? 39.935 -14.863 2.430 1.00 14.41 ? 100 LYS A O 1 ATOM 746 C CB . LYS A 1 99 ? 38.455 -15.817 -0.268 1.00 18.05 ? 100 LYS A CB 1 ATOM 747 C CG . LYS A 1 99 ? 38.553 -15.520 -1.798 1.00 22.10 ? 100 LYS A CG 1 ATOM 748 C CD . LYS A 1 99 ? 38.910 -14.073 -2.011 1.00 25.71 ? 100 LYS A CD 1 ATOM 749 C CE . LYS A 1 99 ? 39.242 -13.751 -3.466 1.00 29.90 ? 100 LYS A CE 1 ATOM 750 N NZ . LYS A 1 99 ? 38.976 -12.308 -3.505 1.00 31.20 ? 100 LYS A NZ 1 ATOM 751 N N . LEU A 1 100 ? 39.730 -17.118 2.432 1.00 14.15 ? 101 LEU A N 1 ATOM 752 C CA . LEU A 1 100 ? 39.947 -17.301 3.919 1.00 13.99 ? 101 LEU A CA 1 ATOM 753 C C . LEU A 1 100 ? 41.346 -16.892 4.415 1.00 12.88 ? 101 LEU A C 1 ATOM 754 O O . LEU A 1 100 ? 41.435 -16.127 5.350 1.00 13.53 ? 101 LEU A O 1 ATOM 755 C CB . LEU A 1 100 ? 39.646 -18.764 4.369 1.00 13.16 ? 101 LEU A CB 1 ATOM 756 C CG . LEU A 1 100 ? 38.269 -19.228 3.867 1.00 13.06 ? 101 LEU A CG 1 ATOM 757 C CD1 . LEU A 1 100 ? 37.939 -20.657 4.245 1.00 13.56 ? 101 LEU A CD1 1 ATOM 758 C CD2 . LEU A 1 100 ? 37.142 -18.285 4.355 1.00 13.37 ? 101 LEU A CD2 1 ATOM 759 N N . LEU A 1 101 ? 42.417 -17.341 3.759 1.00 13.18 ? 102 LEU A N 1 ATOM 760 C CA . LEU A 1 101 ? 43.733 -17.000 4.180 1.00 12.89 ? 102 LEU A CA 1 ATOM 761 C C . LEU A 1 101 ? 43.976 -15.503 3.924 1.00 12.88 ? 102 LEU A C 1 ATOM 762 O O . LEU A 1 101 ? 44.560 -14.820 4.771 1.00 13.44 ? 102 LEU A O 1 ATOM 763 C CB . LEU A 1 101 ? 44.778 -17.887 3.552 1.00 12.95 ? 102 LEU A CB 1 ATOM 764 C CG . LEU A 1 101 ? 46.203 -17.517 3.983 1.00 13.36 ? 102 LEU A CG 1 ATOM 765 C CD1 . LEU A 1 101 ? 46.421 -17.623 5.512 1.00 15.16 ? 102 LEU A CD1 1 ATOM 766 C CD2 . LEU A 1 101 ? 47.220 -18.290 3.184 1.00 13.03 ? 102 LEU A CD2 1 ATOM 767 N N . SER A 1 102 ? 43.485 -14.998 2.802 1.00 13.36 ? 103 SER A N 1 ATOM 768 C CA . SER A 1 102 ? 43.600 -13.552 2.457 1.00 14.50 ? 103 SER A CA 1 ATOM 769 C C . SER A 1 102 ? 42.951 -12.668 3.513 1.00 13.84 ? 103 SER A C 1 ATOM 770 O O . SER A 1 102 ? 43.581 -11.764 4.043 1.00 14.29 ? 103 SER A O 1 ATOM 771 C CB . SER A 1 102 ? 43.031 -13.250 1.043 1.00 14.47 ? 103 SER A CB 1 ATOM 772 O OG . SER A 1 102 ? 43.880 -13.896 0.088 1.00 16.07 ? 103 SER A OG 1 ATOM 773 N N . HIS A 1 103 ? 41.729 -12.994 3.862 1.00 14.44 ? 104 HIS A N 1 ATOM 774 C CA . HIS A 1 103 ? 41.030 -12.282 4.919 1.00 15.78 ? 104 HIS A CA 1 ATOM 775 C C . HIS A 1 103 ? 41.892 -12.341 6.272 1.00 16.99 ? 104 HIS A C 1 ATOM 776 O O . HIS A 1 103 ? 42.111 -11.323 6.969 1.00 15.35 ? 104 HIS A O 1 ATOM 777 C CB . HIS A 1 103 ? 39.662 -12.936 5.086 1.00 15.87 ? 104 HIS A CB 1 ATOM 778 C CG . HIS A 1 103 ? 38.941 -12.497 6.317 1.00 15.40 ? 104 HIS A CG 1 ATOM 779 N ND1 . HIS A 1 103 ? 38.535 -11.201 6.500 1.00 13.46 ? 104 HIS A ND1 1 ATOM 780 C CD2 . HIS A 1 103 ? 38.603 -13.166 7.450 1.00 14.46 ? 104 HIS A CD2 1 ATOM 781 C CE1 . HIS A 1 103 ? 37.992 -11.069 7.686 1.00 15.10 ? 104 HIS A CE1 1 ATOM 782 N NE2 . HIS A 1 103 ? 38.007 -12.253 8.280 1.00 15.61 ? 104 HIS A NE2 1 ATOM 783 N N . CYS A 1 104 ? 42.403 -13.524 6.603 1.00 16.79 ? 105 CYS A N 1 ATOM 784 C CA . CYS A 1 104 ? 43.132 -13.673 7.880 1.00 16.61 ? 105 CYS A CA 1 ATOM 785 C C . CYS A 1 104 ? 44.446 -12.910 7.885 1.00 14.98 ? 105 CYS A C 1 ATOM 786 O O . CYS A 1 104 ? 44.806 -12.404 8.901 1.00 13.38 ? 105 CYS A O 1 ATOM 787 C CB . CYS A 1 104 ? 43.371 -15.117 8.252 1.00 16.25 ? 105 CYS A CB 1 ATOM 788 S SG . CYS A 1 104 ? 41.809 -15.957 8.682 1.00 18.14 ? 105 CYS A SG 1 ATOM 789 N N . LEU A 1 105 ? 45.096 -12.768 6.725 1.00 16.65 ? 106 LEU A N 1 ATOM 790 C CA . LEU A 1 105 ? 46.265 -11.901 6.627 1.00 17.55 ? 106 LEU A CA 1 ATOM 791 C C . LEU A 1 105 ? 45.935 -10.438 6.882 1.00 16.54 ? 106 LEU A C 1 ATOM 792 O O . LEU A 1 105 ? 46.698 -9.727 7.589 1.00 16.43 ? 106 LEU A O 1 ATOM 793 C CB . LEU A 1 105 ? 46.978 -12.034 5.291 1.00 19.70 ? 106 LEU A CB 1 ATOM 794 C CG . LEU A 1 105 ? 47.834 -13.302 5.063 1.00 26.00 ? 106 LEU A CG 1 ATOM 795 C CD1 . LEU A 1 105 ? 48.016 -13.747 3.601 1.00 28.50 ? 106 LEU A CD1 1 ATOM 796 C CD2 . LEU A 1 105 ? 49.205 -13.139 5.698 1.00 29.74 ? 106 LEU A CD2 1 ATOM 797 N N . LEU A 1 106 ? 44.858 -9.986 6.260 1.00 16.09 ? 107 LEU A N 1 ATOM 798 C CA . LEU A 1 106 ? 44.352 -8.653 6.458 1.00 16.02 ? 107 LEU A CA 1 ATOM 799 C C . LEU A 1 106 ? 44.024 -8.410 7.915 1.00 17.29 ? 107 LEU A C 1 ATOM 800 O O . LEU A 1 106 ? 44.377 -7.355 8.465 1.00 16.76 ? 107 LEU A O 1 ATOM 801 C CB . LEU A 1 106 ? 43.154 -8.346 5.575 1.00 16.41 ? 107 LEU A CB 1 ATOM 802 C CG . LEU A 1 106 ? 43.377 -8.310 4.031 1.00 15.67 ? 107 LEU A CG 1 ATOM 803 C CD1 . LEU A 1 106 ? 42.093 -8.194 3.251 1.00 17.32 ? 107 LEU A CD1 1 ATOM 804 C CD2 . LEU A 1 106 ? 44.329 -7.256 3.511 1.00 14.33 ? 107 LEU A CD2 1 ATOM 805 N N . VAL A 1 107 ? 43.359 -9.355 8.561 1.00 16.26 ? 108 VAL A N 1 ATOM 806 C CA . VAL A 1 107 ? 43.021 -9.196 9.983 1.00 15.57 ? 108 VAL A CA 1 ATOM 807 C C . VAL A 1 107 ? 44.275 -9.036 10.840 1.00 16.14 ? 108 VAL A C 1 ATOM 808 O O . VAL A 1 107 ? 44.317 -8.192 11.729 1.00 16.99 ? 108 VAL A O 1 ATOM 809 C CB . VAL A 1 107 ? 42.151 -10.366 10.483 1.00 15.91 ? 108 VAL A CB 1 ATOM 810 C CG1 . VAL A 1 107 ? 42.154 -10.464 11.988 1.00 14.22 ? 108 VAL A CG1 1 ATOM 811 C CG2 . VAL A 1 107 ? 40.696 -10.299 9.940 1.00 17.62 ? 108 VAL A CG2 1 ATOM 812 N N . THR A 1 108 ? 45.277 -9.850 10.536 1.00 15.43 ? 109 THR A N 1 ATOM 813 C CA . THR A 1 108 ? 46.572 -9.870 11.225 1.00 15.34 ? 109 THR A CA 1 ATOM 814 C C . THR A 1 108 ? 47.305 -8.542 11.039 1.00 17.50 ? 109 THR A C 1 ATOM 815 O O . THR A 1 108 ? 47.824 -7.976 12.011 1.00 16.78 ? 109 THR A O 1 ATOM 816 C CB . THR A 1 108 ? 47.433 -11.017 10.666 1.00 14.28 ? 109 THR A CB 1 ATOM 817 O OG1 . THR A 1 108 ? 46.794 -12.259 10.979 1.00 14.05 ? 109 THR A OG1 1 ATOM 818 C CG2 . THR A 1 108 ? 48.866 -11.055 11.261 1.00 14.85 ? 109 THR A CG2 1 ATOM 819 N N . LEU A 1 109 ? 47.322 -8.010 9.808 1.00 18.00 ? 110 LEU A N 1 ATOM 820 C CA . LEU A 1 109 ? 47.952 -6.694 9.562 1.00 18.68 ? 110 LEU A CA 1 ATOM 821 C C . LEU A 1 109 ? 47.224 -5.610 10.326 1.00 18.48 ? 110 LEU A C 1 ATOM 822 O O . LEU A 1 109 ? 47.861 -4.718 10.886 1.00 19.45 ? 110 LEU A O 1 ATOM 823 C CB . LEU A 1 109 ? 47.964 -6.313 8.066 1.00 19.24 ? 110 LEU A CB 1 ATOM 824 C CG . LEU A 1 109 ? 48.937 -7.205 7.286 1.00 23.78 ? 110 LEU A CG 1 ATOM 825 C CD1 . LEU A 1 109 ? 48.795 -7.102 5.764 1.00 27.73 ? 110 LEU A CD1 1 ATOM 826 C CD2 . LEU A 1 109 ? 50.337 -6.882 7.680 1.00 25.36 ? 110 LEU A CD2 1 ATOM 827 N N . ALA A 1 110 ? 45.893 -5.644 10.300 1.00 19.21 ? 111 ALA A N 1 ATOM 828 C CA . ALA A 1 110 ? 45.095 -4.626 11.009 1.00 20.58 ? 111 ALA A CA 1 ATOM 829 C C . ALA A 1 110 ? 45.343 -4.576 12.540 1.00 20.04 ? 111 ALA A C 1 ATOM 830 O O . ALA A 1 110 ? 45.320 -3.510 13.218 1.00 18.46 ? 111 ALA A O 1 ATOM 831 C CB . ALA A 1 110 ? 43.631 -4.852 10.710 1.00 22.00 ? 111 ALA A CB 1 ATOM 832 N N . ALA A 1 111 ? 45.513 -5.764 13.079 1.00 20.19 ? 112 ALA A N 1 ATOM 833 C CA . ALA A 1 111 ? 45.735 -5.940 14.487 1.00 20.90 ? 112 ALA A CA 1 ATOM 834 C C . ALA A 1 111 ? 47.161 -5.543 14.838 1.00 22.33 ? 112 ALA A C 1 ATOM 835 O O . ALA A 1 111 ? 47.320 -4.996 15.912 1.00 21.54 ? 112 ALA A O 1 ATOM 836 C CB . ALA A 1 111 ? 45.468 -7.373 14.968 1.00 20.17 ? 112 ALA A CB 1 ATOM 837 N N . HIS A 1 112 ? 48.142 -5.791 13.962 1.00 19.65 ? 113 HIS A N 1 ATOM 838 C CA . HIS A 1 112 ? 49.526 -5.503 14.255 1.00 19.80 ? 113 HIS A CA 1 ATOM 839 C C . HIS A 1 112 ? 50.020 -4.126 13.835 1.00 22.54 ? 113 HIS A C 1 ATOM 840 O O . HIS A 1 112 ? 50.791 -3.577 14.574 1.00 21.65 ? 113 HIS A O 1 ATOM 841 C CB . HIS A 1 112 ? 50.509 -6.549 13.691 1.00 19.12 ? 113 HIS A CB 1 ATOM 842 C CG . HIS A 1 112 ? 50.599 -7.792 14.518 1.00 18.78 ? 113 HIS A CG 1 ATOM 843 N ND1 . HIS A 1 112 ? 51.462 -7.916 15.594 1.00 19.75 ? 113 HIS A ND1 1 ATOM 844 C CD2 . HIS A 1 112 ? 49.866 -8.936 14.489 1.00 17.86 ? 113 HIS A CD2 1 ATOM 845 C CE1 . HIS A 1 112 ? 51.299 -9.120 16.152 1.00 19.90 ? 113 HIS A CE1 1 ATOM 846 N NE2 . HIS A 1 112 ? 50.345 -9.757 15.499 1.00 18.52 ? 113 HIS A NE2 1 ATOM 847 N N . LEU A 1 113 ? 49.577 -3.597 12.691 1.00 21.47 ? 114 LEU A N 1 ATOM 848 C CA . LEU A 1 113 ? 50.047 -2.319 12.120 1.00 19.83 ? 114 LEU A CA 1 ATOM 849 C C . LEU A 1 113 ? 48.850 -1.393 11.826 1.00 17.59 ? 114 LEU A C 1 ATOM 850 O O . LEU A 1 113 ? 48.642 -0.991 10.689 1.00 16.93 ? 114 LEU A O 1 ATOM 851 C CB . LEU A 1 113 ? 50.851 -2.560 10.853 1.00 17.50 ? 114 LEU A CB 1 ATOM 852 C CG . LEU A 1 113 ? 52.126 -3.380 10.962 1.00 20.17 ? 114 LEU A CG 1 ATOM 853 C CD1 . LEU A 1 113 ? 52.710 -3.633 9.595 1.00 20.85 ? 114 LEU A CD1 1 ATOM 854 C CD2 . LEU A 1 113 ? 53.192 -2.771 11.871 1.00 21.38 ? 114 LEU A CD2 1 ATOM 855 N N . PRO A 1 114 ? 48.069 -1.054 12.855 1.00 17.67 ? 115 PRO A N 1 ATOM 856 C CA . PRO A 1 114 ? 46.886 -0.248 12.691 1.00 18.81 ? 115 PRO A CA 1 ATOM 857 C C . PRO A 1 114 ? 47.233 1.133 12.073 1.00 20.37 ? 115 PRO A C 1 ATOM 858 O O . PRO A 1 114 ? 46.561 1.555 11.188 1.00 20.80 ? 115 PRO A O 1 ATOM 859 C CB . PRO A 1 114 ? 46.296 -0.159 14.084 1.00 19.19 ? 115 PRO A CB 1 ATOM 860 C CG . PRO A 1 114 ? 47.392 -0.530 15.012 1.00 17.62 ? 115 PRO A CG 1 ATOM 861 C CD . PRO A 1 114 ? 48.302 -1.423 14.255 1.00 18.41 ? 115 PRO A CD 1 ATOM 862 N N . ALA A 1 115 ? 48.373 1.706 12.375 1.00 20.78 ? 116 ALA A N 1 ATOM 863 C CA . ALA A 1 115 ? 48.723 2.953 11.752 1.00 22.96 ? 116 ALA A CA 1 ATOM 864 C C . ALA A 1 115 ? 48.917 2.831 10.222 1.00 23.92 ? 116 ALA A C 1 ATOM 865 O O . ALA A 1 115 ? 48.663 3.784 9.495 1.00 26.29 ? 116 ALA A O 1 ATOM 866 C CB . ALA A 1 115 ? 49.981 3.493 12.420 1.00 23.88 ? 116 ALA A CB 1 ATOM 867 N N . GLU A 1 116 ? 49.369 1.675 9.725 1.00 24.16 ? 117 GLU A N 1 ATOM 868 C CA . GLU A 1 116 ? 49.599 1.489 8.278 1.00 23.33 ? 117 GLU A CA 1 ATOM 869 C C . GLU A 1 116 ? 48.330 1.027 7.538 1.00 23.24 ? 117 GLU A C 1 ATOM 870 O O . GLU A 1 116 ? 48.251 1.134 6.308 1.00 22.63 ? 117 GLU A O 1 ATOM 871 C CB . GLU A 1 116 ? 50.664 0.433 8.033 1.00 26.43 ? 117 GLU A CB 1 ATOM 872 C CG . GLU A 1 116 ? 52.029 1.013 7.822 1.00 33.58 ? 117 GLU A CG 1 ATOM 873 C CD . GLU A 1 116 ? 52.433 1.939 8.954 1.00 36.37 ? 117 GLU A CD 1 ATOM 874 O OE1 . GLU A 1 116 ? 52.884 3.098 8.689 1.00 37.64 ? 117 GLU A OE1 1 ATOM 875 O OE2 . GLU A 1 116 ? 52.279 1.474 10.097 1.00 37.44 ? 117 GLU A OE2 1 ATOM 876 N N . PHE A 1 117 ? 47.413 0.427 8.275 1.00 19.72 ? 118 PHE A N 1 ATOM 877 C CA . PHE A 1 117 ? 46.173 -0.155 7.727 1.00 19.36 ? 118 PHE A CA 1 ATOM 878 C C . PHE A 1 117 ? 45.065 0.889 7.486 1.00 18.43 ? 118 PHE A C 1 ATOM 879 O O . PHE A 1 117 ? 43.952 0.804 8.023 1.00 19.00 ? 118 PHE A O 1 ATOM 880 C CB . PHE A 1 117 ? 45.692 -1.277 8.641 1.00 18.53 ? 118 PHE A CB 1 ATOM 881 C CG . PHE A 1 117 ? 44.736 -2.247 7.991 1.00 18.15 ? 118 PHE A CG 1 ATOM 882 C CD1 . PHE A 1 117 ? 45.198 -3.147 7.056 1.00 19.05 ? 118 PHE A CD1 1 ATOM 883 C CD2 . PHE A 1 117 ? 43.363 -2.243 8.325 1.00 19.37 ? 118 PHE A CD2 1 ATOM 884 C CE1 . PHE A 1 117 ? 44.317 -4.069 6.459 1.00 18.74 ? 118 PHE A CE1 1 ATOM 885 C CE2 . PHE A 1 117 ? 42.474 -3.158 7.694 1.00 19.34 ? 118 PHE A CE2 1 ATOM 886 C CZ . PHE A 1 117 ? 42.985 -4.060 6.758 1.00 17.12 ? 118 PHE A CZ 1 ATOM 887 N N . THR A 1 118 ? 45.380 1.875 6.652 1.00 17.96 ? 119 THR A N 1 ATOM 888 C CA . THR A 1 118 ? 44.394 2.832 6.240 1.00 19.25 ? 119 THR A CA 1 ATOM 889 C C . THR A 1 118 ? 43.410 2.188 5.222 1.00 19.43 ? 119 THR A C 1 ATOM 890 O O . THR A 1 118 ? 43.688 1.154 4.662 1.00 17.00 ? 119 THR A O 1 ATOM 891 C CB . THR A 1 118 ? 45.044 4.050 5.587 1.00 19.39 ? 119 THR A CB 1 ATOM 892 O OG1 . THR A 1 118 ? 45.669 3.644 4.366 1.00 19.25 ? 119 THR A OG1 1 ATOM 893 C CG2 . THR A 1 118 ? 46.045 4.694 6.561 1.00 20.61 ? 119 THR A CG2 1 ATOM 894 N N . PRO A 1 119 ? 42.261 2.822 5.009 1.00 19.57 ? 120 PRO A N 1 ATOM 895 C CA . PRO A 1 119 ? 41.336 2.355 3.974 1.00 21.23 ? 120 PRO A CA 1 ATOM 896 C C . PRO A 1 119 ? 41.961 2.100 2.589 1.00 18.58 ? 120 PRO A C 1 ATOM 897 O O . PRO A 1 119 ? 41.709 1.022 1.979 1.00 15.54 ? 120 PRO A O 1 ATOM 898 C CB . PRO A 1 119 ? 40.308 3.477 3.923 1.00 22.05 ? 120 PRO A CB 1 ATOM 899 C CG . PRO A 1 119 ? 40.284 4.016 5.330 1.00 22.46 ? 120 PRO A CG 1 ATOM 900 C CD . PRO A 1 119 ? 41.749 4.025 5.702 1.00 22.55 ? 120 PRO A CD 1 ATOM 901 N N . ALA A 1 120 ? 42.780 3.043 2.121 1.00 16.65 ? 121 ALA A N 1 ATOM 902 C CA . ALA A 1 120 ? 43.407 2.898 0.828 1.00 18.96 ? 121 ALA A CA 1 ATOM 903 C C . ALA A 1 120 ? 44.395 1.752 0.770 1.00 18.79 ? 121 ALA A C 1 ATOM 904 O O . ALA A 1 120 ? 44.486 1.028 -0.237 1.00 16.40 ? 121 ALA A O 1 ATOM 905 C CB . ALA A 1 120 ? 44.110 4.224 0.397 1.00 20.43 ? 121 ALA A CB 1 ATOM 906 N N . VAL A 1 121 ? 45.157 1.580 1.845 1.00 18.78 ? 122 VAL A N 1 ATOM 907 C CA . VAL A 1 121 ? 46.140 0.517 1.874 1.00 18.47 ? 122 VAL A CA 1 ATOM 908 C C . VAL A 1 121 ? 45.437 -0.843 1.949 1.00 16.83 ? 122 VAL A C 1 ATOM 909 O O . VAL A 1 121 ? 45.891 -1.822 1.330 1.00 16.46 ? 122 VAL A O 1 ATOM 910 C CB . VAL A 1 121 ? 47.131 0.725 3.054 1.00 20.54 ? 122 VAL A CB 1 ATOM 911 C CG1 . VAL A 1 121 ? 47.908 -0.498 3.383 1.00 20.16 ? 122 VAL A CG1 1 ATOM 912 C CG2 . VAL A 1 121 ? 48.155 1.822 2.699 1.00 24.08 ? 122 VAL A CG2 1 ATOM 913 N N . HIS A 1 122 ? 44.341 -0.856 2.705 1.00 15.89 ? 123 HIS A N 1 ATOM 914 C CA . HIS A 1 122 ? 43.484 -2.045 2.888 1.00 16.09 ? 123 HIS A CA 1 ATOM 915 C C . HIS A 1 122 ? 42.956 -2.439 1.493 1.00 16.23 ? 123 HIS A C 1 ATOM 916 O O . HIS A 1 122 ? 43.043 -3.605 1.113 1.00 16.52 ? 123 HIS A O 1 ATOM 917 C CB . HIS A 1 122 ? 42.392 -1.724 3.909 1.00 15.43 ? 123 HIS A CB 1 ATOM 918 C CG . HIS A 1 122 ? 41.377 -2.805 4.146 1.00 17.25 ? 123 HIS A CG 1 ATOM 919 N ND1 . HIS A 1 122 ? 40.356 -2.645 5.063 1.00 18.50 ? 123 HIS A ND1 1 ATOM 920 C CD2 . HIS A 1 122 ? 41.154 -4.006 3.551 1.00 16.64 ? 123 HIS A CD2 1 ATOM 921 C CE1 . HIS A 1 122 ? 39.548 -3.691 5.034 1.00 17.76 ? 123 HIS A CE1 1 ATOM 922 N NE2 . HIS A 1 122 ? 40.028 -4.551 4.144 1.00 20.07 ? 123 HIS A NE2 1 ATOM 923 N N . ALA A 1 123 ? 42.529 -1.453 0.687 1.00 16.85 ? 124 ALA A N 1 ATOM 924 C CA . ALA A 1 123 ? 41.987 -1.724 -0.617 1.00 15.94 ? 124 ALA A CA 1 ATOM 925 C C . ALA A 1 123 ? 43.050 -2.284 -1.512 1.00 16.82 ? 124 ALA A C 1 ATOM 926 O O . ALA A 1 123 ? 42.824 -3.316 -2.154 1.00 16.79 ? 124 ALA A O 1 ATOM 927 C CB . ALA A 1 123 ? 41.397 -0.465 -1.219 1.00 16.70 ? 124 ALA A CB 1 ATOM 928 N N . SER A 1 124 ? 44.249 -1.653 -1.542 1.00 15.97 ? 125 SER A N 1 ATOM 929 C CA . SER A 1 124 ? 45.316 -2.108 -2.409 1.00 15.33 ? 125 SER A CA 1 ATOM 930 C C . SER A 1 124 ? 45.783 -3.552 -2.060 1.00 16.42 ? 125 SER A C 1 ATOM 931 O O . SER A 1 124 ? 46.100 -4.361 -2.952 1.00 15.58 ? 125 SER A O 1 ATOM 932 C CB . SER A 1 124 ? 46.469 -1.152 -2.358 1.00 16.14 ? 125 SER A CB 1 ATOM 933 O OG . SER A 1 124 ? 46.035 0.075 -2.950 1.00 16.06 ? 125 SER A OG 1 ATOM 934 N N . LEU A 1 125 ? 45.922 -3.822 -0.762 1.00 15.23 ? 126 LEU A N 1 ATOM 935 C CA . LEU A 1 125 ? 46.340 -5.186 -0.292 1.00 14.96 ? 126 LEU A CA 1 ATOM 936 C C . LEU A 1 125 ? 45.305 -6.231 -0.634 1.00 14.41 ? 126 LEU A C 1 ATOM 937 O O . LEU A 1 125 ? 45.660 -7.305 -0.996 1.00 14.75 ? 126 LEU A O 1 ATOM 938 C CB . LEU A 1 125 ? 46.626 -5.176 1.202 1.00 13.64 ? 126 LEU A CB 1 ATOM 939 C CG . LEU A 1 125 ? 47.893 -4.385 1.666 1.00 14.84 ? 126 LEU A CG 1 ATOM 940 C CD1 . LEU A 1 125 ? 47.990 -4.402 3.140 1.00 16.86 ? 126 LEU A CD1 1 ATOM 941 C CD2 . LEU A 1 125 ? 49.156 -4.978 1.154 1.00 16.86 ? 126 LEU A CD2 1 ATOM 942 N N . ASP A 1 126 ? 44.045 -5.934 -0.404 1.00 15.71 ? 127 ASP A N 1 ATOM 943 C CA . ASP A 1 126 ? 42.956 -6.865 -0.769 1.00 18.45 ? 127 ASP A CA 1 ATOM 944 C C . ASP A 1 126 ? 42.988 -7.208 -2.255 1.00 16.93 ? 127 ASP A C 1 ATOM 945 O O . ASP A 1 126 ? 42.813 -8.320 -2.607 1.00 16.23 ? 127 ASP A O 1 ATOM 946 C CB . ASP A 1 126 ? 41.564 -6.293 -0.429 1.00 18.94 ? 127 ASP A CB 1 ATOM 947 C CG . ASP A 1 126 ? 40.427 -7.330 -0.647 1.00 21.75 ? 127 ASP A CG 1 ATOM 948 O OD1 . ASP A 1 126 ? 39.938 -7.441 -1.727 1.00 25.95 ? 127 ASP A OD1 1 ATOM 949 O OD2 . ASP A 1 126 ? 39.994 -8.039 0.266 1.00 29.93 ? 127 ASP A OD2 1 ATOM 950 N N . LYS A 1 127 ? 43.212 -6.212 -3.093 1.00 17.16 ? 128 LYS A N 1 ATOM 951 C CA . LYS A 1 127 ? 43.361 -6.412 -4.502 1.00 19.47 ? 128 LYS A CA 1 ATOM 952 C C . LYS A 1 127 ? 44.606 -7.230 -4.831 1.00 17.89 ? 128 LYS A C 1 ATOM 953 O O . LYS A 1 127 ? 44.581 -8.121 -5.681 1.00 16.03 ? 128 LYS A O 1 ATOM 954 C CB . LYS A 1 127 ? 43.388 -5.048 -5.191 1.00 23.53 ? 128 LYS A CB 1 ATOM 955 C CG . LYS A 1 127 ? 42.873 -5.105 -6.578 1.00 30.87 ? 128 LYS A CG 1 ATOM 956 C CD . LYS A 1 127 ? 43.025 -3.781 -7.271 1.00 36.58 ? 128 LYS A CD 1 ATOM 957 C CE . LYS A 1 127 ? 42.081 -2.758 -6.688 1.00 43.02 ? 128 LYS A CE 1 ATOM 958 N NZ . LYS A 1 127 ? 41.680 -1.845 -7.818 1.00 52.63 ? 128 LYS A NZ 1 ATOM 959 N N . PHE A 1 128 ? 45.696 -6.964 -4.125 1.00 15.60 ? 129 PHE A N 1 ATOM 960 C CA . PHE A 1 128 ? 46.941 -7.696 -4.366 1.00 15.66 ? 129 PHE A CA 1 ATOM 961 C C . PHE A 1 128 ? 46.681 -9.190 -4.017 1.00 13.84 ? 129 PHE A C 1 ATOM 962 O O . PHE A 1 128 ? 47.066 -10.083 -4.787 1.00 12.82 ? 129 PHE A O 1 ATOM 963 C CB . PHE A 1 128 ? 48.123 -7.134 -3.552 1.00 15.60 ? 129 PHE A CB 1 ATOM 964 C CG . PHE A 1 128 ? 49.341 -8.024 -3.505 1.00 15.88 ? 129 PHE A CG 1 ATOM 965 C CD1 . PHE A 1 128 ? 50.197 -8.087 -4.586 1.00 15.55 ? 129 PHE A CD1 1 ATOM 966 C CD2 . PHE A 1 128 ? 49.679 -8.686 -2.337 1.00 15.65 ? 129 PHE A CD2 1 ATOM 967 C CE1 . PHE A 1 128 ? 51.326 -8.910 -4.549 1.00 16.09 ? 129 PHE A CE1 1 ATOM 968 C CE2 . PHE A 1 128 ? 50.846 -9.456 -2.275 1.00 15.43 ? 129 PHE A CE2 1 ATOM 969 C CZ . PHE A 1 128 ? 51.651 -9.571 -3.384 1.00 16.18 ? 129 PHE A CZ 1 ATOM 970 N N . LEU A 1 129 ? 46.092 -9.437 -2.861 1.00 13.05 ? 130 LEU A N 1 ATOM 971 C CA . LEU A 1 129 ? 45.923 -10.809 -2.411 1.00 15.11 ? 130 LEU A CA 1 ATOM 972 C C . LEU A 1 129 ? 44.877 -11.566 -3.275 1.00 14.92 ? 130 LEU A C 1 ATOM 973 O O . LEU A 1 129 ? 44.962 -12.765 -3.485 1.00 14.96 ? 130 LEU A O 1 ATOM 974 C CB . LEU A 1 129 ? 45.535 -10.828 -0.941 1.00 14.53 ? 130 LEU A CB 1 ATOM 975 C CG . LEU A 1 129 ? 46.561 -10.354 0.051 1.00 14.17 ? 130 LEU A CG 1 ATOM 976 C CD1 . LEU A 1 129 ? 45.950 -10.252 1.475 1.00 14.90 ? 130 LEU A CD1 1 ATOM 977 C CD2 . LEU A 1 129 ? 47.759 -11.269 0.059 1.00 14.29 ? 130 LEU A CD2 1 ATOM 978 N N . ALA A 1 130 ? 43.911 -10.821 -3.778 1.00 15.44 ? 131 ALA A N 1 ATOM 979 C CA . ALA A 1 130 ? 42.964 -11.380 -4.735 1.00 17.73 ? 131 ALA A CA 1 ATOM 980 C C . ALA A 1 130 ? 43.662 -11.722 -6.101 1.00 17.62 ? 131 ALA A C 1 ATOM 981 O O . ALA A 1 130 ? 43.350 -12.786 -6.703 1.00 15.72 ? 131 ALA A O 1 ATOM 982 C CB . ALA A 1 130 ? 41.773 -10.429 -4.899 1.00 18.62 ? 131 ALA A CB 1 ATOM 983 N N . SER A 1 131 ? 44.661 -10.924 -6.534 1.00 14.81 ? 132 SER A N 1 ATOM 984 C CA . SER A 1 131 ? 45.472 -11.332 -7.675 1.00 15.27 ? 132 SER A CA 1 ATOM 985 C C . SER A 1 131 ? 46.317 -12.571 -7.398 1.00 12.95 ? 132 SER A C 1 ATOM 986 O O . SER A 1 131 ? 46.387 -13.453 -8.251 1.00 12.72 ? 132 SER A O 1 ATOM 987 C CB . SER A 1 131 ? 46.443 -10.256 -8.205 1.00 16.66 ? 132 SER A CB 1 ATOM 988 O OG . SER A 1 131 ? 45.734 -9.221 -8.790 1.00 19.15 ? 132 SER A OG 1 ATOM 989 N N . VAL A 1 132 ? 46.920 -12.652 -6.215 1.00 12.73 ? 133 VAL A N 1 ATOM 990 C CA . VAL A 1 132 ? 47.710 -13.872 -5.839 1.00 12.35 ? 133 VAL A CA 1 ATOM 991 C C . VAL A 1 132 ? 46.780 -15.095 -5.817 1.00 11.89 ? 133 VAL A C 1 ATOM 992 O O . VAL A 1 132 ? 47.114 -16.142 -6.381 1.00 13.33 ? 133 VAL A O 1 ATOM 993 C CB . VAL A 1 132 ? 48.505 -13.712 -4.557 1.00 12.36 ? 133 VAL A CB 1 ATOM 994 C CG1 . VAL A 1 132 ? 49.078 -15.029 -4.072 1.00 12.97 ? 133 VAL A CG1 1 ATOM 995 C CG2 . VAL A 1 132 ? 49.631 -12.673 -4.751 1.00 13.48 ? 133 VAL A CG2 1 ATOM 996 N N . SER A 1 133 ? 45.643 -14.934 -5.198 1.00 12.47 ? 134 SER A N 1 ATOM 997 C CA . SER A 1 133 ? 44.697 -16.013 -5.035 1.00 13.11 ? 134 SER A CA 1 ATOM 998 C C . SER A 1 133 ? 44.189 -16.492 -6.376 1.00 13.28 ? 134 SER A C 1 ATOM 999 O O . SER A 1 133 ? 43.891 -17.657 -6.541 1.00 13.95 ? 134 SER A O 1 ATOM 1000 C CB . SER A 1 133 ? 43.527 -15.554 -4.205 1.00 14.05 ? 134 SER A CB 1 ATOM 1001 O OG . SER A 1 133 ? 43.887 -15.255 -2.880 1.00 14.36 ? 134 SER A OG 1 ATOM 1002 N N . THR A 1 134 ? 44.008 -15.574 -7.327 1.00 14.14 ? 135 THR A N 1 ATOM 1003 C CA . THR A 1 134 ? 43.558 -15.950 -8.658 1.00 14.61 ? 135 THR A CA 1 ATOM 1004 C C . THR A 1 134 ? 44.639 -16.711 -9.415 1.00 15.70 ? 135 THR A C 1 ATOM 1005 O O . THR A 1 134 ? 44.408 -17.809 -9.908 1.00 14.93 ? 135 THR A O 1 ATOM 1006 C CB . THR A 1 134 ? 43.039 -14.741 -9.431 1.00 16.51 ? 135 THR A CB 1 ATOM 1007 O OG1 . THR A 1 134 ? 42.056 -14.102 -8.618 1.00 16.05 ? 135 THR A OG1 1 ATOM 1008 C CG2 . THR A 1 134 ? 42.374 -15.202 -10.730 1.00 16.16 ? 135 THR A CG2 1 ATOM 1009 N N . VAL A 1 135 ? 45.852 -16.174 -9.444 1.00 15.25 ? 136 VAL A N 1 ATOM 1010 C CA . VAL A 1 135 ? 46.989 -16.918 -10.023 1.00 14.21 ? 136 VAL A CA 1 ATOM 1011 C C . VAL A 1 135 ? 47.134 -18.319 -9.445 1.00 14.10 ? 136 VAL A C 1 ATOM 1012 O O . VAL A 1 135 ? 47.342 -19.270 -10.197 1.00 14.42 ? 136 VAL A O 1 ATOM 1013 C CB . VAL A 1 135 ? 48.292 -16.140 -9.865 1.00 15.35 ? 136 VAL A CB 1 ATOM 1014 C CG1 . VAL A 1 135 ? 49.451 -16.970 -10.255 1.00 15.95 ? 136 VAL A CG1 1 ATOM 1015 C CG2 . VAL A 1 135 ? 48.235 -14.817 -10.607 1.00 16.51 ? 136 VAL A CG2 1 ATOM 1016 N N . LEU A 1 136 ? 46.958 -18.493 -8.135 1.00 13.37 ? 137 LEU A N 1 ATOM 1017 C CA . LEU A 1 136 ? 47.162 -19.795 -7.521 1.00 14.94 ? 137 LEU A CA 1 ATOM 1018 C C . LEU A 1 136 ? 45.992 -20.761 -7.748 1.00 16.42 ? 137 LEU A C 1 ATOM 1019 O O . LEU A 1 136 ? 46.109 -21.983 -7.430 1.00 18.28 ? 137 LEU A O 1 ATOM 1020 C CB . LEU A 1 136 ? 47.481 -19.686 -5.997 1.00 15.82 ? 137 LEU A CB 1 ATOM 1021 C CG . LEU A 1 136 ? 48.767 -18.911 -5.644 1.00 15.39 ? 137 LEU A CG 1 ATOM 1022 C CD1 . LEU A 1 136 ? 48.976 -18.745 -4.166 1.00 16.51 ? 137 LEU A CD1 1 ATOM 1023 C CD2 . LEU A 1 136 ? 49.942 -19.632 -6.254 1.00 14.96 ? 137 LEU A CD2 1 ATOM 1024 N N . THR A 1 137 ? 44.894 -20.249 -8.293 1.00 15.11 ? 138 THR A N 1 ATOM 1025 C CA . THR A 1 137 ? 43.720 -21.101 -8.530 1.00 15.56 ? 138 THR A CA 1 ATOM 1026 C C . THR A 1 137 ? 43.298 -21.238 -9.990 1.00 14.83 ? 138 THR A C 1 ATOM 1027 O O . THR A 1 137 ? 42.373 -22.018 -10.306 1.00 15.24 ? 138 THR A O 1 ATOM 1028 C CB . THR A 1 137 ? 42.518 -20.552 -7.740 1.00 16.32 ? 138 THR A CB 1 ATOM 1029 O OG1 . THR A 1 137 ? 42.229 -19.198 -8.133 1.00 16.76 ? 138 THR A OG1 1 ATOM 1030 C CG2 . THR A 1 137 ? 42.775 -20.632 -6.170 1.00 16.93 ? 138 THR A CG2 1 ATOM 1031 N N . SER A 1 138 ? 43.898 -20.490 -10.911 1.00 14.19 ? 139 SER A N 1 ATOM 1032 C CA . SER A 1 138 ? 43.376 -20.477 -12.277 1.00 13.99 ? 139 SER A CA 1 ATOM 1033 C C . SER A 1 138 ? 43.533 -21.817 -12.948 1.00 15.28 ? 139 SER A C 1 ATOM 1034 O O . SER A 1 138 ? 42.779 -22.064 -13.906 1.00 15.34 ? 139 SER A O 1 ATOM 1035 C CB . SER A 1 138 ? 44.026 -19.406 -13.143 1.00 14.67 ? 139 SER A CB 1 ATOM 1036 O OG . SER A 1 138 ? 45.402 -19.611 -13.116 1.00 15.40 ? 139 SER A OG 1 ATOM 1037 N N . LYS A 1 139 ? 44.500 -22.641 -12.486 1.00 15.43 ? 140 LYS A N 1 ATOM 1038 C CA . LYS A 1 139 ? 44.779 -24.005 -13.023 1.00 17.69 ? 140 LYS A CA 1 ATOM 1039 C C . LYS A 1 139 ? 43.972 -25.106 -12.347 1.00 18.90 ? 140 LYS A C 1 ATOM 1040 O O . LYS A 1 139 ? 44.058 -26.257 -12.747 1.00 21.59 ? 140 LYS A O 1 ATOM 1041 C CB . LYS A 1 139 ? 46.261 -24.351 -12.875 1.00 18.25 ? 140 LYS A CB 1 ATOM 1042 C CG . LYS A 1 139 ? 47.118 -23.449 -13.765 1.00 20.94 ? 140 LYS A CG 1 ATOM 1043 C CD . LYS A 1 139 ? 48.570 -23.511 -13.424 1.00 21.79 ? 140 LYS A CD 1 ATOM 1044 C CE . LYS A 1 139 ? 49.427 -22.625 -14.357 1.00 23.37 ? 140 LYS A CE 1 ATOM 1045 N NZ . LYS A 1 139 ? 50.830 -22.756 -13.835 1.00 27.13 ? 140 LYS A NZ 1 ATOM 1046 N N . TYR A 1 140 ? 43.215 -24.741 -11.312 1.00 18.93 ? 141 TYR A N 1 ATOM 1047 C CA . TYR A 1 140 ? 42.393 -25.682 -10.550 1.00 21.58 ? 141 TYR A CA 1 ATOM 1048 C C . TYR A 1 140 ? 41.333 -26.275 -11.460 1.00 21.66 ? 141 TYR A C 1 ATOM 1049 O O . TYR A 1 140 ? 40.604 -25.541 -12.104 1.00 20.32 ? 141 TYR A O 1 ATOM 1050 C CB . TYR A 1 140 ? 41.720 -25.001 -9.348 1.00 20.98 ? 141 TYR A CB 1 ATOM 1051 C CG . TYR A 1 140 ? 40.837 -25.885 -8.446 1.00 20.80 ? 141 TYR A CG 1 ATOM 1052 C CD1 . TYR A 1 140 ? 41.373 -26.652 -7.412 1.00 21.37 ? 141 TYR A CD1 1 ATOM 1053 C CD2 . TYR A 1 140 ? 39.446 -25.933 -8.625 1.00 20.73 ? 141 TYR A CD2 1 ATOM 1054 C CE1 . TYR A 1 140 ? 40.544 -27.460 -6.575 1.00 21.37 ? 141 TYR A CE1 1 ATOM 1055 C CE2 . TYR A 1 140 ? 38.619 -26.685 -7.770 1.00 20.53 ? 141 TYR A CE2 1 ATOM 1056 C CZ . TYR A 1 140 ? 39.178 -27.473 -6.755 1.00 22.15 ? 141 TYR A CZ 1 ATOM 1057 O OH . TYR A 1 140 ? 38.339 -28.216 -5.905 1.00 22.20 ? 141 TYR A OH 1 ATOM 1058 N N . ARG A 1 141 ? 41.162 -27.587 -11.360 1.00 24.79 ? 142 ARG A N 1 ATOM 1059 C CA . ARG A 1 141 ? 40.460 -28.415 -12.381 1.00 31.04 ? 142 ARG A CA 1 ATOM 1060 C C . ARG A 1 141 ? 39.774 -29.579 -11.687 1.00 31.76 ? 142 ARG A C 1 ATOM 1061 O O . ARG A 1 141 ? 40.029 -29.799 -10.486 1.00 32.36 ? 142 ARG A O 1 ATOM 1062 C CB . ARG A 1 141 ? 41.491 -29.144 -13.275 1.00 33.40 ? 142 ARG A CB 1 ATOM 1063 C CG . ARG A 1 141 ? 42.064 -28.402 -14.410 1.00 38.53 ? 142 ARG A CG 1 ATOM 1064 C CD . ARG A 1 141 ? 42.847 -29.353 -15.285 1.00 38.65 ? 142 ARG A CD 1 ATOM 1065 N NE . ARG A 1 141 ? 43.792 -30.159 -14.528 1.00 41.32 ? 142 ARG A NE 1 ATOM 1066 C CZ . ARG A 1 141 ? 44.961 -30.579 -15.020 1.00 49.63 ? 142 ARG A CZ 1 ATOM 1067 N NH1 . ARG A 1 141 ? 45.318 -30.270 -16.259 1.00 52.49 ? 142 ARG A NH1 1 ATOM 1068 N NH2 . ARG A 1 141 ? 45.790 -31.311 -14.267 1.00 52.06 ? 142 ARG A NH2 1 ATOM 1069 O OXT . ARG A 1 141 ? 39.094 -30.369 -12.371 1.00 28.10 ? 142 ARG A OXT 1 ATOM 1070 N N . HIS B 2 2 ? 26.019 -23.562 17.802 1.00 56.00 ? 3 HIS B N 1 ATOM 1071 C CA . HIS B 2 2 ? 26.322 -22.168 17.383 1.00 52.46 ? 3 HIS B CA 1 ATOM 1072 C C . HIS B 2 2 ? 27.485 -21.620 18.200 1.00 47.76 ? 3 HIS B C 1 ATOM 1073 O O . HIS B 2 2 ? 28.618 -21.986 17.947 1.00 42.66 ? 3 HIS B O 1 ATOM 1074 C CB . HIS B 2 2 ? 25.061 -21.313 17.500 1.00 56.32 ? 3 HIS B CB 1 ATOM 1075 C CG . HIS B 2 2 ? 24.545 -20.844 16.192 1.00 59.38 ? 3 HIS B CG 1 ATOM 1076 N ND1 . HIS B 2 2 ? 23.829 -19.675 16.062 1.00 63.79 ? 3 HIS B ND1 1 ATOM 1077 C CD2 . HIS B 2 2 ? 24.683 -21.349 14.943 1.00 68.22 ? 3 HIS B CD2 1 ATOM 1078 C CE1 . HIS B 2 2 ? 23.517 -19.494 14.791 1.00 65.40 ? 3 HIS B CE1 1 ATOM 1079 N NE2 . HIS B 2 2 ? 24.026 -20.495 14.090 1.00 68.48 ? 3 HIS B NE2 1 ATOM 1080 N N . LEU B 2 3 ? 27.224 -20.781 19.193 1.00 51.86 ? 4 LEU B N 1 ATOM 1081 C CA . LEU B 2 3 ? 28.298 -20.252 20.014 1.00 53.66 ? 4 LEU B CA 1 ATOM 1082 C C . LEU B 2 3 ? 28.323 -21.012 21.315 1.00 52.61 ? 4 LEU B C 1 ATOM 1083 O O . LEU B 2 3 ? 27.333 -21.011 22.036 1.00 56.81 ? 4 LEU B O 1 ATOM 1084 C CB . LEU B 2 3 ? 28.110 -18.752 20.330 1.00 51.62 ? 4 LEU B CB 1 ATOM 1085 C CG . LEU B 2 3 ? 28.816 -17.737 19.446 1.00 49.51 ? 4 LEU B CG 1 ATOM 1086 C CD1 . LEU B 2 3 ? 28.400 -17.984 18.019 1.00 49.58 ? 4 LEU B CD1 1 ATOM 1087 C CD2 . LEU B 2 3 ? 28.452 -16.321 19.874 1.00 47.93 ? 4 LEU B CD2 1 ATOM 1088 N N . THR B 2 4 ? 29.457 -21.624 21.640 1.00 47.35 ? 5 THR B N 1 ATOM 1089 C CA . THR B 2 4 ? 29.636 -22.108 22.968 1.00 49.69 ? 5 THR B CA 1 ATOM 1090 C C . THR B 2 4 ? 29.222 -20.933 23.836 1.00 55.67 ? 5 THR B C 1 ATOM 1091 O O . THR B 2 4 ? 29.042 -19.787 23.345 1.00 53.72 ? 5 THR B O 1 ATOM 1092 C CB . THR B 2 4 ? 31.090 -22.471 23.312 1.00 48.71 ? 5 THR B CB 1 ATOM 1093 O OG1 . THR B 2 4 ? 31.851 -21.283 23.597 1.00 50.64 ? 5 THR B OG1 1 ATOM 1094 C CG2 . THR B 2 4 ? 31.734 -23.246 22.199 1.00 47.39 ? 5 THR B CG2 1 ATOM 1095 N N . PRO B 2 5 ? 29.035 -21.202 25.126 1.00 57.24 ? 6 PRO B N 1 ATOM 1096 C CA . PRO B 2 5 ? 28.679 -20.073 25.966 1.00 58.83 ? 6 PRO B CA 1 ATOM 1097 C C . PRO B 2 5 ? 29.945 -19.258 26.208 1.00 51.90 ? 6 PRO B C 1 ATOM 1098 O O . PRO B 2 5 ? 29.883 -18.055 26.403 1.00 60.84 ? 6 PRO B O 1 ATOM 1099 C CB . PRO B 2 5 ? 28.130 -20.746 27.238 1.00 57.49 ? 6 PRO B CB 1 ATOM 1100 C CG . PRO B 2 5 ? 27.884 -22.178 26.851 1.00 53.18 ? 6 PRO B CG 1 ATOM 1101 C CD . PRO B 2 5 ? 28.946 -22.477 25.855 1.00 54.68 ? 6 PRO B CD 1 ATOM 1102 N N . GLU B 2 6 ? 31.079 -19.930 26.164 1.00 44.66 ? 7 GLU B N 1 ATOM 1103 C CA . GLU B 2 6 ? 32.381 -19.288 26.243 1.00 48.83 ? 7 GLU B CA 1 ATOM 1104 C C . GLU B 2 6 ? 32.584 -18.257 25.106 1.00 48.45 ? 7 GLU B C 1 ATOM 1105 O O . GLU B 2 6 ? 33.040 -17.137 25.322 1.00 43.78 ? 7 GLU B O 1 ATOM 1106 C CB . GLU B 2 6 ? 33.491 -20.344 26.192 1.00 52.92 ? 7 GLU B CB 1 ATOM 1107 C CG . GLU B 2 6 ? 34.599 -20.061 27.209 1.00 63.39 ? 7 GLU B CG 1 ATOM 1108 C CD . GLU B 2 6 ? 35.946 -20.772 26.950 1.00 69.96 ? 7 GLU B CD 1 ATOM 1109 O OE1 . GLU B 2 6 ? 36.889 -20.541 27.742 1.00 72.39 ? 7 GLU B OE1 1 ATOM 1110 O OE2 . GLU B 2 6 ? 36.093 -21.556 25.979 1.00 75.43 ? 7 GLU B OE2 1 ATOM 1111 N N . GLU B 2 7 ? 32.223 -18.645 23.898 1.00 45.76 ? 8 GLU B N 1 ATOM 1112 C CA . GLU B 2 7 ? 32.339 -17.746 22.740 1.00 42.52 ? 8 GLU B CA 1 ATOM 1113 C C . GLU B 2 7 ? 31.348 -16.565 22.846 1.00 44.18 ? 8 GLU B C 1 ATOM 1114 O O . GLU B 2 7 ? 31.767 -15.387 22.744 1.00 43.91 ? 8 GLU B O 1 ATOM 1115 C CB . GLU B 2 7 ? 32.113 -18.545 21.471 1.00 41.40 ? 8 GLU B CB 1 ATOM 1116 C CG . GLU B 2 7 ? 33.197 -19.580 21.226 1.00 37.27 ? 8 GLU B CG 1 ATOM 1117 C CD . GLU B 2 7 ? 33.024 -20.203 19.895 1.00 37.55 ? 8 GLU B CD 1 ATOM 1118 O OE1 . GLU B 2 7 ? 31.954 -20.830 19.716 1.00 39.15 ? 8 GLU B OE1 1 ATOM 1119 O OE2 . GLU B 2 7 ? 33.939 -20.044 19.029 1.00 38.48 ? 8 GLU B OE2 1 ATOM 1120 N N . LYS B 2 8 ? 30.067 -16.869 23.126 1.00 43.76 ? 9 LYS B N 1 ATOM 1121 C CA . LYS B 2 8 ? 29.035 -15.823 23.411 1.00 45.87 ? 9 LYS B CA 1 ATOM 1122 C C . LYS B 2 8 ? 29.632 -14.786 24.367 1.00 42.05 ? 9 LYS B C 1 ATOM 1123 O O . LYS B 2 8 ? 29.463 -13.567 24.250 1.00 36.62 ? 9 LYS B O 1 ATOM 1124 C CB . LYS B 2 8 ? 27.805 -16.483 24.062 1.00 54.50 ? 9 LYS B CB 1 ATOM 1125 C CG . LYS B 2 8 ? 26.604 -15.572 24.370 1.00 56.57 ? 9 LYS B CG 1 ATOM 1126 C CD . LYS B 2 8 ? 25.928 -15.941 25.714 1.00 61.25 ? 9 LYS B CD 1 ATOM 1127 C CE . LYS B 2 8 ? 24.391 -15.972 25.686 1.00 62.79 ? 9 LYS B CE 1 ATOM 1128 N NZ . LYS B 2 8 ? 23.743 -14.761 25.113 1.00 63.34 ? 9 LYS B NZ 1 ATOM 1129 N N . SER B 2 9 ? 30.392 -15.307 25.305 1.00 40.11 ? 10 SER B N 1 ATOM 1130 C CA . SER B 2 9 ? 30.931 -14.512 26.370 1.00 39.74 ? 10 SER B CA 1 ATOM 1131 C C . SER B 2 9 ? 32.062 -13.576 25.873 1.00 39.80 ? 10 SER B C 1 ATOM 1132 O O . SER B 2 9 ? 32.128 -12.395 26.233 1.00 38.50 ? 10 SER B O 1 ATOM 1133 C CB . SER B 2 9 ? 31.381 -15.484 27.486 1.00 40.81 ? 10 SER B CB 1 ATOM 1134 O OG . SER B 2 9 ? 32.452 -14.979 28.261 1.00 45.99 ? 10 SER B OG 1 ATOM 1135 N N . ALA B 2 10 ? 32.962 -14.120 25.066 1.00 38.74 ? 11 ALA B N 1 ATOM 1136 C CA . ALA B 2 10 ? 34.086 -13.357 24.534 1.00 41.10 ? 11 ALA B CA 1 ATOM 1137 C C . ALA B 2 10 ? 33.584 -12.272 23.569 1.00 33.22 ? 11 ALA B C 1 ATOM 1138 O O . ALA B 2 10 ? 34.116 -11.155 23.551 1.00 36.30 ? 11 ALA B O 1 ATOM 1139 C CB . ALA B 2 10 ? 35.073 -14.288 23.850 1.00 39.87 ? 11 ALA B CB 1 ATOM 1140 N N . VAL B 2 11 ? 32.560 -12.636 22.790 1.00 30.60 ? 12 VAL B N 1 ATOM 1141 C CA . VAL B 2 11 ? 31.896 -11.739 21.871 1.00 31.72 ? 12 VAL B CA 1 ATOM 1142 C C . VAL B 2 11 ? 31.241 -10.537 22.570 1.00 34.83 ? 12 VAL B C 1 ATOM 1143 O O . VAL B 2 11 ? 31.556 -9.376 22.249 1.00 31.20 ? 12 VAL B O 1 ATOM 1144 C CB . VAL B 2 11 ? 30.829 -12.487 21.030 1.00 33.85 ? 12 VAL B CB 1 ATOM 1145 C CG1 . VAL B 2 11 ? 29.960 -11.501 20.239 1.00 33.77 ? 12 VAL B CG1 1 ATOM 1146 C CG2 . VAL B 2 11 ? 31.477 -13.469 20.049 1.00 34.04 ? 12 VAL B CG2 1 ATOM 1147 N N . THR B 2 12 ? 30.317 -10.800 23.502 1.00 35.64 ? 13 THR B N 1 ATOM 1148 C CA . THR B 2 12 ? 29.586 -9.695 24.167 1.00 36.85 ? 13 THR B CA 1 ATOM 1149 C C . THR B 2 12 ? 30.560 -8.893 25.006 1.00 32.32 ? 13 THR B C 1 ATOM 1150 O O . THR B 2 12 ? 30.497 -7.643 24.995 1.00 33.17 ? 13 THR B O 1 ATOM 1151 C CB . THR B 2 12 ? 28.398 -10.189 25.014 1.00 42.50 ? 13 THR B CB 1 ATOM 1152 O OG1 . THR B 2 12 ? 28.903 -10.986 26.075 1.00 44.37 ? 13 THR B OG1 1 ATOM 1153 C CG2 . THR B 2 12 ? 27.439 -11.057 24.153 1.00 42.16 ? 13 THR B CG2 1 ATOM 1154 N N . ALA B 2 13 ? 31.530 -9.563 25.632 1.00 30.39 ? 14 ALA B N 1 ATOM 1155 C CA . ALA B 2 13 ? 32.666 -8.850 26.292 1.00 32.11 ? 14 ALA B CA 1 ATOM 1156 C C . ALA B 2 13 ? 33.350 -7.799 25.388 1.00 33.61 ? 14 ALA B C 1 ATOM 1157 O O . ALA B 2 13 ? 33.533 -6.630 25.741 1.00 36.19 ? 14 ALA B O 1 ATOM 1158 C CB . ALA B 2 13 ? 33.689 -9.876 26.834 1.00 33.44 ? 14 ALA B CB 1 ATOM 1159 N N . LEU B 2 14 ? 33.705 -8.205 24.170 1.00 34.86 ? 15 LEU B N 1 ATOM 1160 C CA . LEU B 2 14 ? 34.300 -7.276 23.215 1.00 29.89 ? 15 LEU B CA 1 ATOM 1161 C C . LEU B 2 14 ? 33.305 -6.194 22.736 1.00 27.29 ? 15 LEU B C 1 ATOM 1162 O O . LEU B 2 14 ? 33.641 -5.029 22.669 1.00 25.21 ? 15 LEU B O 1 ATOM 1163 C CB . LEU B 2 14 ? 34.806 -8.066 22.003 1.00 32.72 ? 15 LEU B CB 1 ATOM 1164 C CG . LEU B 2 14 ? 35.809 -7.244 21.182 1.00 37.16 ? 15 LEU B CG 1 ATOM 1165 C CD1 . LEU B 2 14 ? 37.143 -7.351 21.871 1.00 38.55 ? 15 LEU B CD1 1 ATOM 1166 C CD2 . LEU B 2 14 ? 35.913 -7.746 19.744 1.00 38.53 ? 15 LEU B CD2 1 ATOM 1167 N N . TRP B 2 15 ? 32.091 -6.604 22.380 1.00 25.68 ? 16 TRP B N 1 ATOM 1168 C CA . TRP B 2 15 ? 31.089 -5.707 21.800 1.00 29.45 ? 16 TRP B CA 1 ATOM 1169 C C . TRP B 2 15 ? 30.767 -4.539 22.747 1.00 31.05 ? 16 TRP B C 1 ATOM 1170 O O . TRP B 2 15 ? 30.603 -3.366 22.308 1.00 28.84 ? 16 TRP B O 1 ATOM 1171 C CB . TRP B 2 15 ? 29.796 -6.475 21.497 1.00 30.95 ? 16 TRP B CB 1 ATOM 1172 C CG . TRP B 2 15 ? 28.899 -5.778 20.536 1.00 34.08 ? 16 TRP B CG 1 ATOM 1173 C CD1 . TRP B 2 15 ? 27.721 -5.149 20.820 1.00 33.53 ? 16 TRP B CD1 1 ATOM 1174 C CD2 . TRP B 2 15 ? 29.096 -5.653 19.122 1.00 33.22 ? 16 TRP B CD2 1 ATOM 1175 N NE1 . TRP B 2 15 ? 27.180 -4.650 19.677 1.00 35.46 ? 16 TRP B NE1 1 ATOM 1176 C CE2 . TRP B 2 15 ? 28.002 -4.950 18.615 1.00 35.55 ? 16 TRP B CE2 1 ATOM 1177 C CE3 . TRP B 2 15 ? 30.087 -6.097 18.231 1.00 33.76 ? 16 TRP B CE3 1 ATOM 1178 C CZ2 . TRP B 2 15 ? 27.878 -4.631 17.251 1.00 34.98 ? 16 TRP B CZ2 1 ATOM 1179 C CZ3 . TRP B 2 15 ? 29.958 -5.779 16.858 1.00 33.68 ? 16 TRP B CZ3 1 ATOM 1180 C CH2 . TRP B 2 15 ? 28.866 -5.045 16.396 1.00 33.45 ? 16 TRP B CH2 1 ATOM 1181 N N . GLY B 2 16 ? 30.730 -4.872 24.046 1.00 31.76 ? 17 GLY B N 1 ATOM 1182 C CA . GLY B 2 16 ? 30.449 -3.908 25.119 1.00 30.68 ? 17 GLY B CA 1 ATOM 1183 C C . GLY B 2 16 ? 31.443 -2.779 25.118 1.00 29.94 ? 17 GLY B C 1 ATOM 1184 O O . GLY B 2 16 ? 31.139 -1.688 25.555 1.00 36.21 ? 17 GLY B O 1 ATOM 1185 N N . LYS B 2 17 ? 32.619 -3.013 24.586 1.00 27.70 ? 18 LYS B N 1 ATOM 1186 C CA . LYS B 2 17 ? 33.598 -1.955 24.416 1.00 29.91 ? 18 LYS B CA 1 ATOM 1187 C C . LYS B 2 17 ? 33.615 -1.252 23.106 1.00 27.72 ? 18 LYS B C 1 ATOM 1188 O O . LYS B 2 17 ? 34.490 -0.441 22.909 1.00 32.48 ? 18 LYS B O 1 ATOM 1189 C CB . LYS B 2 17 ? 34.983 -2.496 24.647 1.00 34.51 ? 18 LYS B CB 1 ATOM 1190 C CG . LYS B 2 17 ? 35.073 -3.061 26.063 1.00 41.43 ? 18 LYS B CG 1 ATOM 1191 C CD . LYS B 2 17 ? 36.499 -3.350 26.441 1.00 48.34 ? 18 LYS B CD 1 ATOM 1192 C CE . LYS B 2 17 ? 36.768 -4.831 26.467 1.00 57.33 ? 18 LYS B CE 1 ATOM 1193 N NZ . LYS B 2 17 ? 38.119 -4.999 27.049 1.00 64.09 ? 18 LYS B NZ 1 ATOM 1194 N N . VAL B 2 18 ? 32.678 -1.494 22.202 1.00 30.31 ? 19 VAL B N 1 ATOM 1195 C CA . VAL B 2 18 ? 32.876 -0.866 20.854 1.00 30.98 ? 19 VAL B CA 1 ATOM 1196 C C . VAL B 2 18 ? 32.314 0.520 20.859 1.00 30.74 ? 19 VAL B C 1 ATOM 1197 O O . VAL B 2 18 ? 31.314 0.760 21.477 1.00 33.03 ? 19 VAL B O 1 ATOM 1198 C CB . VAL B 2 18 ? 32.374 -1.680 19.606 1.00 33.32 ? 19 VAL B CB 1 ATOM 1199 C CG1 . VAL B 2 18 ? 32.384 -3.148 19.864 1.00 31.05 ? 19 VAL B CG1 1 ATOM 1200 C CG2 . VAL B 2 18 ? 31.040 -1.164 19.052 1.00 34.84 ? 19 VAL B CG2 1 ATOM 1201 N N . ASN B 2 19 ? 32.977 1.450 20.210 1.00 33.39 ? 20 ASN B N 1 ATOM 1202 C CA . ASN B 2 19 ? 32.367 2.757 20.028 1.00 33.91 ? 20 ASN B CA 1 ATOM 1203 C C . ASN B 2 19 ? 31.194 2.702 19.013 1.00 38.16 ? 20 ASN B C 1 ATOM 1204 O O . ASN B 2 19 ? 31.382 2.845 17.826 1.00 38.03 ? 20 ASN B O 1 ATOM 1205 C CB . ASN B 2 19 ? 33.417 3.721 19.573 1.00 34.73 ? 20 ASN B CB 1 ATOM 1206 C CG . ASN B 2 19 ? 32.923 5.125 19.586 1.00 35.72 ? 20 ASN B CG 1 ATOM 1207 O OD1 . ASN B 2 19 ? 31.733 5.409 19.398 1.00 38.01 ? 20 ASN B OD1 1 ATOM 1208 N ND2 . ASN B 2 19 ? 33.824 6.012 19.844 1.00 39.91 ? 20 ASN B ND2 1 ATOM 1209 N N . VAL B 2 20 ? 30.018 2.390 19.524 1.00 39.18 ? 21 VAL B N 1 ATOM 1210 C CA . VAL B 2 20 ? 28.770 2.362 18.825 1.00 41.25 ? 21 VAL B CA 1 ATOM 1211 C C . VAL B 2 20 ? 28.539 3.494 17.816 1.00 41.01 ? 21 VAL B C 1 ATOM 1212 O O . VAL B 2 20 ? 27.841 3.321 16.830 1.00 44.83 ? 21 VAL B O 1 ATOM 1213 C CB . VAL B 2 20 ? 27.650 2.291 19.915 1.00 44.17 ? 21 VAL B CB 1 ATOM 1214 C CG1 . VAL B 2 20 ? 26.421 3.117 19.581 1.00 43.98 ? 21 VAL B CG1 1 ATOM 1215 C CG2 . VAL B 2 20 ? 27.304 0.834 20.194 1.00 41.44 ? 21 VAL B CG2 1 ATOM 1216 N N . ASP B 2 21 ? 29.129 4.641 18.052 1.00 40.51 ? 22 ASP B N 1 ATOM 1217 C CA . ASP B 2 21 ? 28.946 5.774 17.166 1.00 41.46 ? 22 ASP B CA 1 ATOM 1218 C C . ASP B 2 21 ? 29.950 5.822 16.012 1.00 41.21 ? 22 ASP B C 1 ATOM 1219 O O . ASP B 2 21 ? 29.852 6.729 15.164 1.00 33.92 ? 22 ASP B O 1 ATOM 1220 C CB . ASP B 2 21 ? 29.045 7.102 17.968 1.00 45.98 ? 22 ASP B CB 1 ATOM 1221 C CG . ASP B 2 21 ? 27.803 7.382 18.831 1.00 50.67 ? 22 ASP B CG 1 ATOM 1222 O OD1 . ASP B 2 21 ? 26.776 6.666 18.740 1.00 47.90 ? 22 ASP B OD1 1 ATOM 1223 O OD2 . ASP B 2 21 ? 27.859 8.327 19.629 1.00 53.73 ? 22 ASP B OD2 1 ATOM 1224 N N . GLU B 2 22 ? 30.906 4.881 15.975 1.00 34.81 ? 23 GLU B N 1 ATOM 1225 C CA . GLU B 2 22 ? 32.018 4.974 15.032 1.00 33.80 ? 23 GLU B CA 1 ATOM 1226 C C . GLU B 2 22 ? 32.309 3.707 14.207 1.00 30.38 ? 23 GLU B C 1 ATOM 1227 O O . GLU B 2 22 ? 32.626 3.822 12.995 1.00 26.26 ? 23 GLU B O 1 ATOM 1228 C CB . GLU B 2 22 ? 33.297 5.373 15.753 1.00 39.89 ? 23 GLU B CB 1 ATOM 1229 C CG . GLU B 2 22 ? 33.350 6.811 16.240 1.00 44.96 ? 23 GLU B CG 1 ATOM 1230 C CD . GLU B 2 22 ? 34.721 7.166 16.805 1.00 59.36 ? 23 GLU B CD 1 ATOM 1231 O OE1 . GLU B 2 22 ? 35.531 6.223 17.066 1.00 63.38 ? 23 GLU B OE1 1 ATOM 1232 O OE2 . GLU B 2 22 ? 35.001 8.389 16.981 1.00 65.95 ? 23 GLU B OE2 1 ATOM 1233 N N . VAL B 2 23 ? 32.246 2.520 14.814 1.00 25.98 ? 24 VAL B N 1 ATOM 1234 C CA . VAL B 2 23 ? 32.760 1.334 14.083 1.00 30.73 ? 24 VAL B CA 1 ATOM 1235 C C . VAL B 2 23 ? 31.845 0.962 12.906 1.00 24.56 ? 24 VAL B C 1 ATOM 1236 O O . VAL B 2 23 ? 32.321 0.484 11.911 1.00 19.49 ? 24 VAL B O 1 ATOM 1237 C CB . VAL B 2 23 ? 33.280 0.109 14.922 1.00 29.87 ? 24 VAL B CB 1 ATOM 1238 C CG1 . VAL B 2 23 ? 33.679 0.476 16.318 1.00 29.73 ? 24 VAL B CG1 1 ATOM 1239 C CG2 . VAL B 2 23 ? 32.425 -1.134 14.810 1.00 31.00 ? 24 VAL B CG2 1 ATOM 1240 N N . GLY B 2 24 ? 30.571 1.283 13.005 1.00 21.90 ? 25 GLY B N 1 ATOM 1241 C CA . GLY B 2 24 ? 29.642 0.961 11.921 1.00 22.93 ? 25 GLY B CA 1 ATOM 1242 C C . GLY B 2 24 ? 29.934 1.790 10.667 1.00 22.46 ? 25 GLY B C 1 ATOM 1243 O O . GLY B 2 24 ? 29.952 1.277 9.551 1.00 21.36 ? 25 GLY B O 1 ATOM 1244 N N . GLY B 2 25 ? 30.218 3.064 10.866 1.00 24.07 ? 26 GLY B N 1 ATOM 1245 C CA . GLY B 2 25 ? 30.609 3.982 9.780 1.00 23.11 ? 26 GLY B CA 1 ATOM 1246 C C . GLY B 2 25 ? 31.989 3.618 9.215 1.00 23.03 ? 26 GLY B C 1 ATOM 1247 O O . GLY B 2 25 ? 32.254 3.778 8.009 1.00 19.57 ? 26 GLY B O 1 ATOM 1248 N N . GLU B 2 26 ? 32.880 3.137 10.073 1.00 21.56 ? 27 GLU B N 1 ATOM 1249 C CA . GLU B 2 26 ? 34.181 2.761 9.584 1.00 23.59 ? 27 GLU B CA 1 ATOM 1250 C C . GLU B 2 26 ? 34.128 1.420 8.741 1.00 21.44 ? 27 GLU B C 1 ATOM 1251 O O . GLU B 2 26 ? 34.873 1.246 7.785 1.00 22.07 ? 27 GLU B O 1 ATOM 1252 C CB . GLU B 2 26 ? 35.190 2.694 10.699 1.00 26.30 ? 27 GLU B CB 1 ATOM 1253 C CG . GLU B 2 26 ? 36.602 2.430 10.172 1.00 35.71 ? 27 GLU B CG 1 ATOM 1254 C CD . GLU B 2 26 ? 37.650 2.216 11.279 1.00 48.30 ? 27 GLU B CD 1 ATOM 1255 O OE1 . GLU B 2 26 ? 37.324 2.650 12.435 1.00 46.03 ? 27 GLU B OE1 1 ATOM 1256 O OE2 . GLU B 2 26 ? 38.759 1.608 11.000 1.00 41.37 ? 27 GLU B OE2 1 ATOM 1257 N N . ALA B 2 27 ? 33.321 0.467 9.150 1.00 21.09 ? 28 ALA B N 1 ATOM 1258 C CA . ALA B 2 27 ? 33.077 -0.742 8.350 1.00 22.20 ? 28 ALA B CA 1 ATOM 1259 C C . ALA B 2 27 ? 32.387 -0.421 7.009 1.00 21.70 ? 28 ALA B C 1 ATOM 1260 O O . ALA B 2 27 ? 32.772 -0.932 5.997 1.00 19.85 ? 28 ALA B O 1 ATOM 1261 C CB . ALA B 2 27 ? 32.227 -1.723 9.108 1.00 22.03 ? 28 ALA B CB 1 ATOM 1262 N N . LEU B 2 28 ? 31.361 0.427 7.016 1.00 19.18 ? 29 LEU B N 1 ATOM 1263 C CA . LEU B 2 28 ? 30.633 0.730 5.808 1.00 18.40 ? 29 LEU B CA 1 ATOM 1264 C C . LEU B 2 28 ? 31.509 1.536 4.879 1.00 17.71 ? 29 LEU B C 1 ATOM 1265 O O . LEU B 2 28 ? 31.598 1.289 3.652 1.00 17.14 ? 29 LEU B O 1 ATOM 1266 C CB . LEU B 2 28 ? 29.286 1.413 6.127 1.00 20.71 ? 29 LEU B CB 1 ATOM 1267 C CG . LEU B 2 28 ? 28.578 1.944 4.899 1.00 23.03 ? 29 LEU B CG 1 ATOM 1268 C CD1 . LEU B 2 28 ? 27.938 0.792 4.124 1.00 25.01 ? 29 LEU B CD1 1 ATOM 1269 C CD2 . LEU B 2 28 ? 27.544 2.991 5.279 1.00 25.69 ? 29 LEU B CD2 1 ATOM 1270 N N . GLY B 2 29 ? 32.260 2.413 5.500 1.00 16.24 ? 30 GLY B N 1 ATOM 1271 C CA . GLY B 2 29 ? 33.155 3.278 4.825 1.00 18.07 ? 30 GLY B CA 1 ATOM 1272 C C . GLY B 2 29 ? 34.230 2.508 4.109 1.00 17.79 ? 30 GLY B C 1 ATOM 1273 O O . GLY B 2 29 ? 34.441 2.713 2.964 1.00 18.22 ? 30 GLY B O 1 ATOM 1274 N N . ARG B 2 30 ? 34.846 1.571 4.788 1.00 18.76 ? 31 ARG B N 1 ATOM 1275 C CA . ARG B 2 30 ? 35.755 0.656 4.158 1.00 18.08 ? 31 ARG B CA 1 ATOM 1276 C C . ARG B 2 30 ? 35.175 -0.276 3.091 1.00 17.94 ? 31 ARG B C 1 ATOM 1277 O O . ARG B 2 30 ? 35.859 -0.518 2.106 1.00 15.88 ? 31 ARG B O 1 ATOM 1278 C CB . ARG B 2 30 ? 36.520 -0.147 5.197 1.00 20.38 ? 31 ARG B CB 1 ATOM 1279 C CG . ARG B 2 30 ? 37.596 0.650 5.927 1.00 20.28 ? 31 ARG B CG 1 ATOM 1280 C CD . ARG B 2 30 ? 38.326 -0.223 6.987 1.00 20.91 ? 31 ARG B CD 1 ATOM 1281 N NE . ARG B 2 30 ? 39.265 0.592 7.760 1.00 20.57 ? 31 ARG B NE 1 ATOM 1282 C CZ . ARG B 2 30 ? 40.589 0.634 7.599 1.00 19.30 ? 31 ARG B CZ 1 ATOM 1283 N NH1 . ARG B 2 30 ? 41.198 -0.068 6.685 1.00 18.16 ? 31 ARG B NH1 1 ATOM 1284 N NH2 . ARG B 2 30 ? 41.326 1.422 8.356 1.00 18.17 ? 31 ARG B NH2 1 ATOM 1285 N N . LEU B 2 31 ? 33.967 -0.834 3.294 1.00 18.98 ? 32 LEU B N 1 ATOM 1286 C CA . LEU B 2 31 ? 33.297 -1.581 2.224 1.00 17.70 ? 32 LEU B CA 1 ATOM 1287 C C . LEU B 2 31 ? 33.239 -0.788 0.905 1.00 18.90 ? 32 LEU B C 1 ATOM 1288 O O . LEU B 2 31 ? 33.545 -1.313 -0.162 1.00 19.77 ? 32 LEU B O 1 ATOM 1289 C CB . LEU B 2 31 ? 31.892 -1.924 2.611 1.00 19.69 ? 32 LEU B CB 1 ATOM 1290 C CG . LEU B 2 31 ? 31.135 -2.863 1.611 1.00 17.44 ? 32 LEU B CG 1 ATOM 1291 C CD1 . LEU B 2 31 ? 31.463 -4.303 1.867 1.00 17.61 ? 32 LEU B CD1 1 ATOM 1292 C CD2 . LEU B 2 31 ? 29.673 -2.648 1.686 1.00 17.48 ? 32 LEU B CD2 1 ATOM 1293 N N . LEU B 2 32 ? 32.898 0.488 0.994 1.00 17.50 ? 33 LEU B N 1 ATOM 1294 C CA . LEU B 2 32 ? 32.733 1.328 -0.155 1.00 18.13 ? 33 LEU B CA 1 ATOM 1295 C C . LEU B 2 32 ? 34.092 1.680 -0.798 1.00 18.37 ? 33 LEU B C 1 ATOM 1296 O O . LEU B 2 32 ? 34.147 1.871 -2.022 1.00 17.46 ? 33 LEU B O 1 ATOM 1297 C CB . LEU B 2 32 ? 32.038 2.628 0.253 1.00 19.21 ? 33 LEU B CB 1 ATOM 1298 C CG . LEU B 2 32 ? 30.577 2.501 0.623 1.00 21.07 ? 33 LEU B CG 1 ATOM 1299 C CD1 . LEU B 2 32 ? 30.225 3.756 1.432 1.00 23.55 ? 33 LEU B CD1 1 ATOM 1300 C CD2 . LEU B 2 32 ? 29.719 2.354 -0.637 1.00 19.49 ? 33 LEU B CD2 1 ATOM 1301 N N . VAL B 2 33 ? 35.184 1.687 -0.014 1.00 16.80 ? 34 VAL B N 1 ATOM 1302 C CA . VAL B 2 33 ? 36.502 2.003 -0.558 1.00 17.93 ? 34 VAL B CA 1 ATOM 1303 C C . VAL B 2 33 ? 37.158 0.718 -1.109 1.00 18.22 ? 34 VAL B C 1 ATOM 1304 O O . VAL B 2 33 ? 37.719 0.716 -2.164 1.00 17.99 ? 34 VAL B O 1 ATOM 1305 C CB . VAL B 2 33 ? 37.365 2.624 0.513 1.00 20.71 ? 34 VAL B CB 1 ATOM 1306 C CG1 . VAL B 2 33 ? 38.793 2.782 0.029 1.00 21.95 ? 34 VAL B CG1 1 ATOM 1307 C CG2 . VAL B 2 33 ? 36.766 3.955 1.015 1.00 22.24 ? 34 VAL B CG2 1 ATOM 1308 N N . VAL B 2 34 ? 37.035 -0.384 -0.386 1.00 17.31 ? 35 VAL B N 1 ATOM 1309 C CA . VAL B 2 34 ? 37.664 -1.635 -0.780 1.00 16.81 ? 35 VAL B CA 1 ATOM 1310 C C . VAL B 2 34 ? 36.907 -2.324 -1.925 1.00 16.85 ? 35 VAL B C 1 ATOM 1311 O O . VAL B 2 34 ? 37.515 -3.030 -2.767 1.00 18.39 ? 35 VAL B O 1 ATOM 1312 C CB . VAL B 2 34 ? 37.791 -2.602 0.436 1.00 15.54 ? 35 VAL B CB 1 ATOM 1313 C CG1 . VAL B 2 34 ? 38.387 -3.948 0.018 1.00 16.61 ? 35 VAL B CG1 1 ATOM 1314 C CG2 . VAL B 2 34 ? 38.690 -2.030 1.518 1.00 13.93 ? 35 VAL B CG2 1 ATOM 1315 N N . TYR B 2 35 ? 35.601 -2.226 -1.934 1.00 15.82 ? 36 TYR B N 1 ATOM 1316 C CA . TYR B 2 35 ? 34.779 -2.916 -2.959 1.00 18.71 ? 36 TYR B CA 1 ATOM 1317 C C . TYR B 2 35 ? 33.875 -1.867 -3.589 1.00 19.56 ? 36 TYR B C 1 ATOM 1318 O O . TYR B 2 35 ? 32.658 -1.816 -3.266 1.00 18.97 ? 36 TYR B O 1 ATOM 1319 C CB . TYR B 2 35 ? 33.932 -4.007 -2.334 1.00 18.86 ? 36 TYR B CB 1 ATOM 1320 C CG . TYR B 2 35 ? 34.733 -4.940 -1.472 1.00 21.04 ? 36 TYR B CG 1 ATOM 1321 C CD1 . TYR B 2 35 ? 35.481 -5.989 -2.021 1.00 22.29 ? 36 TYR B CD1 1 ATOM 1322 C CD2 . TYR B 2 35 ? 34.750 -4.779 -0.093 1.00 24.19 ? 36 TYR B CD2 1 ATOM 1323 C CE1 . TYR B 2 35 ? 36.210 -6.831 -1.220 1.00 22.47 ? 36 TYR B CE1 1 ATOM 1324 C CE2 . TYR B 2 35 ? 35.497 -5.611 0.720 1.00 26.00 ? 36 TYR B CE2 1 ATOM 1325 C CZ . TYR B 2 35 ? 36.208 -6.642 0.149 1.00 24.18 ? 36 TYR B CZ 1 ATOM 1326 O OH . TYR B 2 35 ? 36.911 -7.471 1.000 1.00 25.41 ? 36 TYR B OH 1 ATOM 1327 N N . PRO B 2 36 ? 34.465 -1.007 -4.418 1.00 19.18 ? 37 PRO B N 1 ATOM 1328 C CA . PRO B 2 36 ? 33.850 0.249 -4.882 1.00 21.00 ? 37 PRO B CA 1 ATOM 1329 C C . PRO B 2 36 ? 32.572 0.099 -5.732 1.00 20.47 ? 37 PRO B C 1 ATOM 1330 O O . PRO B 2 36 ? 31.821 1.015 -5.864 1.00 17.62 ? 37 PRO B O 1 ATOM 1331 C CB . PRO B 2 36 ? 34.964 0.902 -5.713 1.00 22.34 ? 37 PRO B CB 1 ATOM 1332 C CG . PRO B 2 36 ? 36.223 0.134 -5.472 1.00 21.20 ? 37 PRO B CG 1 ATOM 1333 C CD . PRO B 2 36 ? 35.817 -1.211 -4.973 1.00 20.54 ? 37 PRO B CD 1 ATOM 1334 N N . TRP B 2 37 ? 32.323 -1.081 -6.230 1.00 22.07 ? 38 TRP B N 1 ATOM 1335 C CA . TRP B 2 37 ? 31.115 -1.338 -6.964 1.00 23.75 ? 38 TRP B CA 1 ATOM 1336 C C . TRP B 2 37 ? 29.897 -1.199 -6.081 1.00 23.87 ? 38 TRP B C 1 ATOM 1337 O O . TRP B 2 37 ? 28.810 -1.037 -6.573 1.00 26.60 ? 38 TRP B O 1 ATOM 1338 C CB . TRP B 2 37 ? 31.171 -2.747 -7.569 1.00 24.16 ? 38 TRP B CB 1 ATOM 1339 C CG . TRP B 2 37 ? 31.385 -3.870 -6.661 1.00 24.51 ? 38 TRP B CG 1 ATOM 1340 C CD1 . TRP B 2 37 ? 30.426 -4.561 -6.009 1.00 27.06 ? 38 TRP B CD1 1 ATOM 1341 C CD2 . TRP B 2 37 ? 32.607 -4.564 -6.389 1.00 25.57 ? 38 TRP B CD2 1 ATOM 1342 N NE1 . TRP B 2 37 ? 30.975 -5.561 -5.263 1.00 26.50 ? 38 TRP B NE1 1 ATOM 1343 C CE2 . TRP B 2 37 ? 32.310 -5.600 -5.522 1.00 23.48 ? 38 TRP B CE2 1 ATOM 1344 C CE3 . TRP B 2 37 ? 33.933 -4.362 -6.747 1.00 27.79 ? 38 TRP B CE3 1 ATOM 1345 C CZ2 . TRP B 2 37 ? 33.268 -6.473 -5.047 1.00 27.84 ? 38 TRP B CZ2 1 ATOM 1346 C CZ3 . TRP B 2 37 ? 34.883 -5.232 -6.265 1.00 29.50 ? 38 TRP B CZ3 1 ATOM 1347 C CH2 . TRP B 2 37 ? 34.553 -6.246 -5.418 1.00 28.26 ? 38 TRP B CH2 1 ATOM 1348 N N . THR B 2 38 ? 30.090 -1.240 -4.764 1.00 21.20 ? 39 THR B N 1 ATOM 1349 C CA . THR B 2 38 ? 29.003 -1.155 -3.868 1.00 19.94 ? 39 THR B CA 1 ATOM 1350 C C . THR B 2 38 ? 28.479 0.275 -3.806 1.00 19.69 ? 39 THR B C 1 ATOM 1351 O O . THR B 2 38 ? 27.361 0.471 -3.324 1.00 20.39 ? 39 THR B O 1 ATOM 1352 C CB . THR B 2 38 ? 29.377 -1.629 -2.446 1.00 20.58 ? 39 THR B CB 1 ATOM 1353 O OG1 . THR B 2 38 ? 30.460 -0.821 -1.911 1.00 17.07 ? 39 THR B OG1 1 ATOM 1354 C CG2 . THR B 2 38 ? 29.730 -3.129 -2.443 1.00 20.55 ? 39 THR B CG2 1 ATOM 1355 N N . GLN B 2 39 ? 29.262 1.272 -4.246 1.00 18.20 ? 40 GLN B N 1 ATOM 1356 C CA . GLN B 2 39 ? 28.820 2.679 -4.134 1.00 19.46 ? 40 GLN B CA 1 ATOM 1357 C C . GLN B 2 39 ? 27.557 2.987 -4.906 1.00 18.39 ? 40 GLN B C 1 ATOM 1358 O O . GLN B 2 39 ? 26.868 3.903 -4.574 1.00 15.10 ? 40 GLN B O 1 ATOM 1359 C CB . GLN B 2 39 ? 29.864 3.701 -4.572 1.00 20.16 ? 40 GLN B CB 1 ATOM 1360 C CG . GLN B 2 39 ? 31.160 3.549 -3.804 1.00 21.95 ? 40 GLN B CG 1 ATOM 1361 C CD . GLN B 2 39 ? 32.238 4.422 -4.343 1.00 23.46 ? 40 GLN B CD 1 ATOM 1362 O OE1 . GLN B 2 39 ? 31.984 5.353 -5.082 1.00 22.01 ? 40 GLN B OE1 1 ATOM 1363 N NE2 . GLN B 2 39 ? 33.445 4.158 -3.931 1.00 23.60 ? 40 GLN B NE2 1 ATOM 1364 N N . ARG B 2 40 ? 27.256 2.212 -5.918 1.00 16.97 ? 41 ARG B N 1 ATOM 1365 C CA . ARG B 2 40 ? 26.062 2.506 -6.679 1.00 18.11 ? 41 ARG B CA 1 ATOM 1366 C C . ARG B 2 40 ? 24.767 2.417 -5.866 1.00 17.78 ? 41 ARG B C 1 ATOM 1367 O O . ARG B 2 40 ? 23.778 2.929 -6.293 1.00 18.26 ? 41 ARG B O 1 ATOM 1368 C CB . ARG B 2 40 ? 26.003 1.612 -7.885 1.00 16.71 ? 41 ARG B CB 1 ATOM 1369 C CG . ARG B 2 40 ? 25.705 0.133 -7.616 1.00 17.30 ? 41 ARG B CG 1 ATOM 1370 C CD . ARG B 2 40 ? 25.481 -0.542 -8.987 1.00 16.20 ? 41 ARG B CD 1 ATOM 1371 N NE . ARG B 2 40 ? 25.240 -2.000 -8.947 1.00 15.28 ? 41 ARG B NE 1 ATOM 1372 C CZ . ARG B 2 40 ? 24.073 -2.644 -8.936 1.00 15.32 ? 41 ARG B CZ 1 ATOM 1373 N NH1 . ARG B 2 40 ? 22.899 -2.024 -8.758 1.00 15.11 ? 41 ARG B NH1 1 ATOM 1374 N NH2 . ARG B 2 40 ? 24.102 -3.990 -8.898 1.00 16.62 ? 41 ARG B NH2 1 ATOM 1375 N N . PHE B 2 41 ? 24.791 1.748 -4.711 1.00 18.51 ? 42 PHE B N 1 ATOM 1376 C CA . PHE B 2 41 ? 23.601 1.579 -3.882 1.00 19.14 ? 42 PHE B CA 1 ATOM 1377 C C . PHE B 2 41 ? 23.346 2.774 -3.009 1.00 19.92 ? 42 PHE B C 1 ATOM 1378 O O . PHE B 2 41 ? 22.240 2.910 -2.486 1.00 17.96 ? 42 PHE B O 1 ATOM 1379 C CB . PHE B 2 41 ? 23.707 0.303 -3.020 1.00 19.97 ? 42 PHE B CB 1 ATOM 1380 C CG . PHE B 2 41 ? 23.720 -0.941 -3.852 1.00 18.80 ? 42 PHE B CG 1 ATOM 1381 C CD1 . PHE B 2 41 ? 22.541 -1.457 -4.362 1.00 18.24 ? 42 PHE B CD1 1 ATOM 1382 C CD2 . PHE B 2 41 ? 24.927 -1.514 -4.220 1.00 18.18 ? 42 PHE B CD2 1 ATOM 1383 C CE1 . PHE B 2 41 ? 22.559 -2.603 -5.155 1.00 18.08 ? 42 PHE B CE1 1 ATOM 1384 C CE2 . PHE B 2 41 ? 24.967 -2.628 -5.018 1.00 19.79 ? 42 PHE B CE2 1 ATOM 1385 C CZ . PHE B 2 41 ? 23.772 -3.189 -5.472 1.00 19.91 ? 42 PHE B CZ 1 ATOM 1386 N N . PHE B 2 42 ? 24.316 3.676 -2.933 1.00 19.39 ? 43 PHE B N 1 ATOM 1387 C CA . PHE B 2 42 ? 24.284 4.713 -1.937 1.00 22.36 ? 43 PHE B CA 1 ATOM 1388 C C . PHE B 2 42 ? 24.457 6.116 -2.532 1.00 23.54 ? 43 PHE B C 1 ATOM 1389 O O . PHE B 2 42 ? 25.104 6.943 -1.976 1.00 26.53 ? 43 PHE B O 1 ATOM 1390 C CB . PHE B 2 42 ? 25.432 4.481 -0.969 1.00 24.41 ? 43 PHE B CB 1 ATOM 1391 C CG . PHE B 2 42 ? 25.301 3.224 -0.146 1.00 23.97 ? 43 PHE B CG 1 ATOM 1392 C CD1 . PHE B 2 42 ? 24.438 3.184 0.951 1.00 24.35 ? 43 PHE B CD1 1 ATOM 1393 C CD2 . PHE B 2 42 ? 26.053 2.111 -0.434 1.00 23.90 ? 43 PHE B CD2 1 ATOM 1394 C CE1 . PHE B 2 42 ? 24.370 2.041 1.743 1.00 23.22 ? 43 PHE B CE1 1 ATOM 1395 C CE2 . PHE B 2 42 ? 25.989 0.992 0.350 1.00 24.62 ? 43 PHE B CE2 1 ATOM 1396 C CZ . PHE B 2 42 ? 25.127 0.947 1.430 1.00 23.82 ? 43 PHE B CZ 1 ATOM 1397 N N . GLU B 2 43 ? 23.878 6.345 -3.680 1.00 23.77 ? 44 GLU B N 1 ATOM 1398 C CA . GLU B 2 43 ? 23.869 7.659 -4.314 1.00 25.01 ? 44 GLU B CA 1 ATOM 1399 C C . GLU B 2 43 ? 23.107 8.659 -3.375 1.00 27.21 ? 44 GLU B C 1 ATOM 1400 O O . GLU B 2 43 ? 23.467 9.801 -3.332 1.00 22.22 ? 44 GLU B O 1 ATOM 1401 C CB . GLU B 2 43 ? 23.172 7.593 -5.704 1.00 23.56 ? 44 GLU B CB 1 ATOM 1402 C CG . GLU B 2 43 ? 23.853 6.690 -6.727 1.00 23.57 ? 44 GLU B CG 1 ATOM 1403 C CD . GLU B 2 43 ? 23.025 6.443 -7.995 1.00 23.22 ? 44 GLU B CD 1 ATOM 1404 O OE1 . GLU B 2 43 ? 21.813 6.780 -7.970 1.00 22.66 ? 44 GLU B OE1 1 ATOM 1405 O OE2 . GLU B 2 43 ? 23.572 5.869 -9.008 1.00 21.34 ? 44 GLU B OE2 1 ATOM 1406 N N . SER B 2 44 ? 22.096 8.254 -2.585 1.00 28.62 ? 45 SER B N 1 ATOM 1407 C CA . SER B 2 44 ? 21.484 9.297 -1.748 1.00 35.09 ? 45 SER B CA 1 ATOM 1408 C C . SER B 2 44 ? 22.380 9.691 -0.511 1.00 41.71 ? 45 SER B C 1 ATOM 1409 O O . SER B 2 44 ? 21.943 10.467 0.341 1.00 39.35 ? 45 SER B O 1 ATOM 1410 C CB . SER B 2 44 ? 20.036 8.953 -1.387 1.00 38.01 ? 45 SER B CB 1 ATOM 1411 O OG . SER B 2 44 ? 19.938 7.874 -0.492 1.00 38.42 ? 45 SER B OG 1 ATOM 1412 N N . PHE B 2 45 ? 23.629 9.194 -0.437 1.00 40.24 ? 46 PHE B N 1 ATOM 1413 C CA . PHE B 2 45 ? 24.613 9.651 0.599 1.00 36.10 ? 46 PHE B CA 1 ATOM 1414 C C . PHE B 2 45 ? 25.498 10.792 0.151 1.00 33.13 ? 46 PHE B C 1 ATOM 1415 O O . PHE B 2 45 ? 26.301 11.304 0.942 1.00 30.02 ? 46 PHE B O 1 ATOM 1416 C CB . PHE B 2 45 ? 25.550 8.520 1.071 1.00 34.64 ? 46 PHE B CB 1 ATOM 1417 C CG . PHE B 2 45 ? 24.876 7.512 1.908 1.00 32.74 ? 46 PHE B CG 1 ATOM 1418 C CD1 . PHE B 2 45 ? 23.490 7.472 1.990 1.00 37.74 ? 46 PHE B CD1 1 ATOM 1419 C CD2 . PHE B 2 45 ? 25.599 6.601 2.597 1.00 33.48 ? 46 PHE B CD2 1 ATOM 1420 C CE1 . PHE B 2 45 ? 22.848 6.529 2.749 1.00 35.62 ? 46 PHE B CE1 1 ATOM 1421 C CE2 . PHE B 2 45 ? 24.966 5.616 3.334 1.00 34.11 ? 46 PHE B CE2 1 ATOM 1422 C CZ . PHE B 2 45 ? 23.593 5.583 3.407 1.00 34.70 ? 46 PHE B CZ 1 ATOM 1423 N N . GLY B 2 46 ? 25.400 11.179 -1.112 1.00 33.70 ? 47 GLY B N 1 ATOM 1424 C CA . GLY B 2 46 ? 26.280 12.213 -1.616 1.00 35.78 ? 47 GLY B CA 1 ATOM 1425 C C . GLY B 2 46 ? 27.710 11.769 -1.901 1.00 37.97 ? 47 GLY B C 1 ATOM 1426 O O . GLY B 2 46 ? 27.921 10.690 -2.447 1.00 42.48 ? 47 GLY B O 1 ATOM 1427 N N . ASP B 2 47 ? 28.674 12.622 -1.571 1.00 34.52 ? 48 ASP B N 1 ATOM 1428 C CA . ASP B 2 47 ? 30.071 12.485 -1.993 1.00 36.57 ? 48 ASP B CA 1 ATOM 1429 C C . ASP B 2 47 ? 30.830 11.229 -1.485 1.00 38.65 ? 48 ASP B C 1 ATOM 1430 O O . ASP B 2 47 ? 31.227 11.191 -0.309 1.00 37.89 ? 48 ASP B O 1 ATOM 1431 C CB . ASP B 2 47 ? 30.868 13.725 -1.532 1.00 32.57 ? 48 ASP B CB 1 ATOM 1432 C CG . ASP B 2 47 ? 32.300 13.726 -2.057 1.00 37.52 ? 48 ASP B CG 1 ATOM 1433 O OD1 . ASP B 2 47 ? 32.596 12.975 -3.032 1.00 33.88 ? 48 ASP B OD1 1 ATOM 1434 O OD2 . ASP B 2 47 ? 33.166 14.429 -1.472 1.00 39.78 ? 48 ASP B OD2 1 ATOM 1435 N N . LEU B 2 48 ? 31.091 10.270 -2.388 1.00 35.03 ? 49 LEU B N 1 ATOM 1436 C CA . LEU B 2 48 ? 31.832 9.018 -2.091 1.00 32.35 ? 49 LEU B CA 1 ATOM 1437 C C . LEU B 2 48 ? 33.069 8.894 -2.997 1.00 36.66 ? 49 LEU B C 1 ATOM 1438 O O . LEU B 2 48 ? 33.634 7.810 -3.184 1.00 31.24 ? 49 LEU B O 1 ATOM 1439 C CB . LEU B 2 48 ? 30.931 7.790 -2.317 1.00 28.02 ? 49 LEU B CB 1 ATOM 1440 C CG . LEU B 2 48 ? 29.657 7.826 -1.474 1.00 26.08 ? 49 LEU B CG 1 ATOM 1441 C CD1 . LEU B 2 48 ? 28.698 6.731 -1.876 1.00 26.25 ? 49 LEU B CD1 1 ATOM 1442 C CD2 . LEU B 2 48 ? 29.985 7.753 0.022 1.00 25.20 ? 49 LEU B CD2 1 ATOM 1443 N N . SER B 2 49 ? 33.517 10.007 -3.550 1.00 38.44 ? 50 SER B N 1 ATOM 1444 C CA . SER B 2 49 ? 34.388 9.938 -4.731 1.00 40.61 ? 50 SER B CA 1 ATOM 1445 C C . SER B 2 49 ? 35.870 9.746 -4.409 1.00 40.27 ? 50 SER B C 1 ATOM 1446 O O . SER B 2 49 ? 36.641 9.377 -5.262 1.00 38.60 ? 50 SER B O 1 ATOM 1447 C CB . SER B 2 49 ? 34.129 11.139 -5.669 1.00 41.49 ? 50 SER B CB 1 ATOM 1448 O OG . SER B 2 49 ? 33.883 12.319 -4.926 1.00 39.06 ? 50 SER B OG 1 ATOM 1449 N N . THR B 2 50 ? 36.261 9.919 -3.159 1.00 40.84 ? 51 THR B N 1 ATOM 1450 C CA . THR B 2 50 ? 37.590 9.471 -2.703 1.00 37.95 ? 51 THR B CA 1 ATOM 1451 C C . THR B 2 50 ? 37.495 8.841 -1.274 1.00 35.93 ? 51 THR B C 1 ATOM 1452 O O . THR B 2 50 ? 36.497 9.051 -0.569 1.00 37.71 ? 51 THR B O 1 ATOM 1453 C CB . THR B 2 50 ? 38.516 10.667 -2.640 1.00 38.22 ? 51 THR B CB 1 ATOM 1454 O OG1 . THR B 2 50 ? 38.046 11.472 -1.555 1.00 44.00 ? 51 THR B OG1 1 ATOM 1455 C CG2 . THR B 2 50 ? 38.472 11.499 -3.969 1.00 37.59 ? 51 THR B CG2 1 ATOM 1456 N N . PRO B 2 51 ? 38.522 8.079 -0.840 1.00 31.81 ? 52 PRO B N 1 ATOM 1457 C CA . PRO B 2 51 ? 38.482 7.471 0.497 1.00 31.14 ? 52 PRO B CA 1 ATOM 1458 C C . PRO B 2 51 ? 38.253 8.444 1.666 1.00 34.32 ? 52 PRO B C 1 ATOM 1459 O O . PRO B 2 51 ? 37.498 8.139 2.598 1.00 33.02 ? 52 PRO B O 1 ATOM 1460 C CB . PRO B 2 51 ? 39.839 6.763 0.622 1.00 29.05 ? 52 PRO B CB 1 ATOM 1461 C CG . PRO B 2 51 ? 40.501 6.878 -0.711 1.00 28.11 ? 52 PRO B CG 1 ATOM 1462 C CD . PRO B 2 51 ? 39.626 7.557 -1.671 1.00 27.56 ? 52 PRO B CD 1 ATOM 1463 N N . ASP B 2 52 ? 38.860 9.625 1.616 1.00 37.01 ? 53 ASP B N 1 ATOM 1464 C CA . ASP B 2 52 ? 38.545 10.682 2.617 1.00 37.59 ? 53 ASP B CA 1 ATOM 1465 C C . ASP B 2 52 ? 37.117 11.154 2.500 1.00 33.81 ? 53 ASP B C 1 ATOM 1466 O O . ASP B 2 52 ? 36.385 11.202 3.481 1.00 34.92 ? 53 ASP B O 1 ATOM 1467 C CB . ASP B 2 52 ? 39.493 11.882 2.461 1.00 43.45 ? 53 ASP B CB 1 ATOM 1468 C CG . ASP B 2 52 ? 40.912 11.536 2.826 1.00 44.41 ? 53 ASP B CG 1 ATOM 1469 O OD1 . ASP B 2 52 ? 41.116 10.626 3.666 1.00 40.70 ? 53 ASP B OD1 1 ATOM 1470 O OD2 . ASP B 2 52 ? 41.825 12.152 2.252 1.00 49.59 ? 53 ASP B OD2 1 ATOM 1471 N N . ALA B 2 53 ? 36.667 11.438 1.290 1.00 36.46 ? 54 ALA B N 1 ATOM 1472 C CA . ALA B 2 53 ? 35.239 11.745 1.143 1.00 36.40 ? 54 ALA B CA 1 ATOM 1473 C C . ALA B 2 53 ? 34.405 10.640 1.795 1.00 33.12 ? 54 ALA B C 1 ATOM 1474 O O . ALA B 2 53 ? 33.463 10.911 2.553 1.00 28.96 ? 54 ALA B O 1 ATOM 1475 C CB . ALA B 2 53 ? 34.853 11.919 -0.320 1.00 37.95 ? 54 ALA B CB 1 ATOM 1476 N N . VAL B 2 54 ? 34.726 9.375 1.501 1.00 28.09 ? 55 VAL B N 1 ATOM 1477 C CA . VAL B 2 54 ? 33.922 8.331 2.059 1.00 24.99 ? 55 VAL B CA 1 ATOM 1478 C C . VAL B 2 54 ? 33.984 8.299 3.625 1.00 24.84 ? 55 VAL B C 1 ATOM 1479 O O . VAL B 2 54 ? 32.957 8.225 4.298 1.00 26.58 ? 55 VAL B O 1 ATOM 1480 C CB . VAL B 2 54 ? 34.331 6.944 1.506 1.00 25.53 ? 55 VAL B CB 1 ATOM 1481 C CG1 . VAL B 2 54 ? 33.495 5.880 2.217 1.00 22.73 ? 55 VAL B CG1 1 ATOM 1482 C CG2 . VAL B 2 54 ? 34.080 6.863 0.009 1.00 25.35 ? 55 VAL B CG2 1 ATOM 1483 N N . MET B 2 55 ? 35.190 8.328 4.165 1.00 26.78 ? 56 MET B N 1 ATOM 1484 C CA . MET B 2 55 ? 35.442 8.083 5.575 1.00 28.68 ? 56 MET B CA 1 ATOM 1485 C C . MET B 2 55 ? 34.985 9.274 6.428 1.00 30.33 ? 56 MET B C 1 ATOM 1486 O O . MET B 2 55 ? 34.619 9.100 7.603 1.00 30.32 ? 56 MET B O 1 ATOM 1487 C CB . MET B 2 55 ? 36.942 7.768 5.804 1.00 26.03 ? 56 MET B CB 1 ATOM 1488 C CG . MET B 2 55 ? 37.449 6.445 5.182 1.00 29.17 ? 56 MET B CG 1 ATOM 1489 S SD . MET B 2 55 ? 36.340 4.969 5.250 1.00 26.47 ? 56 MET B SD 1 ATOM 1490 C CE . MET B 2 55 ? 36.558 4.726 7.018 1.00 24.70 ? 56 MET B CE 1 ATOM 1491 N N . GLY B 2 56 ? 34.934 10.464 5.835 1.00 30.83 ? 57 GLY B N 1 ATOM 1492 C CA . GLY B 2 56 ? 34.417 11.629 6.529 1.00 28.34 ? 57 GLY B CA 1 ATOM 1493 C C . GLY B 2 56 ? 32.964 12.016 6.228 1.00 30.98 ? 57 GLY B C 1 ATOM 1494 O O . GLY B 2 56 ? 32.512 13.021 6.739 1.00 35.18 ? 57 GLY B O 1 ATOM 1495 N N . ASN B 2 57 ? 32.247 11.265 5.385 1.00 28.12 ? 58 ASN B N 1 ATOM 1496 C CA . ASN B 2 57 ? 30.869 11.550 5.002 1.00 27.86 ? 58 ASN B CA 1 ATOM 1497 C C . ASN B 2 57 ? 29.887 11.311 6.154 1.00 30.74 ? 58 ASN B C 1 ATOM 1498 O O . ASN B 2 57 ? 29.824 10.221 6.722 1.00 30.85 ? 58 ASN B O 1 ATOM 1499 C CB . ASN B 2 57 ? 30.543 10.637 3.848 1.00 29.95 ? 58 ASN B CB 1 ATOM 1500 C CG . ASN B 2 57 ? 29.178 10.849 3.259 1.00 28.61 ? 58 ASN B CG 1 ATOM 1501 O OD1 . ASN B 2 57 ? 28.145 10.812 3.953 1.00 33.49 ? 58 ASN B OD1 1 ATOM 1502 N ND2 . ASN B 2 57 ? 29.153 11.012 1.932 1.00 28.58 ? 58 ASN B ND2 1 ATOM 1503 N N . PRO B 2 58 ? 29.092 12.322 6.518 1.00 32.12 ? 59 PRO B N 1 ATOM 1504 C CA . PRO B 2 58 ? 28.328 12.081 7.737 1.00 31.84 ? 59 PRO B CA 1 ATOM 1505 C C . PRO B 2 58 ? 27.194 11.053 7.545 1.00 29.41 ? 59 PRO B C 1 ATOM 1506 O O . PRO B 2 58 ? 26.801 10.374 8.500 1.00 25.56 ? 59 PRO B O 1 ATOM 1507 C CB . PRO B 2 58 ? 27.792 13.484 8.105 1.00 35.93 ? 59 PRO B CB 1 ATOM 1508 C CG . PRO B 2 58 ? 28.437 14.452 7.144 1.00 34.68 ? 59 PRO B CG 1 ATOM 1509 C CD . PRO B 2 58 ? 28.785 13.638 5.938 1.00 36.71 ? 59 PRO B CD 1 ATOM 1510 N N . LYS B 2 59 ? 26.680 10.922 6.329 1.00 27.00 ? 60 LYS B N 1 ATOM 1511 C CA . LYS B 2 59 ? 25.639 9.930 6.045 1.00 29.47 ? 60 LYS B CA 1 ATOM 1512 C C . LYS B 2 59 ? 26.147 8.501 6.076 1.00 27.52 ? 60 LYS B C 1 ATOM 1513 O O . LYS B 2 59 ? 25.391 7.573 6.349 1.00 27.64 ? 60 LYS B O 1 ATOM 1514 C CB . LYS B 2 59 ? 24.992 10.184 4.678 1.00 36.19 ? 60 LYS B CB 1 ATOM 1515 C CG . LYS B 2 59 ? 24.067 11.413 4.646 1.00 38.40 ? 60 LYS B CG 1 ATOM 1516 C CD . LYS B 2 59 ? 23.183 11.343 3.422 1.00 45.33 ? 60 LYS B CD 1 ATOM 1517 C CE . LYS B 2 59 ? 22.124 12.418 3.388 1.00 46.23 ? 60 LYS B CE 1 ATOM 1518 N NZ . LYS B 2 59 ? 22.745 13.562 2.674 1.00 50.40 ? 60 LYS B NZ 1 ATOM 1519 N N . VAL B 2 60 ? 27.430 8.329 5.780 1.00 27.23 ? 61 VAL B N 1 ATOM 1520 C CA . VAL B 2 60 ? 28.043 7.036 5.900 1.00 25.07 ? 61 VAL B CA 1 ATOM 1521 C C . VAL B 2 60 ? 28.088 6.662 7.381 1.00 25.90 ? 61 VAL B C 1 ATOM 1522 O O . VAL B 2 60 ? 27.755 5.495 7.801 1.00 24.84 ? 61 VAL B O 1 ATOM 1523 C CB . VAL B 2 60 ? 29.451 7.023 5.239 1.00 26.00 ? 61 VAL B CB 1 ATOM 1524 C CG1 . VAL B 2 60 ? 30.254 5.810 5.661 1.00 25.06 ? 61 VAL B CG1 1 ATOM 1525 C CG2 . VAL B 2 60 ? 29.317 7.058 3.709 1.00 27.70 ? 61 VAL B CG2 1 ATOM 1526 N N . LYS B 2 61 ? 28.510 7.634 8.181 1.00 26.81 ? 62 LYS B N 1 ATOM 1527 C CA . LYS B 2 61 ? 28.641 7.416 9.590 1.00 29.13 ? 62 LYS B CA 1 ATOM 1528 C C . LYS B 2 61 ? 27.283 7.080 10.194 1.00 29.19 ? 62 LYS B C 1 ATOM 1529 O O . LYS B 2 61 ? 27.130 6.115 10.923 1.00 30.71 ? 62 LYS B O 1 ATOM 1530 C CB . LYS B 2 61 ? 29.255 8.654 10.247 1.00 31.60 ? 62 LYS B CB 1 ATOM 1531 C CG . LYS B 2 61 ? 29.154 8.596 11.751 1.00 35.53 ? 62 LYS B CG 1 ATOM 1532 C CD . LYS B 2 61 ? 29.972 9.689 12.423 1.00 38.95 ? 62 LYS B CD 1 ATOM 1533 C CE . LYS B 2 61 ? 29.640 9.731 13.907 1.00 43.34 ? 62 LYS B CE 1 ATOM 1534 N NZ . LYS B 2 61 ? 30.770 10.362 14.649 1.00 46.98 ? 62 LYS B NZ 1 ATOM 1535 N N . ALA B 2 62 ? 26.279 7.856 9.821 1.00 30.50 ? 63 ALA B N 1 ATOM 1536 C CA . ALA B 2 62 ? 24.950 7.646 10.337 1.00 29.84 ? 63 ALA B CA 1 ATOM 1537 C C . ALA B 2 62 ? 24.356 6.355 9.878 1.00 28.28 ? 63 ALA B C 1 ATOM 1538 O O . ALA B 2 62 ? 23.713 5.662 10.666 1.00 27.56 ? 63 ALA B O 1 ATOM 1539 C CB . ALA B 2 62 ? 24.022 8.800 9.987 1.00 26.58 ? 63 ALA B CB 1 ATOM 1540 N N . HIS B 2 63 ? 24.548 5.996 8.612 1.00 27.33 ? 64 HIS B N 1 ATOM 1541 C CA . HIS B 2 63 ? 23.959 4.748 8.192 1.00 25.95 ? 64 HIS B CA 1 ATOM 1542 C C . HIS B 2 63 ? 24.713 3.591 8.862 1.00 27.21 ? 64 HIS B C 1 ATOM 1543 O O . HIS B 2 63 ? 24.100 2.585 9.274 1.00 25.38 ? 64 HIS B O 1 ATOM 1544 C CB . HIS B 2 63 ? 23.886 4.657 6.656 1.00 26.29 ? 64 HIS B CB 1 ATOM 1545 C CG . HIS B 2 63 ? 23.324 3.375 6.175 1.00 26.39 ? 64 HIS B CG 1 ATOM 1546 N ND1 . HIS B 2 63 ? 21.979 3.093 6.235 1.00 25.93 ? 64 HIS B ND1 1 ATOM 1547 C CD2 . HIS B 2 63 ? 23.925 2.273 5.653 1.00 28.71 ? 64 HIS B CD2 1 ATOM 1548 C CE1 . HIS B 2 63 ? 21.771 1.873 5.755 1.00 28.27 ? 64 HIS B CE1 1 ATOM 1549 N NE2 . HIS B 2 63 ? 22.930 1.358 5.379 1.00 25.87 ? 64 HIS B NE2 1 ATOM 1550 N N . GLY B 2 64 ? 26.031 3.766 9.000 1.00 25.77 ? 65 GLY B N 1 ATOM 1551 C CA . GLY B 2 64 ? 26.837 2.834 9.730 1.00 31.04 ? 65 GLY B CA 1 ATOM 1552 C C . GLY B 2 64 ? 26.284 2.487 11.103 1.00 34.34 ? 65 GLY B C 1 ATOM 1553 O O . GLY B 2 64 ? 26.195 1.285 11.481 1.00 33.11 ? 65 GLY B O 1 ATOM 1554 N N . LYS B 2 65 ? 25.891 3.515 11.853 1.00 32.67 ? 66 LYS B N 1 ATOM 1555 C CA . LYS B 2 65 ? 25.246 3.265 13.128 1.00 35.78 ? 66 LYS B CA 1 ATOM 1556 C C . LYS B 2 65 ? 24.108 2.287 12.981 1.00 30.01 ? 66 LYS B C 1 ATOM 1557 O O . LYS B 2 65 ? 23.959 1.362 13.806 1.00 29.53 ? 66 LYS B O 1 ATOM 1558 C CB . LYS B 2 65 ? 24.694 4.547 13.744 1.00 42.46 ? 66 LYS B CB 1 ATOM 1559 C CG . LYS B 2 65 ? 25.699 5.414 14.471 1.00 48.07 ? 66 LYS B CG 1 ATOM 1560 C CD . LYS B 2 65 ? 24.952 6.642 14.994 1.00 53.95 ? 66 LYS B CD 1 ATOM 1561 C CE . LYS B 2 65 ? 25.832 7.583 15.790 1.00 59.49 ? 66 LYS B CE 1 ATOM 1562 N NZ . LYS B 2 65 ? 25.026 8.304 16.819 1.00 66.64 ? 66 LYS B NZ 1 ATOM 1563 N N . LYS B 2 66 ? 23.278 2.463 11.954 1.00 29.50 ? 67 LYS B N 1 ATOM 1564 C CA . LYS B 2 66 ? 22.126 1.569 11.789 1.00 29.78 ? 67 LYS B CA 1 ATOM 1565 C C . LYS B 2 66 ? 22.518 0.105 11.546 1.00 30.16 ? 67 LYS B C 1 ATOM 1566 O O . LYS B 2 66 ? 21.864 -0.843 12.069 1.00 27.61 ? 67 LYS B O 1 ATOM 1567 C CB . LYS B 2 66 ? 21.227 2.028 10.672 1.00 31.40 ? 67 LYS B CB 1 ATOM 1568 C CG . LYS B 2 66 ? 20.408 3.262 11.000 1.00 37.39 ? 67 LYS B CG 1 ATOM 1569 C CD . LYS B 2 66 ? 19.894 3.897 9.717 1.00 41.91 ? 67 LYS B CD 1 ATOM 1570 C CE . LYS B 2 66 ? 18.487 4.449 9.817 1.00 52.58 ? 67 LYS B CE 1 ATOM 1571 N NZ . LYS B 2 66 ? 17.554 3.691 8.908 1.00 59.44 ? 67 LYS B NZ 1 ATOM 1572 N N . VAL B 2 67 ? 23.574 -0.071 10.752 1.00 27.57 ? 68 VAL B N 1 ATOM 1573 C CA . VAL B 2 67 ? 24.062 -1.412 10.407 1.00 26.40 ? 68 VAL B CA 1 ATOM 1574 C C . VAL B 2 67 ? 24.586 -2.073 11.669 1.00 24.80 ? 68 VAL B C 1 ATOM 1575 O O . VAL B 2 67 ? 24.249 -3.218 11.954 1.00 22.01 ? 68 VAL B O 1 ATOM 1576 C CB . VAL B 2 67 ? 25.154 -1.382 9.296 1.00 24.27 ? 68 VAL B CB 1 ATOM 1577 C CG1 . VAL B 2 67 ? 25.757 -2.756 9.096 1.00 24.47 ? 68 VAL B CG1 1 ATOM 1578 C CG2 . VAL B 2 67 ? 24.542 -0.940 7.980 1.00 27.03 ? 68 VAL B CG2 1 ATOM 1579 N N . LEU B 2 68 ? 25.385 -1.324 12.435 1.00 26.25 ? 69 LEU B N 1 ATOM 1580 C CA . LEU B 2 68 ? 25.917 -1.817 13.706 1.00 25.90 ? 69 LEU B CA 1 ATOM 1581 C C . LEU B 2 68 ? 24.811 -2.244 14.681 1.00 27.04 ? 69 LEU B C 1 ATOM 1582 O O . LEU B 2 68 ? 24.925 -3.277 15.358 1.00 29.02 ? 69 LEU B O 1 ATOM 1583 C CB . LEU B 2 68 ? 26.805 -0.787 14.351 1.00 26.96 ? 69 LEU B CB 1 ATOM 1584 C CG . LEU B 2 68 ? 27.824 -1.338 15.340 1.00 30.08 ? 69 LEU B CG 1 ATOM 1585 C CD1 . LEU B 2 68 ? 28.946 -2.069 14.603 1.00 32.20 ? 69 LEU B CD1 1 ATOM 1586 C CD2 . LEU B 2 68 ? 28.401 -0.215 16.168 1.00 29.82 ? 69 LEU B CD2 1 ATOM 1587 N N . GLY B 2 69 ? 23.743 -1.451 14.689 1.00 28.09 ? 70 GLY B N 1 ATOM 1588 C CA . GLY B 2 69 ? 22.561 -1.662 15.501 1.00 29.39 ? 70 GLY B CA 1 ATOM 1589 C C . GLY B 2 69 ? 21.885 -2.939 15.149 1.00 33.44 ? 70 GLY B C 1 ATOM 1590 O O . GLY B 2 69 ? 21.415 -3.639 16.055 1.00 32.64 ? 70 GLY B O 1 ATOM 1591 N N . ALA B 2 70 ? 21.828 -3.262 13.840 1.00 31.34 ? 71 ALA B N 1 ATOM 1592 C CA . ALA B 2 70 ? 21.314 -4.549 13.403 1.00 29.47 ? 71 ALA B CA 1 ATOM 1593 C C . ALA B 2 70 ? 22.208 -5.730 13.851 1.00 30.28 ? 71 ALA B C 1 ATOM 1594 O O . ALA B 2 70 ? 21.678 -6.806 14.229 1.00 29.72 ? 71 ALA B O 1 ATOM 1595 C CB . ALA B 2 70 ? 21.082 -4.586 11.887 1.00 30.92 ? 71 ALA B CB 1 ATOM 1596 N N . PHE B 2 71 ? 23.534 -5.563 13.785 1.00 29.30 ? 72 PHE B N 1 ATOM 1597 C CA . PHE B 2 71 ? 24.449 -6.564 14.349 1.00 29.70 ? 72 PHE B CA 1 ATOM 1598 C C . PHE B 2 71 ? 24.194 -6.673 15.849 1.00 25.79 ? 72 PHE B C 1 ATOM 1599 O O . PHE B 2 71 ? 24.149 -7.755 16.343 1.00 24.86 ? 72 PHE B O 1 ATOM 1600 C CB . PHE B 2 71 ? 25.944 -6.282 14.112 1.00 29.02 ? 72 PHE B CB 1 ATOM 1601 C CG . PHE B 2 71 ? 26.442 -6.719 12.740 1.00 29.21 ? 72 PHE B CG 1 ATOM 1602 C CD1 . PHE B 2 71 ? 26.899 -7.974 12.552 1.00 30.20 ? 72 PHE B CD1 1 ATOM 1603 C CD2 . PHE B 2 71 ? 26.428 -5.820 11.617 1.00 30.93 ? 72 PHE B CD2 1 ATOM 1604 C CE1 . PHE B 2 71 ? 27.343 -8.387 11.288 1.00 32.74 ? 72 PHE B CE1 1 ATOM 1605 C CE2 . PHE B 2 71 ? 26.880 -6.226 10.348 1.00 29.87 ? 72 PHE B CE2 1 ATOM 1606 C CZ . PHE B 2 71 ? 27.329 -7.516 10.192 1.00 29.30 ? 72 PHE B CZ 1 ATOM 1607 N N . SER B 2 72 ? 24.029 -5.566 16.558 1.00 28.22 ? 73 SER B N 1 ATOM 1608 C CA . SER B 2 72 ? 23.630 -5.675 17.999 1.00 32.03 ? 73 SER B CA 1 ATOM 1609 C C . SER B 2 72 ? 22.362 -6.496 18.154 1.00 30.88 ? 73 SER B C 1 ATOM 1610 O O . SER B 2 72 ? 22.342 -7.457 18.920 1.00 31.19 ? 73 SER B O 1 ATOM 1611 C CB . SER B 2 72 ? 23.480 -4.318 18.601 1.00 28.53 ? 73 SER B CB 1 ATOM 1612 O OG . SER B 2 72 ? 24.773 -3.836 18.680 1.00 32.08 ? 73 SER B OG 1 ATOM 1613 N N . ASP B 2 73 ? 21.343 -6.207 17.354 1.00 29.27 ? 74 ASP B N 1 ATOM 1614 C CA . ASP B 2 73 ? 20.158 -7.107 17.377 1.00 34.44 ? 74 ASP B CA 1 ATOM 1615 C C . ASP B 2 73 ? 20.499 -8.563 17.164 1.00 36.29 ? 74 ASP B C 1 ATOM 1616 O O . ASP B 2 73 ? 19.986 -9.418 17.875 1.00 36.22 ? 74 ASP B O 1 ATOM 1617 C CB . ASP B 2 73 ? 19.079 -6.731 16.370 1.00 36.37 ? 74 ASP B CB 1 ATOM 1618 C CG . ASP B 2 73 ? 18.472 -5.415 16.670 1.00 41.73 ? 74 ASP B CG 1 ATOM 1619 O OD1 . ASP B 2 73 ? 18.593 -5.007 17.846 1.00 47.72 ? 74 ASP B OD1 1 ATOM 1620 O OD2 . ASP B 2 73 ? 17.918 -4.769 15.745 1.00 54.77 ? 74 ASP B OD2 1 ATOM 1621 N N . GLY B 2 74 ? 21.316 -8.876 16.161 1.00 37.13 ? 75 GLY B N 1 ATOM 1622 C CA . GLY B 2 74 ? 21.698 -10.260 15.920 1.00 32.66 ? 75 GLY B CA 1 ATOM 1623 C C . GLY B 2 74 ? 22.359 -10.896 17.142 1.00 37.94 ? 75 GLY B C 1 ATOM 1624 O O . GLY B 2 74 ? 22.069 -12.059 17.481 1.00 33.44 ? 75 GLY B O 1 ATOM 1625 N N . LEU B 2 75 ? 23.225 -10.141 17.821 1.00 35.33 ? 76 LEU B N 1 ATOM 1626 C CA . LEU B 2 75 ? 23.868 -10.673 19.020 1.00 41.88 ? 76 LEU B CA 1 ATOM 1627 C C . LEU B 2 75 ? 22.804 -11.104 20.082 1.00 41.49 ? 76 LEU B C 1 ATOM 1628 O O . LEU B 2 75 ? 22.875 -12.189 20.662 1.00 38.05 ? 76 LEU B O 1 ATOM 1629 C CB . LEU B 2 75 ? 24.902 -9.684 19.573 1.00 41.25 ? 76 LEU B CB 1 ATOM 1630 C CG . LEU B 2 75 ? 26.162 -9.498 18.699 1.00 43.41 ? 76 LEU B CG 1 ATOM 1631 C CD1 . LEU B 2 75 ? 27.077 -8.439 19.266 1.00 44.12 ? 76 LEU B CD1 1 ATOM 1632 C CD2 . LEU B 2 75 ? 26.939 -10.800 18.496 1.00 43.11 ? 76 LEU B CD2 1 ATOM 1633 N N . ALA B 2 76 ? 21.779 -10.284 20.257 1.00 38.14 ? 77 ALA B N 1 ATOM 1634 C CA . ALA B 2 76 ? 20.723 -10.572 21.211 1.00 35.69 ? 77 ALA B CA 1 ATOM 1635 C C . ALA B 2 76 ? 19.884 -11.781 20.838 1.00 39.60 ? 77 ALA B C 1 ATOM 1636 O O . ALA B 2 76 ? 19.082 -12.198 21.637 1.00 38.21 ? 77 ALA B O 1 ATOM 1637 C CB . ALA B 2 76 ? 19.822 -9.358 21.348 1.00 32.42 ? 77 ALA B CB 1 ATOM 1638 N N . HIS B 2 77 ? 20.031 -12.323 19.629 1.00 39.43 ? 78 HIS B N 1 ATOM 1639 C CA . HIS B 2 77 ? 19.088 -13.315 19.099 1.00 39.64 ? 78 HIS B CA 1 ATOM 1640 C C . HIS B 2 77 ? 19.729 -14.384 18.280 1.00 36.13 ? 78 HIS B C 1 ATOM 1641 O O . HIS B 2 77 ? 19.135 -14.877 17.328 1.00 42.99 ? 78 HIS B O 1 ATOM 1642 C CB . HIS B 2 77 ? 18.002 -12.646 18.241 1.00 38.70 ? 78 HIS B CB 1 ATOM 1643 C CG . HIS B 2 77 ? 17.139 -11.716 19.011 1.00 41.77 ? 78 HIS B CG 1 ATOM 1644 N ND1 . HIS B 2 77 ? 17.462 -10.386 19.201 1.00 46.64 ? 78 HIS B ND1 1 ATOM 1645 C CD2 . HIS B 2 77 ? 15.974 -11.920 19.672 1.00 44.14 ? 78 HIS B CD2 1 ATOM 1646 C CE1 . HIS B 2 77 ? 16.529 -9.805 19.937 1.00 44.87 ? 78 HIS B CE1 1 ATOM 1647 N NE2 . HIS B 2 77 ? 15.618 -10.714 20.242 1.00 45.06 ? 78 HIS B NE2 1 ATOM 1648 N N . LEU B 2 78 ? 20.914 -14.813 18.685 1.00 37.66 ? 79 LEU B N 1 ATOM 1649 C CA . LEU B 2 78 ? 21.670 -15.801 17.910 1.00 36.52 ? 79 LEU B CA 1 ATOM 1650 C C . LEU B 2 78 ? 20.915 -17.058 17.596 1.00 37.84 ? 79 LEU B C 1 ATOM 1651 O O . LEU B 2 78 ? 21.280 -17.831 16.702 1.00 38.99 ? 79 LEU B O 1 ATOM 1652 C CB . LEU B 2 78 ? 22.953 -16.167 18.652 1.00 34.47 ? 79 LEU B CB 1 ATOM 1653 C CG . LEU B 2 78 ? 23.794 -14.912 18.882 1.00 33.95 ? 79 LEU B CG 1 ATOM 1654 C CD1 . LEU B 2 78 ? 24.912 -15.130 19.881 1.00 35.31 ? 79 LEU B CD1 1 ATOM 1655 C CD2 . LEU B 2 78 ? 24.340 -14.431 17.531 1.00 33.99 ? 79 LEU B CD2 1 ATOM 1656 N N . ASP B 2 79 ? 19.886 -17.278 18.384 1.00 44.32 ? 80 ASP B N 1 ATOM 1657 C CA . ASP B 2 79 ? 19.047 -18.450 18.288 1.00 43.24 ? 80 ASP B CA 1 ATOM 1658 C C . ASP B 2 79 ? 18.021 -18.288 17.214 1.00 41.84 ? 80 ASP B C 1 ATOM 1659 O O . ASP B 2 79 ? 17.426 -19.254 16.835 1.00 43.37 ? 80 ASP B O 1 ATOM 1660 C CB . ASP B 2 79 ? 18.302 -18.654 19.621 1.00 51.63 ? 80 ASP B CB 1 ATOM 1661 C CG . ASP B 2 79 ? 17.622 -17.359 20.143 1.00 51.87 ? 80 ASP B CG 1 ATOM 1662 O OD1 . ASP B 2 79 ? 16.923 -16.631 19.405 1.00 59.03 ? 80 ASP B OD1 1 ATOM 1663 O OD2 . ASP B 2 79 ? 17.774 -17.073 21.337 1.00 67.71 ? 80 ASP B OD2 1 ATOM 1664 N N . ASN B 2 80 ? 17.744 -17.064 16.757 1.00 42.09 ? 81 ASN B N 1 ATOM 1665 C CA . ASN B 2 80 ? 16.722 -16.901 15.715 1.00 41.77 ? 81 ASN B CA 1 ATOM 1666 C C . ASN B 2 80 ? 17.068 -15.819 14.696 1.00 37.49 ? 81 ASN B C 1 ATOM 1667 O O . ASN B 2 80 ? 16.293 -14.841 14.510 1.00 29.01 ? 81 ASN B O 1 ATOM 1668 C CB . ASN B 2 80 ? 15.329 -16.651 16.325 1.00 41.39 ? 81 ASN B CB 1 ATOM 1669 C CG . ASN B 2 80 ? 14.229 -16.649 15.259 1.00 45.68 ? 81 ASN B CG 1 ATOM 1670 O OD1 . ASN B 2 80 ? 14.292 -17.395 14.255 1.00 46.81 ? 81 ASN B OD1 1 ATOM 1671 N ND2 . ASN B 2 80 ? 13.254 -15.759 15.428 1.00 46.94 ? 81 ASN B ND2 1 ATOM 1672 N N . LEU B 2 81 ? 18.224 -15.982 14.029 1.00 34.89 ? 82 LEU B N 1 ATOM 1673 C CA . LEU B 2 81 ? 18.748 -14.852 13.224 1.00 31.21 ? 82 LEU B CA 1 ATOM 1674 C C . LEU B 2 81 ? 17.802 -14.616 12.030 1.00 30.63 ? 82 LEU B C 1 ATOM 1675 O O . LEU B 2 81 ? 17.471 -13.466 11.715 1.00 30.37 ? 82 LEU B O 1 ATOM 1676 C CB . LEU B 2 81 ? 20.203 -15.081 12.799 1.00 29.52 ? 82 LEU B CB 1 ATOM 1677 C CG . LEU B 2 81 ? 21.212 -15.018 13.916 1.00 26.73 ? 82 LEU B CG 1 ATOM 1678 C CD1 . LEU B 2 81 ? 22.563 -15.509 13.446 1.00 31.10 ? 82 LEU B CD1 1 ATOM 1679 C CD2 . LEU B 2 81 ? 21.323 -13.647 14.518 1.00 30.15 ? 82 LEU B CD2 1 ATOM 1680 N N . LYS B 2 82 ? 17.311 -15.722 11.473 1.00 32.52 ? 83 LYS B N 1 ATOM 1681 C CA . LYS B 2 82 ? 16.292 -15.765 10.392 1.00 38.29 ? 83 LYS B CA 1 ATOM 1682 C C . LYS B 2 82 ? 15.065 -14.865 10.618 1.00 38.34 ? 83 LYS B C 1 ATOM 1683 O O . LYS B 2 82 ? 14.824 -13.918 9.831 1.00 34.28 ? 83 LYS B O 1 ATOM 1684 C CB . LYS B 2 82 ? 15.858 -17.216 10.150 1.00 39.85 ? 83 LYS B CB 1 ATOM 1685 C CG . LYS B 2 82 ? 16.635 -17.928 9.037 1.00 45.68 ? 83 LYS B CG 1 ATOM 1686 C CD . LYS B 2 82 ? 18.122 -18.089 9.335 1.00 46.22 ? 83 LYS B CD 1 ATOM 1687 C CE . LYS B 2 82 ? 18.937 -18.574 8.120 1.00 53.29 ? 83 LYS B CE 1 ATOM 1688 N NZ . LYS B 2 82 ? 18.513 -19.930 7.624 1.00 53.50 ? 83 LYS B NZ 1 ATOM 1689 N N . GLY B 2 83 ? 14.313 -15.125 11.699 1.00 36.34 ? 84 GLY B N 1 ATOM 1690 C CA . GLY B 2 83 ? 13.190 -14.277 12.082 1.00 29.75 ? 84 GLY B CA 1 ATOM 1691 C C . GLY B 2 83 ? 13.622 -12.859 12.315 1.00 31.23 ? 84 GLY B C 1 ATOM 1692 O O . GLY B 2 83 ? 13.012 -11.894 11.850 1.00 34.12 ? 84 GLY B O 1 ATOM 1693 N N . THR B 2 84 ? 14.708 -12.684 13.027 1.00 31.16 ? 85 THR B N 1 ATOM 1694 C CA . THR B 2 84 ? 15.126 -11.354 13.381 1.00 31.37 ? 85 THR B CA 1 ATOM 1695 C C . THR B 2 84 ? 15.398 -10.463 12.118 1.00 34.35 ? 85 THR B C 1 ATOM 1696 O O . THR B 2 84 ? 15.148 -9.212 12.150 1.00 30.04 ? 85 THR B O 1 ATOM 1697 C CB . THR B 2 84 ? 16.429 -11.442 14.186 1.00 35.38 ? 85 THR B CB 1 ATOM 1698 O OG1 . THR B 2 84 ? 16.335 -12.508 15.175 1.00 35.66 ? 85 THR B OG1 1 ATOM 1699 C CG2 . THR B 2 84 ? 16.773 -10.123 14.784 1.00 33.81 ? 85 THR B CG2 1 ATOM 1700 N N . PHE B 2 85 ? 15.941 -11.102 11.057 1.00 30.68 ? 86 PHE B N 1 ATOM 1701 C CA . PHE B 2 85 ? 16.432 -10.389 9.858 1.00 33.51 ? 86 PHE B CA 1 ATOM 1702 C C . PHE B 2 85 ? 15.505 -10.546 8.643 1.00 33.79 ? 86 PHE B C 1 ATOM 1703 O O . PHE B 2 85 ? 15.844 -10.108 7.558 1.00 32.87 ? 86 PHE B O 1 ATOM 1704 C CB . PHE B 2 85 ? 17.886 -10.841 9.515 1.00 33.08 ? 86 PHE B CB 1 ATOM 1705 C CG . PHE B 2 85 ? 18.934 -10.224 10.403 1.00 30.95 ? 86 PHE B CG 1 ATOM 1706 C CD1 . PHE B 2 85 ? 19.293 -8.919 10.246 1.00 34.42 ? 86 PHE B CD1 1 ATOM 1707 C CD2 . PHE B 2 85 ? 19.565 -10.964 11.403 1.00 33.52 ? 86 PHE B CD2 1 ATOM 1708 C CE1 . PHE B 2 85 ? 20.243 -8.324 11.074 1.00 34.32 ? 86 PHE B CE1 1 ATOM 1709 C CE2 . PHE B 2 85 ? 20.516 -10.393 12.239 1.00 32.14 ? 86 PHE B CE2 1 ATOM 1710 C CZ . PHE B 2 85 ? 20.854 -9.063 12.081 1.00 35.25 ? 86 PHE B CZ 1 ATOM 1711 N N . ALA B 2 86 ? 14.308 -11.124 8.827 1.00 34.61 ? 87 ALA B N 1 ATOM 1712 C CA . ALA B 2 86 ? 13.445 -11.481 7.706 1.00 32.65 ? 87 ALA B CA 1 ATOM 1713 C C . ALA B 2 86 ? 12.990 -10.245 6.900 1.00 33.33 ? 87 ALA B C 1 ATOM 1714 O O . ALA B 2 86 ? 12.973 -10.239 5.647 1.00 30.80 ? 87 ALA B O 1 ATOM 1715 C CB . ALA B 2 86 ? 12.236 -12.263 8.221 1.00 38.26 ? 87 ALA B CB 1 ATOM 1716 N N . THR B 2 87 ? 12.651 -9.199 7.614 1.00 30.45 ? 88 THR B N 1 ATOM 1717 C CA . THR B 2 87 ? 12.200 -7.976 6.991 1.00 37.19 ? 88 THR B CA 1 ATOM 1718 C C . THR B 2 87 ? 13.365 -7.297 6.266 1.00 37.03 ? 88 THR B C 1 ATOM 1719 O O . THR B 2 87 ? 13.193 -6.840 5.145 1.00 37.19 ? 88 THR B O 1 ATOM 1720 C CB . THR B 2 87 ? 11.621 -7.010 8.050 1.00 37.93 ? 88 THR B CB 1 ATOM 1721 O OG1 . THR B 2 87 ? 10.381 -7.542 8.509 1.00 39.99 ? 88 THR B OG1 1 ATOM 1722 C CG2 . THR B 2 87 ? 11.380 -5.613 7.506 1.00 42.07 ? 88 THR B CG2 1 ATOM 1723 N N . LEU B 2 88 ? 14.533 -7.250 6.914 1.00 35.40 ? 89 LEU B N 1 ATOM 1724 C CA . LEU B 2 88 ? 15.734 -6.672 6.298 1.00 33.07 ? 89 LEU B CA 1 ATOM 1725 C C . LEU B 2 88 ? 16.141 -7.458 5.058 1.00 27.99 ? 89 LEU B C 1 ATOM 1726 O O . LEU B 2 88 ? 16.482 -6.854 4.050 1.00 25.44 ? 89 LEU B O 1 ATOM 1727 C CB . LEU B 2 88 ? 16.899 -6.641 7.285 1.00 33.23 ? 89 LEU B CB 1 ATOM 1728 C CG . LEU B 2 88 ? 16.916 -5.403 8.159 1.00 34.69 ? 89 LEU B CG 1 ATOM 1729 C CD1 . LEU B 2 88 ? 18.136 -5.445 9.058 1.00 33.46 ? 89 LEU B CD1 1 ATOM 1730 C CD2 . LEU B 2 88 ? 16.910 -4.119 7.357 1.00 32.45 ? 89 LEU B CD2 1 ATOM 1731 N N . SER B 2 89 ? 16.057 -8.790 5.134 1.00 24.12 ? 90 SER B N 1 ATOM 1732 C CA . SER B 2 89 ? 16.390 -9.660 3.994 1.00 27.37 ? 90 SER B CA 1 ATOM 1733 C C . SER B 2 89 ? 15.541 -9.317 2.789 1.00 30.53 ? 90 SER B C 1 ATOM 1734 O O . SER B 2 89 ? 16.034 -9.253 1.662 1.00 28.79 ? 90 SER B O 1 ATOM 1735 C CB . SER B 2 89 ? 16.221 -11.123 4.311 1.00 26.07 ? 90 SER B CB 1 ATOM 1736 O OG . SER B 2 89 ? 16.548 -11.963 3.202 1.00 23.02 ? 90 SER B OG 1 ATOM 1737 N N . GLU B 2 90 ? 14.269 -9.049 3.063 1.00 29.15 ? 91 GLU B N 1 ATOM 1738 C CA . GLU B 2 90 ? 13.304 -8.759 2.047 1.00 30.15 ? 91 GLU B CA 1 ATOM 1739 C C . GLU B 2 90 ? 13.566 -7.369 1.403 1.00 26.85 ? 91 GLU B C 1 ATOM 1740 O O . GLU B 2 90 ? 13.376 -7.207 0.213 1.00 28.49 ? 91 GLU B O 1 ATOM 1741 C CB . GLU B 2 90 ? 11.905 -8.748 2.696 1.00 36.58 ? 91 GLU B CB 1 ATOM 1742 C CG . GLU B 2 90 ? 10.833 -9.375 1.884 1.00 43.91 ? 91 GLU B CG 1 ATOM 1743 C CD . GLU B 2 90 ? 9.460 -9.195 2.529 1.00 54.53 ? 91 GLU B CD 1 ATOM 1744 O OE1 . GLU B 2 90 ? 9.327 -9.361 3.772 1.00 56.36 ? 91 GLU B OE1 1 ATOM 1745 O OE2 . GLU B 2 90 ? 8.508 -8.890 1.777 1.00 62.49 ? 91 GLU B OE2 1 ATOM 1746 N N . LEU B 2 91 ? 13.929 -6.387 2.220 1.00 23.51 ? 92 LEU B N 1 ATOM 1747 C CA . LEU B 2 91 ? 14.249 -5.086 1.765 1.00 24.87 ? 92 LEU B CA 1 ATOM 1748 C C . LEU B 2 91 ? 15.491 -5.157 0.816 1.00 27.02 ? 92 LEU B C 1 ATOM 1749 O O . LEU B 2 91 ? 15.465 -4.617 -0.301 1.00 28.97 ? 92 LEU B O 1 ATOM 1750 C CB . LEU B 2 91 ? 14.603 -4.200 2.953 1.00 25.02 ? 92 LEU B CB 1 ATOM 1751 C CG . LEU B 2 91 ? 15.239 -2.832 2.645 1.00 24.50 ? 92 LEU B CG 1 ATOM 1752 C CD1 . LEU B 2 91 ? 14.256 -1.866 2.047 1.00 28.73 ? 92 LEU B CD1 1 ATOM 1753 C CD2 . LEU B 2 91 ? 15.868 -2.241 3.875 1.00 23.51 ? 92 LEU B CD2 1 ATOM 1754 N N . HIS B 2 92 ? 16.561 -5.816 1.278 1.00 25.00 ? 93 HIS B N 1 ATOM 1755 C CA . HIS B 2 92 ? 17.812 -5.823 0.546 1.00 25.19 ? 93 HIS B CA 1 ATOM 1756 C C . HIS B 2 92 ? 17.583 -6.576 -0.767 1.00 24.68 ? 93 HIS B C 1 ATOM 1757 O O . HIS B 2 92 ? 18.134 -6.182 -1.789 1.00 24.52 ? 93 HIS B O 1 ATOM 1758 C CB . HIS B 2 92 ? 18.971 -6.417 1.391 1.00 24.64 ? 93 HIS B CB 1 ATOM 1759 C CG . HIS B 2 92 ? 19.467 -5.488 2.454 1.00 25.20 ? 93 HIS B CG 1 ATOM 1760 N ND1 . HIS B 2 92 ? 18.812 -5.310 3.653 1.00 26.99 ? 93 HIS B ND1 1 ATOM 1761 C CD2 . HIS B 2 92 ? 20.523 -4.652 2.479 1.00 24.80 ? 93 HIS B CD2 1 ATOM 1762 C CE1 . HIS B 2 92 ? 19.465 -4.420 4.378 1.00 27.40 ? 93 HIS B CE1 1 ATOM 1763 N NE2 . HIS B 2 92 ? 20.497 -3.992 3.681 1.00 24.68 ? 93 HIS B NE2 1 ATOM 1764 N N . CYS B 2 93 ? 16.768 -7.638 -0.754 1.00 24.96 ? 94 CYS B N 1 ATOM 1765 C CA . CYS B 2 93 ? 16.506 -8.440 -1.957 1.00 24.67 ? 94 CYS B CA 1 ATOM 1766 C C . CYS B 2 93 ? 15.585 -7.736 -2.927 1.00 24.68 ? 94 CYS B C 1 ATOM 1767 O O . CYS B 2 93 ? 15.991 -7.398 -4.016 1.00 22.64 ? 94 CYS B O 1 ATOM 1768 C CB . CYS B 2 93 ? 15.847 -9.793 -1.648 1.00 28.51 ? 94 CYS B CB 1 ATOM 1769 S SG . CYS B 2 93 ? 15.559 -10.813 -3.136 1.00 32.41 ? 94 CYS B SG 1 ATOM 1770 N N . ASP B 2 94 ? 14.362 -7.474 -2.484 1.00 26.32 ? 95 ASP B N 1 ATOM 1771 C CA . ASP B 2 94 ? 13.262 -7.084 -3.348 1.00 29.56 ? 95 ASP B CA 1 ATOM 1772 C C . ASP B 2 94 ? 13.309 -5.670 -3.717 1.00 27.22 ? 95 ASP B C 1 ATOM 1773 O O . ASP B 2 94 ? 13.078 -5.350 -4.870 1.00 27.03 ? 95 ASP B O 1 ATOM 1774 C CB . ASP B 2 94 ? 11.880 -7.300 -2.677 1.00 34.58 ? 95 ASP B CB 1 ATOM 1775 C CG . ASP B 2 94 ? 11.573 -8.783 -2.411 1.00 42.79 ? 95 ASP B CG 1 ATOM 1776 O OD1 . ASP B 2 94 ? 12.196 -9.607 -3.100 1.00 40.18 ? 95 ASP B OD1 1 ATOM 1777 O OD2 . ASP B 2 94 ? 10.684 -9.106 -1.549 1.00 48.74 ? 95 ASP B OD2 1 ATOM 1778 N N . LYS B 2 95 ? 13.574 -4.818 -2.760 1.00 28.64 ? 96 LYS B N 1 ATOM 1779 C CA . LYS B 2 95 ? 13.648 -3.415 -3.052 1.00 29.61 ? 96 LYS B CA 1 ATOM 1780 C C . LYS B 2 95 ? 15.022 -2.973 -3.533 1.00 27.75 ? 96 LYS B C 1 ATOM 1781 O O . LYS B 2 95 ? 15.116 -2.209 -4.505 1.00 30.11 ? 96 LYS B O 1 ATOM 1782 C CB . LYS B 2 95 ? 13.118 -2.579 -1.874 1.00 38.24 ? 96 LYS B CB 1 ATOM 1783 C CG . LYS B 2 95 ? 11.578 -2.767 -1.774 1.00 49.79 ? 96 LYS B CG 1 ATOM 1784 C CD . LYS B 2 95 ? 10.872 -2.197 -0.532 1.00 58.46 ? 96 LYS B CD 1 ATOM 1785 C CE . LYS B 2 95 ? 11.277 -2.846 0.811 1.00 61.69 ? 96 LYS B CE 1 ATOM 1786 N NZ . LYS B 2 95 ? 10.592 -4.123 1.211 1.00 61.09 ? 96 LYS B NZ 1 ATOM 1787 N N . LEU B 2 96 ? 16.087 -3.437 -2.893 1.00 24.51 ? 97 LEU B N 1 ATOM 1788 C CA . LEU B 2 96 ? 17.389 -2.841 -3.143 1.00 24.03 ? 97 LEU B CA 1 ATOM 1789 C C . LEU B 2 96 ? 18.192 -3.593 -4.204 1.00 22.38 ? 97 LEU B C 1 ATOM 1790 O O . LEU B 2 96 ? 19.115 -3.036 -4.736 1.00 20.13 ? 97 LEU B O 1 ATOM 1791 C CB . LEU B 2 96 ? 18.180 -2.735 -1.849 1.00 21.52 ? 97 LEU B CB 1 ATOM 1792 C CG . LEU B 2 96 ? 17.579 -1.910 -0.705 1.00 23.11 ? 97 LEU B CG 1 ATOM 1793 C CD1 . LEU B 2 96 ? 18.457 -1.935 0.552 1.00 23.03 ? 97 LEU B CD1 1 ATOM 1794 C CD2 . LEU B 2 96 ? 17.217 -0.492 -1.134 1.00 23.26 ? 97 LEU B CD2 1 ATOM 1795 N N . HIS B 2 97 ? 17.863 -4.852 -4.447 1.00 19.70 ? 98 HIS B N 1 ATOM 1796 C CA . HIS B 2 97 ? 18.625 -5.702 -5.385 1.00 19.57 ? 98 HIS B CA 1 ATOM 1797 C C . HIS B 2 97 ? 20.112 -5.914 -5.042 1.00 18.27 ? 98 HIS B C 1 ATOM 1798 O O . HIS B 2 97 ? 20.961 -6.037 -5.929 1.00 17.63 ? 98 HIS B O 1 ATOM 1799 C CB . HIS B 2 97 ? 18.577 -5.149 -6.814 1.00 19.83 ? 98 HIS B CB 1 ATOM 1800 C CG . HIS B 2 97 ? 17.211 -5.012 -7.381 1.00 20.36 ? 98 HIS B CG 1 ATOM 1801 N ND1 . HIS B 2 97 ? 16.077 -5.491 -6.756 1.00 23.78 ? 98 HIS B ND1 1 ATOM 1802 C CD2 . HIS B 2 97 ? 16.800 -4.526 -8.572 1.00 20.45 ? 98 HIS B CD2 1 ATOM 1803 C CE1 . HIS B 2 97 ? 15.021 -5.265 -7.520 1.00 21.57 ? 98 HIS B CE1 1 ATOM 1804 N NE2 . HIS B 2 97 ? 15.436 -4.703 -8.638 1.00 22.10 ? 98 HIS B NE2 1 ATOM 1805 N N . VAL B 2 98 ? 20.435 -5.972 -3.758 1.00 19.48 ? 99 VAL B N 1 ATOM 1806 C CA . VAL B 2 98 ? 21.803 -6.169 -3.296 1.00 19.11 ? 99 VAL B CA 1 ATOM 1807 C C . VAL B 2 98 ? 22.235 -7.649 -3.389 1.00 18.94 ? 99 VAL B C 1 ATOM 1808 O O . VAL B 2 98 ? 21.576 -8.559 -2.885 1.00 20.69 ? 99 VAL B O 1 ATOM 1809 C CB . VAL B 2 98 ? 21.968 -5.607 -1.853 1.00 20.03 ? 99 VAL B CB 1 ATOM 1810 C CG1 . VAL B 2 98 ? 23.305 -5.951 -1.274 1.00 19.73 ? 99 VAL B CG1 1 ATOM 1811 C CG2 . VAL B 2 98 ? 21.848 -4.121 -1.844 1.00 21.66 ? 99 VAL B CG2 1 ATOM 1812 N N . ASP B 2 99 ? 23.337 -7.900 -4.058 1.00 18.97 ? 100 ASP B N 1 ATOM 1813 C CA . ASP B 2 99 ? 23.817 -9.242 -4.230 1.00 20.12 ? 100 ASP B CA 1 ATOM 1814 C C . ASP B 2 99 ? 24.222 -9.759 -2.858 1.00 18.09 ? 100 ASP B C 1 ATOM 1815 O O . ASP B 2 99 ? 24.985 -9.097 -2.163 1.00 19.06 ? 100 ASP B O 1 ATOM 1816 C CB . ASP B 2 99 ? 25.031 -9.373 -5.170 1.00 22.54 ? 100 ASP B CB 1 ATOM 1817 C CG . ASP B 2 99 ? 25.328 -10.836 -5.462 1.00 24.07 ? 100 ASP B CG 1 ATOM 1818 O OD1 . ASP B 2 99 ? 25.822 -11.504 -4.527 1.00 22.92 ? 100 ASP B OD1 1 ATOM 1819 O OD2 . ASP B 2 99 ? 24.963 -11.354 -6.586 1.00 29.51 ? 100 ASP B OD2 1 ATOM 1820 N N . PRO B 2 100 ? 23.706 -10.906 -2.467 1.00 17.74 ? 101 PRO B N 1 ATOM 1821 C CA . PRO B 2 100 ? 24.006 -11.370 -1.145 1.00 20.81 ? 101 PRO B CA 1 ATOM 1822 C C . PRO B 2 100 ? 25.469 -11.697 -0.812 1.00 20.68 ? 101 PRO B C 1 ATOM 1823 O O . PRO B 2 100 ? 25.764 -11.831 0.341 1.00 18.48 ? 101 PRO B O 1 ATOM 1824 C CB . PRO B 2 100 ? 23.164 -12.625 -0.992 1.00 21.58 ? 101 PRO B CB 1 ATOM 1825 C CG . PRO B 2 100 ? 22.565 -12.963 -2.291 1.00 21.97 ? 101 PRO B CG 1 ATOM 1826 C CD . PRO B 2 100 ? 22.776 -11.789 -3.197 1.00 22.41 ? 101 PRO B CD 1 ATOM 1827 N N . GLU B 2 101 ? 26.352 -11.824 -1.800 1.00 20.76 ? 102 GLU B N 1 ATOM 1828 C CA . GLU B 2 101 ? 27.795 -11.979 -1.546 1.00 23.21 ? 102 GLU B CA 1 ATOM 1829 C C . GLU B 2 101 ? 28.361 -10.828 -0.688 1.00 21.08 ? 102 GLU B C 1 ATOM 1830 O O . GLU B 2 101 ? 29.348 -11.010 0.041 1.00 22.53 ? 102 GLU B O 1 ATOM 1831 C CB . GLU B 2 101 ? 28.566 -12.040 -2.873 1.00 24.70 ? 102 GLU B CB 1 ATOM 1832 C CG . GLU B 2 101 ? 28.831 -10.689 -3.502 1.00 26.16 ? 102 GLU B CG 1 ATOM 1833 C CD . GLU B 2 101 ? 29.504 -10.704 -4.859 1.00 29.79 ? 102 GLU B CD 1 ATOM 1834 O OE1 . GLU B 2 101 ? 29.827 -11.736 -5.439 1.00 30.93 ? 102 GLU B OE1 1 ATOM 1835 O OE2 . GLU B 2 101 ? 29.770 -9.605 -5.350 1.00 36.11 ? 102 GLU B OE2 1 ATOM 1836 N N . ASN B 2 102 ? 27.809 -9.629 -0.877 1.00 18.91 ? 103 ASN B N 1 ATOM 1837 C CA . ASN B 2 102 ? 28.262 -8.409 -0.168 1.00 18.42 ? 103 ASN B CA 1 ATOM 1838 C C . ASN B 2 102 ? 27.961 -8.403 1.345 1.00 19.96 ? 103 ASN B C 1 ATOM 1839 O O . ASN B 2 102 ? 28.591 -7.636 2.105 1.00 16.88 ? 103 ASN B O 1 ATOM 1840 C CB . ASN B 2 102 ? 27.590 -7.167 -0.800 1.00 17.69 ? 103 ASN B CB 1 ATOM 1841 C CG . ASN B 2 102 ? 28.023 -6.944 -2.245 1.00 18.30 ? 103 ASN B CG 1 ATOM 1842 O OD1 . ASN B 2 102 ? 29.181 -6.903 -2.510 1.00 21.27 ? 103 ASN B OD1 1 ATOM 1843 N ND2 . ASN B 2 102 ? 27.110 -6.906 -3.156 1.00 19.61 ? 103 ASN B ND2 1 ATOM 1844 N N . PHE B 2 103 ? 27.038 -9.282 1.799 1.00 20.65 ? 104 PHE B N 1 ATOM 1845 C CA . PHE B 2 103 ? 26.755 -9.324 3.224 1.00 21.73 ? 104 PHE B CA 1 ATOM 1846 C C . PHE B 2 103 ? 28.009 -9.918 3.943 1.00 20.82 ? 104 PHE B C 1 ATOM 1847 O O . PHE B 2 103 ? 28.410 -9.462 5.017 1.00 20.50 ? 104 PHE B O 1 ATOM 1848 C CB . PHE B 2 103 ? 25.501 -10.112 3.591 1.00 23.39 ? 104 PHE B CB 1 ATOM 1849 C CG . PHE B 2 103 ? 24.204 -9.692 2.878 1.00 24.23 ? 104 PHE B CG 1 ATOM 1850 C CD1 . PHE B 2 103 ? 23.776 -8.365 2.835 1.00 22.74 ? 104 PHE B CD1 1 ATOM 1851 C CD2 . PHE B 2 103 ? 23.349 -10.686 2.364 1.00 21.59 ? 104 PHE B CD2 1 ATOM 1852 C CE1 . PHE B 2 103 ? 22.575 -8.036 2.205 1.00 22.53 ? 104 PHE B CE1 1 ATOM 1853 C CE2 . PHE B 2 103 ? 22.146 -10.364 1.758 1.00 23.90 ? 104 PHE B CE2 1 ATOM 1854 C CZ . PHE B 2 103 ? 21.753 -9.022 1.672 1.00 22.44 ? 104 PHE B CZ 1 ATOM 1855 N N . ARG B 2 104 ? 28.623 -10.900 3.305 1.00 20.40 ? 105 ARG B N 1 ATOM 1856 C CA . ARG B 2 104 ? 29.751 -11.569 3.833 1.00 21.93 ? 105 ARG B CA 1 ATOM 1857 C C . ARG B 2 104 ? 30.934 -10.606 3.756 1.00 20.66 ? 105 ARG B C 1 ATOM 1858 O O . ARG B 2 104 ? 31.751 -10.572 4.653 1.00 19.99 ? 105 ARG B O 1 ATOM 1859 C CB . ARG B 2 104 ? 29.999 -12.871 3.029 1.00 28.08 ? 105 ARG B CB 1 ATOM 1860 C CG . ARG B 2 104 ? 30.470 -14.067 3.835 1.00 34.07 ? 105 ARG B CG 1 ATOM 1861 C CD . ARG B 2 104 ? 30.470 -15.417 3.085 1.00 40.88 ? 105 ARG B CD 1 ATOM 1862 N NE . ARG B 2 104 ? 29.262 -16.185 3.446 1.00 46.31 ? 105 ARG B NE 1 ATOM 1863 C CZ . ARG B 2 104 ? 29.099 -16.933 4.554 1.00 49.04 ? 105 ARG B CZ 1 ATOM 1864 N NH1 . ARG B 2 104 ? 30.060 -17.097 5.444 1.00 45.92 ? 105 ARG B NH1 1 ATOM 1865 N NH2 . ARG B 2 104 ? 27.953 -17.564 4.758 1.00 50.56 ? 105 ARG B NH2 1 ATOM 1866 N N . LEU B 2 105 ? 30.978 -9.758 2.718 1.00 19.22 ? 106 LEU B N 1 ATOM 1867 C CA . LEU B 2 105 ? 32.103 -8.834 2.529 1.00 19.01 ? 106 LEU B CA 1 ATOM 1868 C C . LEU B 2 105 ? 32.076 -7.777 3.631 1.00 17.98 ? 106 LEU B C 1 ATOM 1869 O O . LEU B 2 105 ? 33.093 -7.479 4.229 1.00 18.49 ? 106 LEU B O 1 ATOM 1870 C CB . LEU B 2 105 ? 32.013 -8.181 1.137 1.00 18.40 ? 106 LEU B CB 1 ATOM 1871 C CG . LEU B 2 105 ? 32.473 -9.064 -0.015 1.00 18.60 ? 106 LEU B CG 1 ATOM 1872 C CD1 . LEU B 2 105 ? 32.458 -8.185 -1.243 1.00 20.38 ? 106 LEU B CD1 1 ATOM 1873 C CD2 . LEU B 2 105 ? 33.878 -9.640 0.150 1.00 17.83 ? 106 LEU B CD2 1 ATOM 1874 N N . LEU B 2 106 ? 30.882 -7.276 3.931 1.00 15.95 ? 107 LEU B N 1 ATOM 1875 C CA . LEU B 2 106 ? 30.690 -6.257 4.999 1.00 18.56 ? 107 LEU B CA 1 ATOM 1876 C C . LEU B 2 106 ? 30.999 -6.811 6.382 1.00 17.56 ? 107 LEU B C 1 ATOM 1877 O O . LEU B 2 106 ? 31.703 -6.170 7.194 1.00 17.01 ? 107 LEU B O 1 ATOM 1878 C CB . LEU B 2 106 ? 29.303 -5.639 4.938 1.00 19.73 ? 107 LEU B CB 1 ATOM 1879 C CG . LEU B 2 106 ? 29.030 -4.570 5.995 1.00 24.10 ? 107 LEU B CG 1 ATOM 1880 C CD1 . LEU B 2 106 ? 30.049 -3.437 5.948 1.00 25.82 ? 107 LEU B CD1 1 ATOM 1881 C CD2 . LEU B 2 106 ? 27.640 -3.999 5.798 1.00 25.81 ? 107 LEU B CD2 1 ATOM 1882 N N . GLY B 2 107 ? 30.540 -8.034 6.585 1.00 17.68 ? 108 GLY B N 1 ATOM 1883 C CA . GLY B 2 107 ? 30.872 -8.795 7.752 1.00 20.46 ? 108 GLY B CA 1 ATOM 1884 C C . GLY B 2 107 ? 32.361 -8.884 7.996 1.00 20.05 ? 108 GLY B C 1 ATOM 1885 O O . GLY B 2 107 ? 32.846 -8.606 9.097 1.00 21.27 ? 108 GLY B O 1 ATOM 1886 N N . ASN B 2 108 ? 33.067 -9.209 6.939 1.00 19.09 ? 109 ASN B N 1 ATOM 1887 C CA . ASN B 2 108 ? 34.463 -9.378 7.006 1.00 21.63 ? 109 ASN B CA 1 ATOM 1888 C C . ASN B 2 108 ? 35.237 -8.109 7.177 1.00 20.42 ? 109 ASN B C 1 ATOM 1889 O O . ASN B 2 108 ? 36.270 -8.082 7.892 1.00 22.27 ? 109 ASN B O 1 ATOM 1890 C CB . ASN B 2 108 ? 34.923 -10.247 5.819 1.00 23.81 ? 109 ASN B CB 1 ATOM 1891 C CG . ASN B 2 108 ? 34.582 -11.704 6.056 1.00 26.59 ? 109 ASN B CG 1 ATOM 1892 O OD1 . ASN B 2 108 ? 34.495 -12.187 7.217 1.00 26.57 ? 109 ASN B OD1 1 ATOM 1893 N ND2 . ASN B 2 108 ? 34.412 -12.409 5.006 1.00 30.03 ? 109 ASN B ND2 1 ATOM 1894 N N . VAL B 2 109 ? 34.757 -7.067 6.530 1.00 18.81 ? 110 VAL B N 1 ATOM 1895 C CA . VAL B 2 109 ? 35.286 -5.766 6.755 1.00 19.36 ? 110 VAL B CA 1 ATOM 1896 C C . VAL B 2 109 ? 35.059 -5.356 8.218 1.00 17.90 ? 110 VAL B C 1 ATOM 1897 O O . VAL B 2 109 ? 35.904 -4.697 8.806 1.00 17.72 ? 110 VAL B O 1 ATOM 1898 C CB . VAL B 2 109 ? 34.676 -4.728 5.791 1.00 19.30 ? 110 VAL B CB 1 ATOM 1899 C CG1 . VAL B 2 109 ? 35.143 -3.338 6.174 1.00 20.28 ? 110 VAL B CG1 1 ATOM 1900 C CG2 . VAL B 2 109 ? 35.124 -5.040 4.369 1.00 20.82 ? 110 VAL B CG2 1 ATOM 1901 N N . LEU B 2 110 ? 33.903 -5.690 8.769 1.00 17.78 ? 111 LEU B N 1 ATOM 1902 C CA . LEU B 2 110 ? 33.649 -5.426 10.209 1.00 18.64 ? 111 LEU B CA 1 ATOM 1903 C C . LEU B 2 110 ? 34.649 -6.093 11.134 1.00 17.90 ? 111 LEU B C 1 ATOM 1904 O O . LEU B 2 110 ? 35.241 -5.427 12.048 1.00 18.94 ? 111 LEU B O 1 ATOM 1905 C CB . LEU B 2 110 ? 32.227 -5.778 10.630 1.00 20.36 ? 111 LEU B CB 1 ATOM 1906 C CG . LEU B 2 110 ? 31.891 -5.569 12.155 1.00 20.77 ? 111 LEU B CG 1 ATOM 1907 C CD1 . LEU B 2 110 ? 31.915 -4.117 12.635 1.00 21.23 ? 111 LEU B CD1 1 ATOM 1908 C CD2 . LEU B 2 110 ? 30.524 -6.175 12.355 1.00 22.15 ? 111 LEU B CD2 1 ATOM 1909 N N . VAL B 2 111 ? 34.929 -7.373 10.856 1.00 17.20 ? 112 VAL B N 1 ATOM 1910 C CA . VAL B 2 111 ? 35.949 -8.124 11.583 1.00 15.14 ? 112 VAL B CA 1 ATOM 1911 C C . VAL B 2 111 ? 37.304 -7.404 11.496 1.00 16.60 ? 112 VAL B C 1 ATOM 1912 O O . VAL B 2 111 ? 38.026 -7.293 12.497 1.00 15.71 ? 112 VAL B O 1 ATOM 1913 C CB . VAL B 2 111 ? 36.035 -9.502 11.018 1.00 15.11 ? 112 VAL B CB 1 ATOM 1914 C CG1 . VAL B 2 111 ? 37.286 -10.209 11.475 1.00 16.02 ? 112 VAL B CG1 1 ATOM 1915 C CG2 . VAL B 2 111 ? 34.810 -10.298 11.445 1.00 15.37 ? 112 VAL B CG2 1 ATOM 1916 N N . CYS B 2 112 ? 37.636 -6.876 10.303 1.00 17.75 ? 113 CYS B N 1 ATOM 1917 C CA . CYS B 2 112 ? 38.887 -6.184 10.097 1.00 17.88 ? 113 CYS B CA 1 ATOM 1918 C C . CYS B 2 112 ? 38.949 -4.927 10.962 1.00 18.02 ? 113 CYS B C 1 ATOM 1919 O O . CYS B 2 112 ? 39.993 -4.567 11.504 1.00 15.29 ? 113 CYS B O 1 ATOM 1920 C CB . CYS B 2 112 ? 39.117 -5.819 8.606 1.00 19.31 ? 113 CYS B CB 1 ATOM 1921 S SG . CYS B 2 112 ? 39.578 -7.223 7.557 1.00 19.91 ? 113 CYS B SG 1 ATOM 1922 N N . VAL B 2 113 ? 37.820 -4.234 11.055 1.00 16.80 ? 114 VAL B N 1 ATOM 1923 C CA . VAL B 2 113 ? 37.733 -3.035 11.851 1.00 16.65 ? 114 VAL B CA 1 ATOM 1924 C C . VAL B 2 113 ? 37.874 -3.367 13.354 1.00 18.58 ? 114 VAL B C 1 ATOM 1925 O O . VAL B 2 113 ? 38.587 -2.684 14.116 1.00 19.42 ? 114 VAL B O 1 ATOM 1926 C CB . VAL B 2 113 ? 36.419 -2.347 11.556 1.00 17.17 ? 114 VAL B CB 1 ATOM 1927 C CG1 . VAL B 2 113 ? 36.121 -1.245 12.595 1.00 19.69 ? 114 VAL B CG1 1 ATOM 1928 C CG2 . VAL B 2 113 ? 36.471 -1.763 10.115 1.00 17.01 ? 114 VAL B CG2 1 ATOM 1929 N N . LEU B 2 114 ? 37.240 -4.439 13.794 1.00 18.46 ? 115 LEU B N 1 ATOM 1930 C CA . LEU B 2 114 ? 37.399 -4.859 15.173 1.00 18.09 ? 115 LEU B CA 1 ATOM 1931 C C . LEU B 2 114 ? 38.872 -5.172 15.461 1.00 19.90 ? 115 LEU B C 1 ATOM 1932 O O . LEU B 2 114 ? 39.443 -4.774 16.522 1.00 21.69 ? 115 LEU B O 1 ATOM 1933 C CB . LEU B 2 114 ? 36.499 -6.035 15.442 1.00 18.54 ? 115 LEU B CB 1 ATOM 1934 C CG . LEU B 2 114 ? 35.001 -5.793 15.388 1.00 18.96 ? 115 LEU B CG 1 ATOM 1935 C CD1 . LEU B 2 114 ? 34.267 -7.073 15.721 1.00 20.95 ? 115 LEU B CD1 1 ATOM 1936 C CD2 . LEU B 2 114 ? 34.611 -4.711 16.351 1.00 23.35 ? 115 LEU B CD2 1 ATOM 1937 N N . ALA B 2 115 ? 39.531 -5.846 14.511 1.00 18.35 ? 116 ALA B N 1 ATOM 1938 C CA . ALA B 2 115 ? 40.914 -6.195 14.717 1.00 17.19 ? 116 ALA B CA 1 ATOM 1939 C C . ALA B 2 115 ? 41.698 -4.871 14.800 1.00 19.01 ? 116 ALA B C 1 ATOM 1940 O O . ALA B 2 115 ? 42.604 -4.719 15.591 1.00 19.29 ? 116 ALA B O 1 ATOM 1941 C CB . ALA B 2 115 ? 41.427 -7.027 13.580 1.00 16.77 ? 116 ALA B CB 1 ATOM 1942 N N . HIS B 2 116 ? 41.338 -3.939 13.954 1.00 18.55 ? 117 HIS B N 1 ATOM 1943 C CA . HIS B 2 116 ? 42.050 -2.668 13.854 1.00 20.98 ? 117 HIS B CA 1 ATOM 1944 C C . HIS B 2 116 ? 42.006 -1.856 15.155 1.00 20.64 ? 117 HIS B C 1 ATOM 1945 O O . HIS B 2 116 ? 42.988 -1.320 15.552 1.00 20.18 ? 117 HIS B O 1 ATOM 1946 C CB . HIS B 2 116 ? 41.452 -1.872 12.696 1.00 21.50 ? 117 HIS B CB 1 ATOM 1947 C CG . HIS B 2 116 ? 42.178 -0.614 12.355 1.00 24.81 ? 117 HIS B CG 1 ATOM 1948 N ND1 . HIS B 2 116 ? 43.501 -0.580 11.989 1.00 29.23 ? 117 HIS B ND1 1 ATOM 1949 C CD2 . HIS B 2 116 ? 41.733 0.650 12.249 1.00 27.19 ? 117 HIS B CD2 1 ATOM 1950 C CE1 . HIS B 2 116 ? 43.852 0.666 11.713 1.00 27.64 ? 117 HIS B CE1 1 ATOM 1951 N NE2 . HIS B 2 116 ? 42.804 1.435 11.897 1.00 28.49 ? 117 HIS B NE2 1 ATOM 1952 N N . HIS B 2 117 ? 40.852 -1.835 15.785 1.00 22.77 ? 118 HIS B N 1 ATOM 1953 C CA . HIS B 2 117 ? 40.620 -1.177 17.047 1.00 27.69 ? 118 HIS B CA 1 ATOM 1954 C C . HIS B 2 117 ? 41.097 -1.950 18.266 1.00 26.13 ? 118 HIS B C 1 ATOM 1955 O O . HIS B 2 117 ? 41.471 -1.349 19.205 1.00 28.18 ? 118 HIS B O 1 ATOM 1956 C CB . HIS B 2 117 ? 39.112 -0.827 17.167 1.00 29.03 ? 118 HIS B CB 1 ATOM 1957 C CG . HIS B 2 117 ? 38.692 0.256 16.222 1.00 38.66 ? 118 HIS B CG 1 ATOM 1958 N ND1 . HIS B 2 117 ? 37.956 1.354 16.620 1.00 50.53 ? 118 HIS B ND1 1 ATOM 1959 C CD2 . HIS B 2 117 ? 38.972 0.451 14.909 1.00 40.59 ? 118 HIS B CD2 1 ATOM 1960 C CE1 . HIS B 2 117 ? 37.739 2.138 15.578 1.00 44.38 ? 118 HIS B CE1 1 ATOM 1961 N NE2 . HIS B 2 117 ? 38.366 1.625 14.536 1.00 43.65 ? 118 HIS B NE2 1 ATOM 1962 N N . PHE B 2 118 ? 41.083 -3.271 18.265 1.00 26.48 ? 119 PHE B N 1 ATOM 1963 C CA . PHE B 2 118 ? 41.366 -4.021 19.477 1.00 23.72 ? 119 PHE B CA 1 ATOM 1964 C C . PHE B 2 118 ? 42.705 -4.662 19.550 1.00 22.98 ? 119 PHE B C 1 ATOM 1965 O O . PHE B 2 118 ? 43.093 -5.101 20.609 1.00 19.32 ? 119 PHE B O 1 ATOM 1966 C CB . PHE B 2 118 ? 40.257 -5.066 19.708 1.00 26.33 ? 119 PHE B CB 1 ATOM 1967 C CG . PHE B 2 118 ? 38.934 -4.443 20.159 1.00 25.87 ? 119 PHE B CG 1 ATOM 1968 C CD1 . PHE B 2 118 ? 38.812 -3.936 21.439 1.00 28.00 ? 119 PHE B CD1 1 ATOM 1969 C CD2 . PHE B 2 118 ? 37.877 -4.320 19.307 1.00 27.55 ? 119 PHE B CD2 1 ATOM 1970 C CE1 . PHE B 2 118 ? 37.643 -3.326 21.869 1.00 30.22 ? 119 PHE B CE1 1 ATOM 1971 C CE2 . PHE B 2 118 ? 36.683 -3.758 19.728 1.00 27.09 ? 119 PHE B CE2 1 ATOM 1972 C CZ . PHE B 2 118 ? 36.560 -3.259 21.018 1.00 30.31 ? 119 PHE B CZ 1 ATOM 1973 N N . GLY B 2 119 ? 43.405 -4.733 18.438 1.00 26.04 ? 120 GLY B N 1 ATOM 1974 C CA . GLY B 2 119 ? 44.749 -5.262 18.388 1.00 23.98 ? 120 GLY B CA 1 ATOM 1975 C C . GLY B 2 119 ? 44.753 -6.677 18.920 1.00 25.15 ? 120 GLY B C 1 ATOM 1976 O O . GLY B 2 119 ? 43.886 -7.470 18.623 1.00 26.79 ? 120 GLY B O 1 ATOM 1977 N N . LYS B 2 120 ? 45.727 -6.934 19.760 1.00 28.44 ? 121 LYS B N 1 ATOM 1978 C CA . LYS B 2 120 ? 45.962 -8.214 20.420 1.00 30.52 ? 121 LYS B CA 1 ATOM 1979 C C . LYS B 2 120 ? 44.762 -8.817 21.186 1.00 28.36 ? 121 LYS B C 1 ATOM 1980 O O . LYS B 2 120 ? 44.624 -10.071 21.270 1.00 27.17 ? 121 LYS B O 1 ATOM 1981 C CB . LYS B 2 120 ? 47.070 -7.936 21.418 1.00 37.52 ? 121 LYS B CB 1 ATOM 1982 C CG . LYS B 2 120 ? 47.683 -9.154 22.033 1.00 44.68 ? 121 LYS B CG 1 ATOM 1983 C CD . LYS B 2 120 ? 48.722 -9.762 21.110 1.00 54.19 ? 121 LYS B CD 1 ATOM 1984 C CE . LYS B 2 120 ? 49.925 -10.277 21.896 1.00 53.84 ? 121 LYS B CE 1 ATOM 1985 N NZ . LYS B 2 120 ? 49.445 -11.149 22.998 1.00 53.38 ? 121 LYS B NZ 1 ATOM 1986 N N . GLU B 2 121 ? 43.881 -7.975 21.741 1.00 24.41 ? 122 GLU B N 1 ATOM 1987 C CA . GLU B 2 121 ? 42.655 -8.524 22.354 1.00 26.36 ? 122 GLU B CA 1 ATOM 1988 C C . GLU B 2 121 ? 41.816 -9.217 21.312 1.00 25.92 ? 122 GLU B C 1 ATOM 1989 O O . GLU B 2 121 ? 40.916 -10.007 21.659 1.00 23.56 ? 122 GLU B O 1 ATOM 1990 C CB . GLU B 2 121 ? 41.733 -7.473 22.921 1.00 27.02 ? 122 GLU B CB 1 ATOM 1991 C CG . GLU B 2 121 ? 42.424 -6.484 23.781 1.00 32.65 ? 122 GLU B CG 1 ATOM 1992 C CD . GLU B 2 121 ? 41.450 -5.686 24.613 1.00 38.89 ? 122 GLU B CD 1 ATOM 1993 O OE1 . GLU B 2 121 ? 40.223 -6.047 24.744 1.00 43.30 ? 122 GLU B OE1 1 ATOM 1994 O OE2 . GLU B 2 121 ? 41.955 -4.694 25.155 1.00 44.58 ? 122 GLU B OE2 1 ATOM 1995 N N . PHE B 2 122 ? 41.980 -8.826 20.040 1.00 23.92 ? 123 PHE B N 1 ATOM 1996 C CA . PHE B 2 122 ? 41.209 -9.505 19.013 1.00 23.28 ? 123 PHE B CA 1 ATOM 1997 C C . PHE B 2 122 ? 41.939 -10.814 18.699 1.00 24.71 ? 123 PHE B C 1 ATOM 1998 O O . PHE B 2 122 ? 42.437 -10.999 17.574 1.00 26.40 ? 123 PHE B O 1 ATOM 1999 C CB . PHE B 2 122 ? 40.955 -8.624 17.756 1.00 22.38 ? 123 PHE B CB 1 ATOM 2000 C CG . PHE B 2 122 ? 39.814 -9.120 16.894 1.00 22.20 ? 123 PHE B CG 1 ATOM 2001 C CD1 . PHE B 2 122 ? 38.513 -9.020 17.328 1.00 22.04 ? 123 PHE B CD1 1 ATOM 2002 C CD2 . PHE B 2 122 ? 40.054 -9.722 15.670 1.00 22.80 ? 123 PHE B CD2 1 ATOM 2003 C CE1 . PHE B 2 122 ? 37.453 -9.461 16.552 1.00 23.64 ? 123 PHE B CE1 1 ATOM 2004 C CE2 . PHE B 2 122 ? 39.009 -10.203 14.900 1.00 23.44 ? 123 PHE B CE2 1 ATOM 2005 C CZ . PHE B 2 122 ? 37.719 -10.103 15.347 1.00 23.33 ? 123 PHE B CZ 1 ATOM 2006 N N . THR B 2 123 ? 41.977 -11.734 19.677 1.00 21.33 ? 124 THR B N 1 ATOM 2007 C CA . THR B 2 123 ? 42.805 -12.935 19.552 1.00 21.33 ? 124 THR B CA 1 ATOM 2008 C C . THR B 2 123 ? 42.191 -13.882 18.463 1.00 21.80 ? 124 THR B C 1 ATOM 2009 O O . THR B 2 123 ? 41.038 -13.705 18.046 1.00 21.91 ? 124 THR B O 1 ATOM 2010 C CB . THR B 2 123 ? 42.874 -13.687 20.899 1.00 21.01 ? 124 THR B CB 1 ATOM 2011 O OG1 . THR B 2 123 ? 41.568 -14.092 21.252 1.00 21.42 ? 124 THR B OG1 1 ATOM 2012 C CG2 . THR B 2 123 ? 43.362 -12.783 22.045 1.00 23.62 ? 124 THR B CG2 1 ATOM 2013 N N . PRO B 2 124 ? 42.932 -14.892 18.049 1.00 20.92 ? 125 PRO B N 1 ATOM 2014 C CA . PRO B 2 124 ? 42.380 -15.829 17.104 1.00 20.60 ? 125 PRO B CA 1 ATOM 2015 C C . PRO B 2 124 ? 41.045 -16.468 17.585 1.00 20.71 ? 125 PRO B C 1 ATOM 2016 O O . PRO B 2 124 ? 40.129 -16.639 16.808 1.00 19.46 ? 125 PRO B O 1 ATOM 2017 C CB . PRO B 2 124 ? 43.510 -16.857 16.937 1.00 19.94 ? 125 PRO B CB 1 ATOM 2018 C CG . PRO B 2 124 ? 44.786 -16.095 17.264 1.00 22.01 ? 125 PRO B CG 1 ATOM 2019 C CD . PRO B 2 124 ? 44.362 -15.139 18.336 1.00 23.43 ? 125 PRO B CD 1 ATOM 2020 N N . PRO B 2 125 ? 40.936 -16.817 18.886 1.00 22.44 ? 126 PRO B N 1 ATOM 2021 C CA . PRO B 2 125 ? 39.680 -17.450 19.293 1.00 20.82 ? 126 PRO B CA 1 ATOM 2022 C C . PRO B 2 125 ? 38.562 -16.469 19.316 1.00 21.33 ? 126 PRO B C 1 ATOM 2023 O O . PRO B 2 125 ? 37.421 -16.828 19.049 1.00 23.08 ? 126 PRO B O 1 ATOM 2024 C CB . PRO B 2 125 ? 40.000 -17.985 20.707 1.00 20.83 ? 126 PRO B CB 1 ATOM 2025 C CG . PRO B 2 125 ? 41.495 -18.222 20.649 1.00 22.95 ? 126 PRO B CG 1 ATOM 2026 C CD . PRO B 2 125 ? 41.992 -17.016 19.895 1.00 22.78 ? 126 PRO B CD 1 ATOM 2027 N N . VAL B 2 126 ? 38.825 -15.205 19.620 1.00 22.64 ? 127 VAL B N 1 ATOM 2028 C CA . VAL B 2 126 ? 37.683 -14.311 19.563 1.00 22.99 ? 127 VAL B CA 1 ATOM 2029 C C . VAL B 2 126 ? 37.315 -14.059 18.093 1.00 20.75 ? 127 VAL B C 1 ATOM 2030 O O . VAL B 2 126 ? 36.166 -13.891 17.773 1.00 19.74 ? 127 VAL B O 1 ATOM 2031 C CB . VAL B 2 126 ? 37.765 -13.034 20.471 1.00 23.89 ? 127 VAL B CB 1 ATOM 2032 C CG1 . VAL B 2 126 ? 38.695 -13.193 21.679 1.00 24.80 ? 127 VAL B CG1 1 ATOM 2033 C CG2 . VAL B 2 126 ? 37.966 -11.792 19.717 1.00 26.62 ? 127 VAL B CG2 1 ATOM 2034 N N . GLN B 2 127 ? 38.312 -14.047 17.201 1.00 21.82 ? 128 GLN B N 1 ATOM 2035 C CA . GLN B 2 127 ? 37.986 -13.890 15.790 1.00 20.98 ? 128 GLN B CA 1 ATOM 2036 C C . GLN B 2 127 ? 37.046 -14.965 15.349 1.00 22.42 ? 128 GLN B C 1 ATOM 2037 O O . GLN B 2 127 ? 36.012 -14.703 14.665 1.00 22.94 ? 128 GLN B O 1 ATOM 2038 C CB . GLN B 2 127 ? 39.221 -13.936 14.926 1.00 22.70 ? 128 GLN B CB 1 ATOM 2039 C CG . GLN B 2 127 ? 38.848 -13.824 13.441 1.00 22.53 ? 128 GLN B CG 1 ATOM 2040 C CD . GLN B 2 127 ? 40.042 -13.848 12.514 1.00 22.88 ? 128 GLN B CD 1 ATOM 2041 O OE1 . GLN B 2 127 ? 41.198 -13.732 12.942 1.00 19.13 ? 128 GLN B OE1 1 ATOM 2042 N NE2 . GLN B 2 127 ? 39.764 -13.974 11.231 1.00 22.23 ? 128 GLN B NE2 1 ATOM 2043 N N . ALA B 2 128 ? 37.423 -16.182 15.712 1.00 21.71 ? 129 ALA B N 1 ATOM 2044 C CA . ALA B 2 128 ? 36.664 -17.356 15.333 1.00 24.23 ? 129 ALA B CA 1 ATOM 2045 C C . ALA B 2 128 ? 35.236 -17.270 15.770 1.00 23.61 ? 129 ALA B C 1 ATOM 2046 O O . ALA B 2 128 ? 34.331 -17.686 15.042 1.00 27.57 ? 129 ALA B O 1 ATOM 2047 C CB . ALA B 2 128 ? 37.323 -18.638 15.858 1.00 22.63 ? 129 ALA B CB 1 ATOM 2048 N N . ALA B 2 129 ? 34.990 -16.696 16.923 1.00 22.26 ? 130 ALA B N 1 ATOM 2049 C CA . ALA B 2 129 ? 33.625 -16.625 17.371 1.00 22.21 ? 130 ALA B CA 1 ATOM 2050 C C . ALA B 2 129 ? 32.848 -15.560 16.553 1.00 21.40 ? 130 ALA B C 1 ATOM 2051 O O . ALA B 2 129 ? 31.673 -15.754 16.194 1.00 21.28 ? 130 ALA B O 1 ATOM 2052 C CB . ALA B 2 129 ? 33.591 -16.289 18.829 1.00 24.65 ? 130 ALA B CB 1 ATOM 2053 N N . TYR B 2 130 ? 33.510 -14.447 16.292 1.00 20.64 ? 131 TYR B N 1 ATOM 2054 C CA . TYR B 2 130 ? 32.929 -13.377 15.453 1.00 21.28 ? 131 TYR B CA 1 ATOM 2055 C C . TYR B 2 130 ? 32.710 -13.865 14.032 1.00 21.51 ? 131 TYR B C 1 ATOM 2056 O O . TYR B 2 130 ? 31.707 -13.457 13.414 1.00 19.92 ? 131 TYR B O 1 ATOM 2057 C CB . TYR B 2 130 ? 33.773 -12.094 15.458 1.00 20.74 ? 131 TYR B CB 1 ATOM 2058 C CG . TYR B 2 130 ? 33.424 -11.200 16.572 1.00 22.78 ? 131 TYR B CG 1 ATOM 2059 C CD1 . TYR B 2 130 ? 32.316 -10.370 16.470 1.00 23.38 ? 131 TYR B CD1 1 ATOM 2060 C CD2 . TYR B 2 130 ? 34.139 -11.206 17.791 1.00 24.93 ? 131 TYR B CD2 1 ATOM 2061 C CE1 . TYR B 2 130 ? 31.947 -9.525 17.483 1.00 26.10 ? 131 TYR B CE1 1 ATOM 2062 C CE2 . TYR B 2 130 ? 33.738 -10.352 18.832 1.00 27.23 ? 131 TYR B CE2 1 ATOM 2063 C CZ . TYR B 2 130 ? 32.610 -9.548 18.675 1.00 25.15 ? 131 TYR B CZ 1 ATOM 2064 O OH . TYR B 2 130 ? 32.144 -8.666 19.629 1.00 29.55 ? 131 TYR B OH 1 ATOM 2065 N N . GLN B 2 131 ? 33.598 -14.746 13.520 1.00 20.46 ? 132 GLN B N 1 ATOM 2066 C CA . GLN B 2 131 ? 33.339 -15.282 12.200 1.00 21.74 ? 132 GLN B CA 1 ATOM 2067 C C . GLN B 2 131 ? 31.992 -16.058 12.184 1.00 22.34 ? 132 GLN B C 1 ATOM 2068 O O . GLN B 2 131 ? 31.293 -16.083 11.153 1.00 20.62 ? 132 GLN B O 1 ATOM 2069 C CB . GLN B 2 131 ? 34.458 -16.143 11.657 1.00 20.88 ? 132 GLN B CB 1 ATOM 2070 C CG . GLN B 2 131 ? 35.829 -15.479 11.485 1.00 23.09 ? 132 GLN B CG 1 ATOM 2071 C CD . GLN B 2 131 ? 35.894 -14.406 10.388 1.00 24.41 ? 132 GLN B CD 1 ATOM 2072 O OE1 . GLN B 2 131 ? 36.824 -13.564 10.388 1.00 24.19 ? 132 GLN B OE1 1 ATOM 2073 N NE2 . GLN B 2 131 ? 34.902 -14.416 9.464 1.00 23.76 ? 132 GLN B NE2 1 ATOM 2074 N N . LYS B 2 132 ? 31.639 -16.735 13.288 1.00 23.88 ? 133 LYS B N 1 ATOM 2075 C CA . LYS B 2 132 ? 30.363 -17.474 13.322 1.00 24.42 ? 133 LYS B CA 1 ATOM 2076 C C . LYS B 2 132 ? 29.228 -16.465 13.227 1.00 22.87 ? 133 LYS B C 1 ATOM 2077 O O . LYS B 2 132 ? 28.233 -16.659 12.524 1.00 23.14 ? 133 LYS B O 1 ATOM 2078 C CB . LYS B 2 132 ? 30.236 -18.340 14.563 1.00 26.76 ? 133 LYS B CB 1 ATOM 2079 C CG . LYS B 2 132 ? 31.185 -19.531 14.594 1.00 29.06 ? 133 LYS B CG 1 ATOM 2080 C CD . LYS B 2 132 ? 30.862 -20.425 15.800 1.00 32.81 ? 133 LYS B CD 1 ATOM 2081 C CE . LYS B 2 132 ? 31.568 -21.751 15.704 1.00 37.63 ? 133 LYS B CE 1 ATOM 2082 N NZ . LYS B 2 132 ? 31.777 -22.293 17.063 1.00 42.41 ? 133 LYS B NZ 1 ATOM 2083 N N . VAL B 2 133 ? 29.430 -15.346 13.873 1.00 19.74 ? 134 VAL B N 1 ATOM 2084 C CA . VAL B 2 133 ? 28.391 -14.356 13.930 1.00 24.08 ? 134 VAL B CA 1 ATOM 2085 C C . VAL B 2 133 ? 28.237 -13.688 12.571 1.00 23.53 ? 134 VAL B C 1 ATOM 2086 O O . VAL B 2 133 ? 27.126 -13.458 12.109 1.00 23.14 ? 134 VAL B O 1 ATOM 2087 C CB . VAL B 2 133 ? 28.693 -13.250 14.973 1.00 24.26 ? 134 VAL B CB 1 ATOM 2088 C CG1 . VAL B 2 133 ? 27.710 -12.102 14.852 1.00 27.58 ? 134 VAL B CG1 1 ATOM 2089 C CG2 . VAL B 2 133 ? 28.724 -13.815 16.362 1.00 24.96 ? 134 VAL B CG2 1 ATOM 2090 N N . VAL B 2 134 ? 29.339 -13.385 11.908 1.00 26.29 ? 135 VAL B N 1 ATOM 2091 C CA . VAL B 2 134 ? 29.145 -12.694 10.620 1.00 28.99 ? 135 VAL B CA 1 ATOM 2092 C C . VAL B 2 134 ? 28.485 -13.612 9.617 1.00 26.91 ? 135 VAL B C 1 ATOM 2093 O O . VAL B 2 134 ? 27.647 -13.162 8.882 1.00 26.12 ? 135 VAL B O 1 ATOM 2094 C CB . VAL B 2 134 ? 30.395 -11.964 10.097 1.00 29.69 ? 135 VAL B CB 1 ATOM 2095 C CG1 . VAL B 2 134 ? 30.823 -10.920 11.132 1.00 32.82 ? 135 VAL B CG1 1 ATOM 2096 C CG2 . VAL B 2 134 ? 31.509 -12.915 9.817 1.00 33.04 ? 135 VAL B CG2 1 ATOM 2097 N N . ALA B 2 135 ? 28.849 -14.894 9.617 1.00 26.58 ? 136 ALA B N 1 ATOM 2098 C CA . ALA B 2 135 ? 28.280 -15.874 8.708 1.00 25.00 ? 136 ALA B CA 1 ATOM 2099 C C . ALA B 2 135 ? 26.766 -16.042 8.975 1.00 27.69 ? 136 ALA B C 1 ATOM 2100 O O . ALA B 2 135 ? 25.971 -16.077 8.046 1.00 25.19 ? 136 ALA B O 1 ATOM 2101 C CB . ALA B 2 135 ? 28.984 -17.199 8.866 1.00 22.96 ? 136 ALA B CB 1 ATOM 2102 N N . GLY B 2 136 ? 26.416 -16.113 10.263 1.00 24.31 ? 137 GLY B N 1 ATOM 2103 C CA . GLY B 2 136 ? 25.069 -16.282 10.687 1.00 25.54 ? 137 GLY B CA 1 ATOM 2104 C C . GLY B 2 136 ? 24.301 -15.060 10.266 1.00 27.27 ? 137 GLY B C 1 ATOM 2105 O O . GLY B 2 136 ? 23.212 -15.212 9.750 1.00 25.86 ? 137 GLY B O 1 ATOM 2106 N N . VAL B 2 137 ? 24.863 -13.854 10.440 1.00 24.06 ? 138 VAL B N 1 ATOM 2107 C CA . VAL B 2 137 ? 24.134 -12.675 10.020 1.00 25.86 ? 138 VAL B CA 1 ATOM 2108 C C . VAL B 2 137 ? 23.968 -12.608 8.475 1.00 28.72 ? 138 VAL B C 1 ATOM 2109 O O . VAL B 2 137 ? 22.857 -12.287 7.950 1.00 25.36 ? 138 VAL B O 1 ATOM 2110 C CB . VAL B 2 137 ? 24.716 -11.413 10.639 1.00 25.33 ? 138 VAL B CB 1 ATOM 2111 C CG1 . VAL B 2 137 ? 24.005 -10.195 10.124 1.00 27.29 ? 138 VAL B CG1 1 ATOM 2112 C CG2 . VAL B 2 137 ? 24.621 -11.456 12.150 1.00 26.87 ? 138 VAL B CG2 1 ATOM 2113 N N . ALA B 2 138 ? 25.022 -12.976 7.746 1.00 25.79 ? 139 ALA B N 1 ATOM 2114 C CA . ALA B 2 138 ? 24.934 -13.036 6.300 1.00 29.09 ? 139 ALA B CA 1 ATOM 2115 C C . ALA B 2 138 ? 23.873 -14.035 5.775 1.00 31.01 ? 139 ALA B C 1 ATOM 2116 O O . ALA B 2 138 ? 23.109 -13.722 4.820 1.00 25.21 ? 139 ALA B O 1 ATOM 2117 C CB . ALA B 2 138 ? 26.299 -13.353 5.682 1.00 27.43 ? 139 ALA B CB 1 ATOM 2118 N N . ASN B 2 139 ? 23.816 -15.228 6.390 1.00 30.22 ? 140 ASN B N 1 ATOM 2119 C CA . ASN B 2 139 ? 22.850 -16.246 5.912 1.00 29.48 ? 140 ASN B CA 1 ATOM 2120 C C . ASN B 2 139 ? 21.426 -15.791 6.089 1.00 28.70 ? 140 ASN B C 1 ATOM 2121 O O . ASN B 2 139 ? 20.538 -16.085 5.248 1.00 27.05 ? 140 ASN B O 1 ATOM 2122 C CB . ASN B 2 139 ? 22.986 -17.561 6.618 1.00 30.75 ? 140 ASN B CB 1 ATOM 2123 C CG . ASN B 2 139 ? 24.187 -18.343 6.195 1.00 36.08 ? 140 ASN B CG 1 ATOM 2124 O OD1 . ASN B 2 139 ? 24.591 -19.268 6.887 1.00 44.69 ? 140 ASN B OD1 1 ATOM 2125 N ND2 . ASN B 2 139 ? 24.760 -18.020 5.083 1.00 35.14 ? 140 ASN B ND2 1 ATOM 2126 N N . ALA B 2 140 ? 21.212 -15.073 7.177 1.00 27.25 ? 141 ALA B N 1 ATOM 2127 C CA . ALA B 2 140 ? 19.870 -14.656 7.562 1.00 29.19 ? 141 ALA B CA 1 ATOM 2128 C C . ALA B 2 140 ? 19.453 -13.491 6.667 1.00 29.10 ? 141 ALA B C 1 ATOM 2129 O O . ALA B 2 140 ? 18.320 -13.416 6.214 1.00 27.22 ? 141 ALA B O 1 ATOM 2130 C CB . ALA B 2 140 ? 19.839 -14.232 9.015 1.00 25.85 ? 141 ALA B CB 1 ATOM 2131 N N . LEU B 2 141 ? 20.383 -12.589 6.397 1.00 26.56 ? 142 LEU B N 1 ATOM 2132 C CA . LEU B 2 141 ? 20.121 -11.546 5.442 1.00 26.55 ? 142 LEU B CA 1 ATOM 2133 C C . LEU B 2 141 ? 19.848 -12.090 4.011 1.00 27.21 ? 142 LEU B C 1 ATOM 2134 O O . LEU B 2 141 ? 19.083 -11.481 3.295 1.00 27.04 ? 142 LEU B O 1 ATOM 2135 C CB . LEU B 2 141 ? 21.223 -10.504 5.454 1.00 31.07 ? 142 LEU B CB 1 ATOM 2136 C CG . LEU B 2 141 ? 21.038 -9.459 6.565 1.00 35.39 ? 142 LEU B CG 1 ATOM 2137 C CD1 . LEU B 2 141 ? 22.339 -8.721 6.738 1.00 32.35 ? 142 LEU B CD1 1 ATOM 2138 C CD2 . LEU B 2 141 ? 19.876 -8.474 6.319 1.00 37.47 ? 142 LEU B CD2 1 ATOM 2139 N N . ALA B 2 142 ? 20.409 -13.250 3.646 1.00 24.52 ? 143 ALA B N 1 ATOM 2140 C CA . ALA B 2 142 ? 20.215 -13.881 2.319 1.00 24.96 ? 143 ALA B CA 1 ATOM 2141 C C . ALA B 2 142 ? 18.988 -14.727 2.245 1.00 26.62 ? 143 ALA B C 1 ATOM 2142 O O . ALA B 2 142 ? 18.696 -15.292 1.186 1.00 25.71 ? 143 ALA B O 1 ATOM 2143 C CB . ALA B 2 142 ? 21.384 -14.808 2.007 1.00 24.34 ? 143 ALA B CB 1 ATOM 2144 N N . HIS B 2 143 ? 18.315 -14.902 3.381 1.00 31.06 ? 144 HIS B N 1 ATOM 2145 C CA . HIS B 2 143 ? 17.354 -16.016 3.503 1.00 32.76 ? 144 HIS B CA 1 ATOM 2146 C C . HIS B 2 143 ? 16.078 -15.809 2.686 1.00 30.75 ? 144 HIS B C 1 ATOM 2147 O O . HIS B 2 143 ? 15.532 -16.756 2.173 1.00 30.16 ? 144 HIS B O 1 ATOM 2148 C CB . HIS B 2 143 ? 16.987 -16.278 4.948 1.00 35.93 ? 144 HIS B CB 1 ATOM 2149 C CG . HIS B 2 143 ? 16.165 -17.510 5.118 1.00 44.61 ? 144 HIS B CG 1 ATOM 2150 N ND1 . HIS B 2 143 ? 14.846 -17.474 5.524 1.00 41.33 ? 144 HIS B ND1 1 ATOM 2151 C CD2 . HIS B 2 143 ? 16.452 -18.806 4.843 1.00 43.56 ? 144 HIS B CD2 1 ATOM 2152 C CE1 . HIS B 2 143 ? 14.366 -18.704 5.518 1.00 48.02 ? 144 HIS B CE1 1 ATOM 2153 N NE2 . HIS B 2 143 ? 15.326 -19.533 5.133 1.00 46.99 ? 144 HIS B NE2 1 ATOM 2154 N N . LYS B 2 144 ? 15.590 -14.579 2.590 1.00 31.49 ? 145 LYS B N 1 ATOM 2155 C CA . LYS B 2 144 ? 14.442 -14.308 1.745 1.00 31.44 ? 145 LYS B CA 1 ATOM 2156 C C . LYS B 2 144 ? 14.759 -14.135 0.284 1.00 29.93 ? 145 LYS B C 1 ATOM 2157 O O . LYS B 2 144 ? 13.889 -13.701 -0.405 1.00 26.89 ? 145 LYS B O 1 ATOM 2158 C CB . LYS B 2 144 ? 13.702 -13.034 2.182 1.00 32.30 ? 145 LYS B CB 1 ATOM 2159 C CG . LYS B 2 144 ? 13.207 -13.143 3.596 1.00 40.46 ? 145 LYS B CG 1 ATOM 2160 C CD . LYS B 2 144 ? 12.389 -14.421 3.772 1.00 41.64 ? 145 LYS B CD 1 ATOM 2161 C CE . LYS B 2 144 ? 11.215 -14.204 4.690 1.00 45.08 ? 145 LYS B CE 1 ATOM 2162 N NZ . LYS B 2 144 ? 10.360 -15.428 4.638 1.00 50.19 ? 145 LYS B NZ 1 ATOM 2163 N N . TYR B 2 145 ? 15.967 -14.449 -0.190 1.00 31.34 ? 146 TYR B N 1 ATOM 2164 C CA . TYR B 2 145 ? 16.299 -14.284 -1.608 1.00 30.57 ? 146 TYR B CA 1 ATOM 2165 C C . TYR B 2 145 ? 15.682 -15.381 -2.475 1.00 33.99 ? 146 TYR B C 1 ATOM 2166 O O . TYR B 2 145 ? 15.791 -16.539 -2.076 1.00 35.84 ? 146 TYR B O 1 ATOM 2167 C CB . TYR B 2 145 ? 17.828 -14.221 -1.783 1.00 26.34 ? 146 TYR B CB 1 ATOM 2168 C CG . TYR B 2 145 ? 18.371 -12.791 -1.545 1.00 24.78 ? 146 TYR B CG 1 ATOM 2169 C CD1 . TYR B 2 145 ? 18.353 -12.189 -0.269 1.00 23.21 ? 146 TYR B CD1 1 ATOM 2170 C CD2 . TYR B 2 145 ? 18.875 -12.028 -2.597 1.00 23.56 ? 146 TYR B CD2 1 ATOM 2171 C CE1 . TYR B 2 145 ? 18.810 -10.866 -0.063 1.00 19.59 ? 146 TYR B CE1 1 ATOM 2172 C CE2 . TYR B 2 145 ? 19.322 -10.726 -2.395 1.00 20.19 ? 146 TYR B CE2 1 ATOM 2173 C CZ . TYR B 2 145 ? 19.328 -10.175 -1.119 1.00 20.23 ? 146 TYR B CZ 1 ATOM 2174 O OH . TYR B 2 145 ? 19.814 -8.905 -0.932 1.00 21.99 ? 146 TYR B OH 1 ATOM 2175 N N . VAL C 3 1 ? 8.180 -20.179 -27.775 1.00 40.37 ? 148 VAL C N 1 ATOM 2176 C CA . VAL C 3 1 ? 9.003 -21.373 -27.868 1.00 39.94 ? 148 VAL C CA 1 ATOM 2177 C C . VAL C 3 1 ? 10.452 -20.966 -27.515 1.00 37.12 ? 148 VAL C C 1 ATOM 2178 O O . VAL C 3 1 ? 11.084 -21.729 -26.797 1.00 45.21 ? 148 VAL C O 1 ATOM 2179 C CB . VAL C 3 1 ? 8.790 -22.145 -29.216 1.00 39.53 ? 148 VAL C CB 1 ATOM 2180 C CG1 . VAL C 3 1 ? 10.024 -22.877 -29.661 1.00 39.70 ? 148 VAL C CG1 1 ATOM 2181 C CG2 . VAL C 3 1 ? 7.688 -23.184 -29.067 1.00 44.78 ? 148 VAL C CG2 1 ATOM 2182 N N . CYS C 3 2 ? 10.980 -19.808 -27.946 1.00 30.16 ? 149 CYS C N 1 ATOM 2183 C CA . CYS C 3 2 ? 12.383 -19.389 -27.530 1.00 27.10 ? 149 CYS C CA 1 ATOM 2184 C C . CYS C 3 2 ? 12.568 -17.925 -27.364 1.00 24.80 ? 149 CYS C C 1 ATOM 2185 O O . CYS C 3 2 ? 11.991 -17.138 -28.078 1.00 22.44 ? 149 CYS C O 1 ATOM 2186 C CB . CYS C 3 2 ? 13.493 -19.922 -28.423 1.00 26.12 ? 149 CYS C CB 1 ATOM 2187 S SG . CYS C 3 2 ? 13.751 -19.204 -30.092 1.00 28.53 ? 149 CYS C SG 1 ATOM 2188 N N . GLY C 3 3 ? 13.357 -17.545 -26.372 1.00 20.55 ? 150 GLY C N 1 ATOM 2189 C CA . GLY C 3 3 ? 13.799 -16.148 -26.291 1.00 22.27 ? 150 GLY C CA 1 ATOM 2190 C C . GLY C 3 3 ? 12.769 -15.141 -25.867 1.00 21.00 ? 150 GLY C C 1 ATOM 2191 O O . GLY C 3 3 ? 12.955 -13.926 -26.068 1.00 24.54 ? 150 GLY C O 1 ATOM 2192 N N . LYS C 3 4 ? 11.710 -15.602 -25.207 1.00 21.65 ? 151 LYS C N 1 ATOM 2193 C CA . LYS C 3 4 ? 10.660 -14.693 -24.724 1.00 20.52 ? 151 LYS C CA 1 ATOM 2194 C C . LYS C 3 4 ? 10.492 -14.858 -23.251 1.00 23.11 ? 151 LYS C C 1 ATOM 2195 O O . LYS C 3 4 ? 9.495 -15.435 -22.812 1.00 25.47 ? 151 LYS C O 1 ATOM 2196 C CB . LYS C 3 4 ? 9.333 -15.076 -25.410 1.00 25.32 ? 151 LYS C CB 1 ATOM 2197 C CG . LYS C 3 4 ? 9.404 -15.103 -26.922 1.00 25.20 ? 151 LYS C CG 1 ATOM 2198 C CD . LYS C 3 4 ? 9.482 -13.668 -27.404 1.00 26.92 ? 151 LYS C CD 1 ATOM 2199 C CE . LYS C 3 4 ? 9.008 -13.629 -28.862 1.00 27.27 ? 151 LYS C CE 1 ATOM 2200 N NZ . LYS C 3 4 ? 9.324 -12.268 -29.353 1.00 27.01 ? 151 LYS C NZ 1 ATOM 2201 N N . PRO C 3 5 ? 11.443 -14.373 -22.456 1.00 25.39 ? 152 PRO C N 1 ATOM 2202 C CA . PRO C 3 5 ? 11.274 -14.566 -21.034 1.00 25.95 ? 152 PRO C CA 1 ATOM 2203 C C . PRO C 3 5 ? 10.135 -13.758 -20.507 1.00 28.13 ? 152 PRO C C 1 ATOM 2204 O O . PRO C 3 5 ? 9.917 -12.618 -20.930 1.00 32.45 ? 152 PRO C O 1 ATOM 2205 C CB . PRO C 3 5 ? 12.615 -14.064 -20.450 1.00 27.29 ? 152 PRO C CB 1 ATOM 2206 C CG . PRO C 3 5 ? 13.078 -13.026 -21.431 1.00 27.74 ? 152 PRO C CG 1 ATOM 2207 C CD . PRO C 3 5 ? 12.608 -13.519 -22.780 1.00 26.94 ? 152 PRO C CD 1 ATOM 2208 N N . LYS C 3 6 ? 9.397 -14.344 -19.567 1.00 29.41 ? 153 LYS C N 1 ATOM 2209 C CA . LYS C 3 6 ? 8.292 -13.682 -18.888 1.00 31.38 ? 153 LYS C CA 1 ATOM 2210 C C . LYS C 3 6 ? 8.722 -12.410 -18.229 1.00 30.83 ? 153 LYS C C 1 ATOM 2211 O O . LYS C 3 6 ? 8.005 -11.423 -18.300 1.00 25.73 ? 153 LYS C O 1 ATOM 2212 C CB . LYS C 3 6 ? 7.736 -14.610 -17.797 1.00 37.52 ? 153 LYS C CB 1 ATOM 2213 C CG . LYS C 3 6 ? 6.515 -14.045 -17.060 1.00 44.08 ? 153 LYS C CG 1 ATOM 2214 C CD . LYS C 3 6 ? 5.276 -14.062 -17.943 1.00 49.24 ? 153 LYS C CD 1 ATOM 2215 C CE . LYS C 3 6 ? 4.020 -14.353 -17.117 1.00 55.43 ? 153 LYS C CE 1 ATOM 2216 N NZ . LYS C 3 6 ? 3.852 -13.394 -15.991 1.00 59.73 ? 153 LYS C NZ 1 ATOM 2217 N N . ASN C 3 7 ? 9.919 -12.431 -17.611 1.00 27.28 ? 154 ASN C N 1 ATOM 2218 C CA . ASN C 3 7 ? 10.427 -11.279 -16.858 1.00 26.94 ? 154 ASN C CA 1 ATOM 2219 C C . ASN C 3 7 ? 11.786 -10.879 -17.365 1.00 28.42 ? 154 ASN C C 1 ATOM 2220 O O . ASN C 3 7 ? 12.770 -11.251 -16.744 1.00 24.31 ? 154 ASN C O 1 ATOM 2221 C CB . ASN C 3 7 ? 10.606 -11.716 -15.380 1.00 29.61 ? 154 ASN C CB 1 ATOM 2222 C CG . ASN C 3 7 ? 9.332 -12.360 -14.788 1.00 31.00 ? 154 ASN C CG 1 ATOM 2223 O OD1 . ASN C 3 7 ? 9.177 -13.604 -14.639 1.00 33.05 ? 154 ASN C OD1 1 ATOM 2224 N ND2 . ASN C 3 7 ? 8.394 -11.506 -14.523 1.00 32.61 ? 154 ASN C ND2 1 ATOM 2225 N N . PRO C 3 8 ? 11.861 -10.179 -18.509 1.00 28.14 ? 155 PRO C N 1 ATOM 2226 C CA . PRO C 3 8 ? 13.169 -9.911 -19.110 1.00 27.59 ? 155 PRO C CA 1 ATOM 2227 C C . PRO C 3 8 ? 14.029 -9.010 -18.221 1.00 28.35 ? 155 PRO C C 1 ATOM 2228 O O . PRO C 3 8 ? 13.524 -8.152 -17.504 1.00 28.89 ? 155 PRO C O 1 ATOM 2229 C CB . PRO C 3 8 ? 12.822 -9.175 -20.396 1.00 28.37 ? 155 PRO C CB 1 ATOM 2230 C CG . PRO C 3 8 ? 11.536 -8.489 -20.086 1.00 27.27 ? 155 PRO C CG 1 ATOM 2231 C CD . PRO C 3 8 ? 10.786 -9.466 -19.218 1.00 28.22 ? 155 PRO C CD 1 ATOM 2232 N N . ALA C 3 9 ? 15.322 -9.230 -18.299 1.00 23.92 ? 156 ALA C N 1 ATOM 2233 C CA . ALA C 3 9 ? 16.301 -8.562 -17.477 1.00 24.30 ? 156 ALA C CA 1 ATOM 2234 C C . ALA C 3 9 ? 16.117 -7.072 -17.617 1.00 23.73 ? 156 ALA C C 1 ATOM 2235 O O . ALA C 3 9 ? 16.092 -6.566 -18.705 1.00 22.37 ? 156 ALA C O 1 ATOM 2236 C CB . ALA C 3 9 ? 17.705 -8.956 -17.967 1.00 21.57 ? 156 ALA C CB 1 ATOM 2237 N N . ASN C 3 10 ? 16.030 -6.368 -16.524 1.00 22.50 ? 157 ASN C N 1 ATOM 2238 C CA . ASN C 3 10 ? 15.703 -4.945 -16.619 1.00 25.42 ? 157 ASN C CA 1 ATOM 2239 C C . ASN C 3 10 ? 16.327 -4.186 -15.429 1.00 23.83 ? 157 ASN C C 1 ATOM 2240 O O . ASN C 3 10 ? 15.647 -3.820 -14.542 1.00 21.98 ? 157 ASN C O 1 ATOM 2241 C CB . ASN C 3 10 ? 14.174 -4.735 -16.609 1.00 27.56 ? 157 ASN C CB 1 ATOM 2242 C CG . ASN C 3 10 ? 13.772 -3.244 -16.802 1.00 34.22 ? 157 ASN C CG 1 ATOM 2243 O OD1 . ASN C 3 10 ? 12.918 -2.707 -16.079 1.00 39.57 ? 157 ASN C OD1 1 ATOM 2244 N ND2 . ASN C 3 10 ? 14.380 -2.589 -17.771 1.00 35.02 ? 157 ASN C ND2 1 ATOM 2245 N N . PRO C 3 11 ? 17.660 -3.992 -15.419 1.00 22.17 ? 158 PRO C N 1 ATOM 2246 C CA . PRO C 3 11 ? 18.223 -3.425 -14.215 1.00 20.47 ? 158 PRO C CA 1 ATOM 2247 C C . PRO C 3 11 ? 17.741 -1.965 -13.990 1.00 19.66 ? 158 PRO C C 1 ATOM 2248 O O . PRO C 3 11 ? 17.591 -1.189 -14.932 1.00 20.69 ? 158 PRO C O 1 ATOM 2249 C CB . PRO C 3 11 ? 19.729 -3.497 -14.466 1.00 20.78 ? 158 PRO C CB 1 ATOM 2250 C CG . PRO C 3 11 ? 19.892 -3.657 -15.927 1.00 21.20 ? 158 PRO C CG 1 ATOM 2251 C CD . PRO C 3 11 ? 18.658 -4.271 -16.468 1.00 21.00 ? 158 PRO C CD 1 ATOM 2252 N N . VAL C 3 12 ? 17.565 -1.610 -12.749 1.00 18.93 ? 159 VAL C N 1 ATOM 2253 C CA . VAL C 3 12 ? 17.272 -0.243 -12.338 1.00 19.51 ? 159 VAL C CA 1 ATOM 2254 C C . VAL C 3 12 ? 18.383 0.684 -12.755 1.00 20.05 ? 159 VAL C C 1 ATOM 2255 O O . VAL C 3 12 ? 18.085 1.765 -13.242 1.00 17.57 ? 159 VAL C O 1 ATOM 2256 C CB . VAL C 3 12 ? 17.025 -0.182 -10.794 1.00 20.72 ? 159 VAL C CB 1 ATOM 2257 C CG1 . VAL C 3 12 ? 16.757 1.227 -10.332 1.00 21.30 ? 159 VAL C CG1 1 ATOM 2258 C CG2 . VAL C 3 12 ? 15.787 -1.007 -10.505 1.00 21.45 ? 159 VAL C CG2 1 ATOM 2259 N N . GLN C 3 13 ? 19.649 0.280 -12.511 1.00 18.26 ? 160 GLN C N 1 ATOM 2260 C CA . GLN C 3 13 ? 20.812 1.101 -12.806 1.00 17.66 ? 160 GLN C CA 1 ATOM 2261 C C . GLN C 3 13 ? 21.553 0.536 -14.011 1.00 18.64 ? 160 GLN C C 1 ATOM 2262 O O . GLN C 3 13 ? 22.108 -0.588 -13.927 1.00 16.55 ? 160 GLN C O 1 ATOM 2263 C CB . GLN C 3 13 ? 21.779 1.183 -11.628 1.00 18.28 ? 160 GLN C CB 1 ATOM 2264 C CG . GLN C 3 13 ? 21.119 1.599 -10.316 1.00 19.70 ? 160 GLN C CG 1 ATOM 2265 C CD . GLN C 3 13 ? 22.087 1.828 -9.194 1.00 17.74 ? 160 GLN C CD 1 ATOM 2266 O OE1 . GLN C 3 13 ? 22.607 0.898 -8.630 1.00 20.75 ? 160 GLN C OE1 1 ATOM 2267 N NE2 . GLN C 3 13 ? 22.319 3.070 -8.868 1.00 17.28 ? 160 GLN C NE2 1 ATOM 2268 N N . ARG C 3 14 ? 21.589 1.286 -15.115 1.00 18.50 ? 161 ARG C N 1 ATOM 2269 C CA . ARG C 3 14 ? 22.296 0.817 -16.300 1.00 20.50 ? 161 ARG C CA 1 ATOM 2270 C C . ARG C 3 14 ? 23.757 1.144 -16.179 1.00 18.53 ? 161 ARG C C 1 ATOM 2271 O O . ARG C 3 14 ? 24.206 2.211 -16.659 1.00 19.14 ? 161 ARG C O 1 ATOM 2272 C CB . ARG C 3 14 ? 21.800 1.476 -17.598 1.00 26.39 ? 161 ARG C CB 1 ATOM 2273 C CG . ARG C 3 14 ? 20.318 1.448 -17.835 1.00 32.80 ? 161 ARG C CG 1 ATOM 2274 C CD . ARG C 3 14 ? 19.871 0.243 -18.593 1.00 41.00 ? 161 ARG C CD 1 ATOM 2275 N NE . ARG C 3 14 ? 20.621 -0.142 -19.808 1.00 43.90 ? 161 ARG C NE 1 ATOM 2276 C CZ . ARG C 3 14 ? 20.375 -1.291 -20.448 1.00 48.39 ? 161 ARG C CZ 1 ATOM 2277 N NH1 . ARG C 3 14 ? 21.043 -1.673 -21.553 1.00 52.78 ? 161 ARG C NH1 1 ATOM 2278 N NH2 . ARG C 3 14 ? 19.423 -2.083 -19.960 1.00 50.35 ? 161 ARG C NH2 1 ATOM 2279 N N . ILE C 3 15 ? 24.461 0.295 -15.440 1.00 16.22 ? 162 ILE C N 1 ATOM 2280 C CA . ILE C 3 15 ? 25.842 0.427 -15.171 1.00 16.41 ? 162 ILE C CA 1 ATOM 2281 C C . ILE C 3 15 ? 26.466 -0.887 -15.566 1.00 15.74 ? 162 ILE C C 1 ATOM 2282 O O . ILE C 3 15 ? 26.015 -1.935 -15.132 1.00 15.14 ? 162 ILE C O 1 ATOM 2283 C CB . ILE C 3 15 ? 26.063 0.710 -13.665 1.00 18.77 ? 162 ILE C CB 1 ATOM 2284 C CG1 . ILE C 3 15 ? 25.361 2.017 -13.298 1.00 18.64 ? 162 ILE C CG1 1 ATOM 2285 C CG2 . ILE C 3 15 ? 27.536 0.682 -13.320 1.00 18.46 ? 162 ILE C CG2 1 ATOM 2286 C CD1 . ILE C 3 15 ? 25.391 2.280 -11.811 1.00 21.00 ? 162 ILE C CD1 1 ATOM 2287 N N . LEU C 3 16 ? 27.454 -0.836 -16.472 1.00 15.30 ? 163 LEU C N 1 ATOM 2288 C CA . LEU C 3 16 ? 28.129 -2.015 -16.882 1.00 16.79 ? 163 LEU C CA 1 ATOM 2289 C C . LEU C 3 16 ? 28.793 -2.623 -15.650 1.00 18.69 ? 163 LEU C C 1 ATOM 2290 O O . LEU C 3 16 ? 29.455 -1.933 -14.874 1.00 17.64 ? 163 LEU C O 1 ATOM 2291 C CB . LEU C 3 16 ? 29.199 -1.717 -17.947 1.00 15.96 ? 163 LEU C CB 1 ATOM 2292 C CG . LEU C 3 16 ? 28.562 -1.004 -19.159 1.00 16.75 ? 163 LEU C CG 1 ATOM 2293 C CD1 . LEU C 3 16 ? 29.647 -0.533 -20.092 1.00 19.59 ? 163 LEU C CD1 1 ATOM 2294 C CD2 . LEU C 3 16 ? 27.523 -1.807 -19.910 1.00 19.13 ? 163 LEU C CD2 1 ATOM 2295 N N . GLY C 3 17 ? 28.613 -3.911 -15.499 1.00 18.14 ? 164 GLY C N 1 ATOM 2296 C CA . GLY C 3 17 ? 29.145 -4.634 -14.293 1.00 17.82 ? 164 GLY C CA 1 ATOM 2297 C C . GLY C 3 17 ? 28.076 -5.536 -13.716 1.00 15.16 ? 164 GLY C C 1 ATOM 2298 O O . GLY C 3 17 ? 27.106 -5.927 -14.421 1.00 13.76 ? 164 GLY C O 1 ATOM 2299 N N . GLY C 3 18 ? 28.254 -5.905 -12.471 1.00 13.49 ? 165 GLY C N 1 ATOM 2300 C CA . GLY C 3 18 ? 27.364 -6.928 -11.830 1.00 14.53 ? 165 GLY C CA 1 ATOM 2301 C C . GLY C 3 18 ? 25.955 -6.506 -11.409 1.00 14.58 ? 165 GLY C C 1 ATOM 2302 O O . GLY C 3 18 ? 25.700 -5.363 -10.931 1.00 14.78 ? 165 GLY C O 1 ATOM 2303 N N . HIS C 3 19 ? 25.021 -7.461 -11.501 1.00 14.91 ? 166 HIS C N 1 ATOM 2304 C CA . HIS C 3 19 ? 23.644 -7.230 -11.087 1.00 15.86 ? 166 HIS C CA 1 ATOM 2305 C C . HIS C 3 19 ? 23.070 -8.529 -10.513 1.00 17.32 ? 166 HIS C C 1 ATOM 2306 O O . HIS C 3 19 ? 23.410 -9.655 -10.961 1.00 16.35 ? 166 HIS C O 1 ATOM 2307 C CB . HIS C 3 19 ? 22.757 -6.796 -12.272 1.00 15.90 ? 166 HIS C CB 1 ATOM 2308 C CG . HIS C 3 19 ? 23.119 -5.456 -12.837 1.00 16.15 ? 166 HIS C CG 1 ATOM 2309 N ND1 . HIS C 3 19 ? 22.565 -4.266 -12.380 1.00 18.70 ? 166 HIS C ND1 1 ATOM 2310 C CD2 . HIS C 3 19 ? 23.991 -5.119 -13.813 1.00 16.37 ? 166 HIS C CD2 1 ATOM 2311 C CE1 . HIS C 3 19 ? 23.112 -3.263 -13.031 1.00 17.76 ? 166 HIS C CE1 1 ATOM 2312 N NE2 . HIS C 3 19 ? 23.949 -3.762 -13.941 1.00 17.17 ? 166 HIS C NE2 1 ATOM 2313 N N . LEU C 3 20 ? 22.186 -8.384 -9.562 1.00 16.24 ? 167 LEU C N 1 ATOM 2314 C CA . LEU C 3 20 ? 21.461 -9.560 -9.067 1.00 17.18 ? 167 LEU C CA 1 ATOM 2315 C C . LEU C 3 20 ? 20.395 -9.958 -10.067 1.00 16.78 ? 167 LEU C C 1 ATOM 2316 O O . LEU C 3 20 ? 19.735 -9.079 -10.659 1.00 16.97 ? 167 LEU C O 1 ATOM 2317 C CB . LEU C 3 20 ? 20.808 -9.213 -7.751 1.00 17.81 ? 167 LEU C CB 1 ATOM 2318 C CG . LEU C 3 20 ? 19.980 -10.289 -7.066 1.00 19.44 ? 167 LEU C CG 1 ATOM 2319 C CD1 . LEU C 3 20 ? 20.844 -11.467 -6.586 1.00 18.97 ? 167 LEU C CD1 1 ATOM 2320 C CD2 . LEU C 3 20 ? 19.250 -9.652 -5.897 1.00 21.13 ? 167 LEU C CD2 1 ATOM 2321 N N . ASP C 3 21 ? 20.164 -11.253 -10.269 1.00 17.79 ? 168 ASP C N 1 ATOM 2322 C CA . ASP C 3 21 ? 19.000 -11.700 -11.131 1.00 18.78 ? 168 ASP C CA 1 ATOM 2323 C C . ASP C 3 21 ? 17.721 -11.536 -10.315 1.00 21.41 ? 168 ASP C C 1 ATOM 2324 O O . ASP C 3 21 ? 17.115 -12.508 -9.881 1.00 23.34 ? 168 ASP C O 1 ATOM 2325 C CB . ASP C 3 21 ? 19.142 -13.115 -11.635 1.00 17.36 ? 168 ASP C CB 1 ATOM 2326 C CG . ASP C 3 21 ? 17.890 -13.620 -12.439 1.00 19.57 ? 168 ASP C CG 1 ATOM 2327 O OD1 . ASP C 3 21 ? 17.215 -12.839 -13.134 1.00 19.76 ? 168 ASP C OD1 1 ATOM 2328 O OD2 . ASP C 3 21 ? 17.623 -14.840 -12.421 1.00 19.24 ? 168 ASP C OD2 1 ATOM 2329 N N . ALA C 3 22 ? 17.342 -10.300 -10.062 1.00 22.64 ? 169 ALA C N 1 ATOM 2330 C CA . ALA C 3 22 ? 16.135 -10.041 -9.218 1.00 24.19 ? 169 ALA C CA 1 ATOM 2331 C C . ALA C 3 22 ? 14.796 -10.592 -9.747 1.00 24.50 ? 169 ALA C C 1 ATOM 2332 O O . ALA C 3 22 ? 13.925 -10.914 -8.976 1.00 21.21 ? 169 ALA C O 1 ATOM 2333 C CB . ALA C 3 22 ? 15.969 -8.542 -9.050 1.00 23.74 ? 169 ALA C CB 1 ATOM 2334 N N . LYS C 3 23 ? 14.612 -10.640 -11.050 1.00 24.37 ? 170 LYS C N 1 ATOM 2335 C CA . LYS C 3 23 ? 13.308 -10.952 -11.631 1.00 23.80 ? 170 LYS C CA 1 ATOM 2336 C C . LYS C 3 23 ? 13.272 -12.328 -12.202 1.00 25.82 ? 170 LYS C C 1 ATOM 2337 O O . LYS C 3 23 ? 12.206 -12.757 -12.642 1.00 25.41 ? 170 LYS C O 1 ATOM 2338 C CB . LYS C 3 23 ? 12.931 -9.953 -12.757 1.00 26.50 ? 170 LYS C CB 1 ATOM 2339 C CG . LYS C 3 23 ? 13.289 -8.482 -12.505 1.00 31.51 ? 170 LYS C CG 1 ATOM 2340 C CD . LYS C 3 23 ? 12.515 -7.929 -11.293 1.00 41.08 ? 170 LYS C CD 1 ATOM 2341 C CE . LYS C 3 23 ? 12.136 -6.436 -11.400 1.00 51.28 ? 170 LYS C CE 1 ATOM 2342 N NZ . LYS C 3 23 ? 11.761 -5.825 -10.077 1.00 52.73 ? 170 LYS C NZ 1 ATOM 2343 N N . GLY C 3 24 ? 14.385 -13.068 -12.236 1.00 23.40 ? 171 GLY C N 1 ATOM 2344 C CA . GLY C 3 24 ? 14.325 -14.438 -12.828 1.00 21.20 ? 171 GLY C CA 1 ATOM 2345 C C . GLY C 3 24 ? 14.295 -14.337 -14.350 1.00 20.03 ? 171 GLY C C 1 ATOM 2346 O O . GLY C 3 24 ? 13.390 -14.791 -14.989 1.00 20.14 ? 171 GLY C O 1 ATOM 2347 N N . SER C 3 25 ? 15.269 -13.645 -14.917 1.00 18.28 ? 172 SER C N 1 ATOM 2348 C CA . SER C 3 25 ? 15.307 -13.271 -16.307 1.00 18.72 ? 172 SER C CA 1 ATOM 2349 C C . SER C 3 25 ? 16.114 -14.133 -17.262 1.00 18.48 ? 172 SER C C 1 ATOM 2350 O O . SER C 3 25 ? 16.251 -13.784 -18.447 1.00 16.97 ? 172 SER C O 1 ATOM 2351 C CB . SER C 3 25 ? 15.885 -11.851 -16.396 1.00 20.71 ? 172 SER C CB 1 ATOM 2352 O OG . SER C 3 25 ? 15.132 -10.948 -15.625 1.00 20.63 ? 172 SER C OG 1 ATOM 2353 N N . PHE C 3 26 ? 16.582 -15.277 -16.783 1.00 17.29 ? 173 PHE C N 1 ATOM 2354 C CA . PHE C 3 26 ? 17.403 -16.135 -17.565 1.00 18.13 ? 173 PHE C CA 1 ATOM 2355 C C . PHE C 3 26 ? 16.935 -17.600 -17.506 1.00 17.86 ? 173 PHE C C 1 ATOM 2356 O O . PHE C 3 26 ? 17.701 -18.498 -17.044 1.00 14.05 ? 173 PHE C O 1 ATOM 2357 C CB . PHE C 3 26 ? 18.870 -16.011 -17.037 1.00 18.19 ? 173 PHE C CB 1 ATOM 2358 C CG . PHE C 3 26 ? 19.381 -14.609 -17.078 1.00 18.38 ? 173 PHE C CG 1 ATOM 2359 C CD1 . PHE C 3 26 ? 19.994 -14.116 -18.225 1.00 20.00 ? 173 PHE C CD1 1 ATOM 2360 C CD2 . PHE C 3 26 ? 19.227 -13.770 -16.010 1.00 19.32 ? 173 PHE C CD2 1 ATOM 2361 C CE1 . PHE C 3 26 ? 20.413 -12.786 -18.294 1.00 19.21 ? 173 PHE C CE1 1 ATOM 2362 C CE2 . PHE C 3 26 ? 19.673 -12.443 -16.046 1.00 17.92 ? 173 PHE C CE2 1 ATOM 2363 C CZ . PHE C 3 26 ? 20.240 -11.963 -17.193 1.00 20.31 ? 173 PHE C CZ 1 ATOM 2364 N N . PRO C 3 27 ? 15.736 -17.865 -18.054 1.00 16.89 ? 174 PRO C N 1 ATOM 2365 C CA . PRO C 3 27 ? 15.195 -19.247 -17.926 1.00 16.89 ? 174 PRO C CA 1 ATOM 2366 C C . PRO C 3 27 ? 15.886 -20.222 -18.798 1.00 15.49 ? 174 PRO C C 1 ATOM 2367 O O . PRO C 3 27 ? 15.570 -21.412 -18.719 1.00 16.91 ? 174 PRO C O 1 ATOM 2368 C CB . PRO C 3 27 ? 13.728 -19.100 -18.360 1.00 16.52 ? 174 PRO C CB 1 ATOM 2369 C CG . PRO C 3 27 ? 13.712 -17.876 -19.255 1.00 16.73 ? 174 PRO C CG 1 ATOM 2370 C CD . PRO C 3 27 ? 14.739 -16.943 -18.633 1.00 16.93 ? 174 PRO C CD 1 ATOM 2371 N N . TRP C 3 28 ? 16.782 -19.741 -19.669 1.00 14.30 ? 175 TRP C N 1 ATOM 2372 C CA . TRP C 3 28 ? 17.624 -20.613 -20.515 1.00 13.35 ? 175 TRP C CA 1 ATOM 2373 C C . TRP C 3 28 ? 18.824 -21.101 -19.768 1.00 13.19 ? 175 TRP C C 1 ATOM 2374 O O . TRP C 3 28 ? 19.517 -21.950 -20.208 1.00 12.80 ? 175 TRP C O 1 ATOM 2375 C CB . TRP C 3 28 ? 18.056 -19.900 -21.789 1.00 13.42 ? 175 TRP C CB 1 ATOM 2376 C CG . TRP C 3 28 ? 18.577 -18.577 -21.566 1.00 14.30 ? 175 TRP C CG 1 ATOM 2377 C CD1 . TRP C 3 28 ? 19.874 -18.238 -21.186 1.00 15.00 ? 175 TRP C CD1 1 ATOM 2378 C CD2 . TRP C 3 28 ? 17.865 -17.358 -21.709 1.00 15.86 ? 175 TRP C CD2 1 ATOM 2379 N NE1 . TRP C 3 28 ? 19.989 -16.858 -21.073 1.00 14.90 ? 175 TRP C NE1 1 ATOM 2380 C CE2 . TRP C 3 28 ? 18.774 -16.297 -21.399 1.00 17.16 ? 175 TRP C CE2 1 ATOM 2381 C CE3 . TRP C 3 28 ? 16.543 -17.035 -22.107 1.00 15.11 ? 175 TRP C CE3 1 ATOM 2382 C CZ2 . TRP C 3 28 ? 18.377 -14.941 -21.448 1.00 16.81 ? 175 TRP C CZ2 1 ATOM 2383 C CZ3 . TRP C 3 28 ? 16.171 -15.708 -22.151 1.00 16.44 ? 175 TRP C CZ3 1 ATOM 2384 C CH2 . TRP C 3 28 ? 17.075 -14.680 -21.857 1.00 16.23 ? 175 TRP C CH2 1 ATOM 2385 N N . GLN C 3 29 ? 19.102 -20.526 -18.604 1.00 16.01 ? 176 GLN C N 1 ATOM 2386 C CA . GLN C 3 29 ? 20.341 -20.904 -17.886 1.00 15.33 ? 176 GLN C CA 1 ATOM 2387 C C . GLN C 3 29 ? 20.210 -22.288 -17.230 1.00 14.94 ? 176 GLN C C 1 ATOM 2388 O O . GLN C 3 29 ? 19.234 -22.527 -16.500 1.00 13.86 ? 176 GLN C O 1 ATOM 2389 C CB . GLN C 3 29 ? 20.619 -19.872 -16.812 1.00 16.96 ? 176 GLN C CB 1 ATOM 2390 C CG . GLN C 3 29 ? 21.821 -20.168 -15.917 1.00 18.17 ? 176 GLN C CG 1 ATOM 2391 C CD . GLN C 3 29 ? 23.090 -19.925 -16.649 1.00 20.08 ? 176 GLN C CD 1 ATOM 2392 O OE1 . GLN C 3 29 ? 23.311 -18.822 -17.146 1.00 19.32 ? 176 GLN C OE1 1 ATOM 2393 N NE2 . GLN C 3 29 ? 23.964 -20.919 -16.679 1.00 19.23 ? 176 GLN C NE2 1 ATOM 2394 N N . ALA C 3 30 ? 21.217 -23.151 -17.385 1.00 15.15 ? 177 ALA C N 1 ATOM 2395 C CA . ALA C 3 30 ? 21.261 -24.408 -16.630 1.00 15.74 ? 177 ALA C CA 1 ATOM 2396 C C . ALA C 3 30 ? 22.498 -24.495 -15.773 1.00 17.48 ? 177 ALA C C 1 ATOM 2397 O O . ALA C 3 30 ? 23.481 -23.757 -15.982 1.00 16.81 ? 177 ALA C O 1 ATOM 2398 C CB . ALA C 3 30 ? 21.257 -25.591 -17.586 1.00 15.33 ? 177 ALA C CB 1 ATOM 2399 N N . LYS C 3 31 ? 22.483 -25.481 -14.872 1.00 17.59 ? 178 LYS C N 1 ATOM 2400 C CA . LYS C 3 31 ? 23.594 -25.687 -13.930 1.00 17.81 ? 178 LYS C CA 1 ATOM 2401 C C . LYS C 3 31 ? 24.055 -27.082 -14.064 1.00 15.55 ? 178 LYS C C 1 ATOM 2402 O O . LYS C 3 31 ? 23.281 -28.002 -13.808 1.00 15.76 ? 178 LYS C O 1 ATOM 2403 C CB . LYS C 3 31 ? 23.274 -25.413 -12.458 1.00 20.07 ? 178 LYS C CB 1 ATOM 2404 C CG . LYS C 3 31 ? 24.499 -25.540 -11.542 1.00 22.19 ? 178 LYS C CG 1 ATOM 2405 C CD . LYS C 3 31 ? 24.122 -25.575 -10.027 1.00 24.72 ? 178 LYS C CD 1 ATOM 2406 C CE . LYS C 3 31 ? 23.637 -24.203 -9.595 1.00 27.19 ? 178 LYS C CE 1 ATOM 2407 N NZ . LYS C 3 31 ? 23.346 -24.066 -8.139 1.00 35.94 ? 178 LYS C NZ 1 ATOM 2408 N N . MET C 3 32 ? 25.314 -27.215 -14.439 1.00 14.60 ? 179 MET C N 1 ATOM 2409 C CA . MET C 3 32 ? 25.986 -28.493 -14.581 1.00 15.75 ? 179 MET C CA 1 ATOM 2410 C C . MET C 3 32 ? 26.893 -28.725 -13.375 1.00 15.23 ? 179 MET C C 1 ATOM 2411 O O . MET C 3 32 ? 27.544 -27.808 -12.861 1.00 14.51 ? 179 MET C O 1 ATOM 2412 C CB . MET C 3 32 ? 26.832 -28.546 -15.848 1.00 17.10 ? 179 MET C CB 1 ATOM 2413 C CG . MET C 3 32 ? 27.045 -29.959 -16.357 1.00 18.04 ? 179 MET C CG 1 ATOM 2414 S SD . MET C 3 32 ? 27.499 -30.162 -18.114 1.00 22.50 ? 179 MET C SD 1 ATOM 2415 C CE . MET C 3 32 ? 29.196 -29.469 -18.149 1.00 18.34 ? 179 MET C CE 1 ATOM 2416 N N . VAL C 3 33 ? 26.962 -29.963 -12.960 1.00 14.43 ? 180 VAL C N 1 ATOM 2417 C CA . VAL C 3 33 ? 27.861 -30.391 -11.835 1.00 14.83 ? 180 VAL C CA 1 ATOM 2418 C C . VAL C 3 33 ? 28.634 -31.621 -12.321 1.00 14.81 ? 180 VAL C C 1 ATOM 2419 O O . VAL C 3 33 ? 28.061 -32.565 -12.881 1.00 14.44 ? 180 VAL C O 1 ATOM 2420 C CB . VAL C 3 33 ? 27.076 -30.561 -10.494 1.00 16.10 ? 180 VAL C CB 1 ATOM 2421 C CG1 . VAL C 3 33 ? 28.039 -30.890 -9.346 1.00 16.95 ? 180 VAL C CG1 1 ATOM 2422 C CG2 . VAL C 3 33 ? 26.286 -29.290 -10.153 1.00 14.37 ? 180 VAL C CG2 1 ATOM 2423 N N . SER C 3 34 ? 29.968 -31.510 -12.284 1.00 16.09 ? 181 SER C N 1 ATOM 2424 C CA . SER C 3 34 ? 30.925 -32.594 -12.501 1.00 16.48 ? 181 SER C CA 1 ATOM 2425 C C . SER C 3 34 ? 31.015 -33.663 -11.411 1.00 19.04 ? 181 SER C C 1 ATOM 2426 O O . SER C 3 34 ? 30.562 -33.471 -10.308 1.00 19.97 ? 181 SER C O 1 ATOM 2427 C CB . SER C 3 34 ? 32.349 -32.052 -12.655 1.00 16.58 ? 181 SER C CB 1 ATOM 2428 O OG . SER C 3 34 ? 32.880 -31.693 -11.343 1.00 16.22 ? 181 SER C OG 1 ATOM 2429 N N . HIS C 3 35 ? 31.632 -34.790 -11.753 1.00 20.99 ? 182 HIS C N 1 ATOM 2430 C CA . HIS C 3 35 ? 31.650 -35.919 -10.842 1.00 26.52 ? 182 HIS C CA 1 ATOM 2431 C C . HIS C 3 35 ? 32.493 -35.589 -9.604 1.00 27.34 ? 182 HIS C C 1 ATOM 2432 O O . HIS C 3 35 ? 32.319 -36.228 -8.605 1.00 28.64 ? 182 HIS C O 1 ATOM 2433 C CB . HIS C 3 35 ? 32.171 -37.190 -11.516 1.00 32.27 ? 182 HIS C CB 1 ATOM 2434 C CG . HIS C 3 35 ? 31.906 -38.437 -10.714 1.00 43.83 ? 182 HIS C CG 1 ATOM 2435 N ND1 . HIS C 3 35 ? 32.863 -39.027 -9.913 1.00 49.35 ? 182 HIS C ND1 1 ATOM 2436 C CD2 . HIS C 3 35 ? 30.773 -39.172 -10.541 1.00 52.14 ? 182 HIS C CD2 1 ATOM 2437 C CE1 . HIS C 3 35 ? 32.340 -40.071 -9.290 1.00 50.50 ? 182 HIS C CE1 1 ATOM 2438 N NE2 . HIS C 3 35 ? 31.079 -40.193 -9.664 1.00 49.52 ? 182 HIS C NE2 1 ATOM 2439 N N . HIS C 3 36 ? 33.351 -34.557 -9.640 1.00 24.28 ? 183 HIS C N 1 ATOM 2440 C CA . HIS C 3 36 ? 34.051 -34.103 -8.420 1.00 22.40 ? 183 HIS C CA 1 ATOM 2441 C C . HIS C 3 36 ? 33.531 -32.786 -7.880 1.00 23.94 ? 183 HIS C C 1 ATOM 2442 O O . HIS C 3 36 ? 34.263 -32.061 -7.220 1.00 23.47 ? 183 HIS C O 1 ATOM 2443 C CB . HIS C 3 36 ? 35.579 -34.149 -8.620 1.00 24.45 ? 183 HIS C CB 1 ATOM 2444 C CG . HIS C 3 36 ? 36.127 -33.190 -9.648 1.00 30.83 ? 183 HIS C CG 1 ATOM 2445 N ND1 . HIS C 3 36 ? 35.344 -32.436 -10.512 1.00 30.79 ? 183 HIS C ND1 1 ATOM 2446 C CD2 . HIS C 3 36 ? 37.416 -32.878 -9.952 1.00 34.19 ? 183 HIS C CD2 1 ATOM 2447 C CE1 . HIS C 3 36 ? 36.120 -31.685 -11.273 1.00 31.88 ? 183 HIS C CE1 1 ATOM 2448 N NE2 . HIS C 3 36 ? 37.386 -31.953 -10.978 1.00 35.48 ? 183 HIS C NE2 1 ATOM 2449 N N . ASN C 3 37 ? 32.243 -32.494 -8.137 1.00 20.98 ? 184 ASN C N 1 ATOM 2450 C CA . ASN C 3 37 ? 31.487 -31.426 -7.502 1.00 22.70 ? 184 ASN C CA 1 ATOM 2451 C C . ASN C 3 37 ? 31.783 -30.012 -7.933 1.00 20.14 ? 184 ASN C C 1 ATOM 2452 O O . ASN C 3 37 ? 31.527 -29.081 -7.153 1.00 17.05 ? 184 ASN C O 1 ATOM 2453 C CB . ASN C 3 37 ? 31.519 -31.532 -5.953 1.00 28.33 ? 184 ASN C CB 1 ATOM 2454 C CG . ASN C 3 37 ? 30.766 -32.742 -5.471 1.00 42.48 ? 184 ASN C CG 1 ATOM 2455 O OD1 . ASN C 3 37 ? 29.925 -33.292 -6.207 1.00 51.13 ? 184 ASN C OD1 1 ATOM 2456 N ND2 . ASN C 3 37 ? 31.074 -33.207 -4.255 1.00 54.68 ? 184 ASN C ND2 1 ATOM 2457 N N . LEU C 3 38 ? 32.221 -29.824 -9.168 1.00 17.68 ? 185 LEU C N 1 ATOM 2458 C CA . LEU C 3 38 ? 32.456 -28.479 -9.689 1.00 17.66 ? 185 LEU C CA 1 ATOM 2459 C C . LEU C 3 38 ? 31.307 -28.017 -10.534 1.00 16.28 ? 185 LEU C C 1 ATOM 2460 O O . LEU C 3 38 ? 30.879 -28.692 -11.513 1.00 16.08 ? 185 LEU C O 1 ATOM 2461 C CB . LEU C 3 38 ? 33.758 -28.427 -10.497 1.00 19.07 ? 185 LEU C CB 1 ATOM 2462 C CG . LEU C 3 38 ? 35.082 -28.679 -9.695 1.00 22.24 ? 185 LEU C CG 1 ATOM 2463 C CD1 . LEU C 3 38 ? 36.284 -28.284 -10.548 1.00 25.15 ? 185 LEU C CD1 1 ATOM 2464 C CD2 . LEU C 3 38 ? 35.149 -27.935 -8.344 1.00 22.03 ? 185 LEU C CD2 1 ATOM 2465 N N . THR C 3 39 ? 30.807 -26.849 -10.152 1.00 16.84 ? 186 THR C N 1 ATOM 2466 C CA . THR C 3 39 ? 29.693 -26.253 -10.805 1.00 18.63 ? 186 THR C CA 1 ATOM 2467 C C . THR C 3 39 ? 30.155 -25.559 -12.052 1.00 19.88 ? 186 THR C C 1 ATOM 2468 O O . THR C 3 39 ? 31.178 -24.804 -12.027 1.00 17.40 ? 186 THR C O 1 ATOM 2469 C CB . THR C 3 39 ? 28.894 -25.343 -9.866 1.00 18.75 ? 186 THR C CB 1 ATOM 2470 O OG1 . THR C 3 39 ? 28.231 -26.152 -8.921 1.00 20.27 ? 186 THR C OG1 1 ATOM 2471 C CG2 . THR C 3 39 ? 27.835 -24.598 -10.592 1.00 19.55 ? 186 THR C CG2 1 ATOM 2472 N N . THR C 3 40 ? 29.424 -25.835 -13.152 1.00 19.69 ? 187 THR C N 1 ATOM 2473 C CA . THR C 3 40 ? 29.553 -25.020 -14.386 1.00 17.65 ? 187 THR C CA 1 ATOM 2474 C C . THR C 3 40 ? 28.214 -24.669 -15.049 1.00 14.32 ? 187 THR C C 1 ATOM 2475 O O . THR C 3 40 ? 27.170 -24.977 -14.567 1.00 12.53 ? 187 THR C O 1 ATOM 2476 C CB . THR C 3 40 ? 30.512 -25.635 -15.432 1.00 18.79 ? 187 THR C CB 1 ATOM 2477 O OG1 . THR C 3 40 ? 29.987 -26.870 -15.960 1.00 18.08 ? 187 THR C OG1 1 ATOM 2478 C CG2 . THR C 3 40 ? 31.882 -25.852 -14.891 1.00 19.44 ? 187 THR C CG2 1 ATOM 2479 N N . GLY C 3 41 ? 28.267 -23.928 -16.139 1.00 13.14 ? 188 GLY C N 1 ATOM 2480 C CA . GLY C 3 41 ? 27.063 -23.524 -16.872 1.00 11.89 ? 188 GLY C CA 1 ATOM 2481 C C . GLY C 3 41 ? 26.754 -24.327 -18.115 1.00 11.86 ? 188 GLY C C 1 ATOM 2482 O O . GLY C 3 41 ? 27.648 -24.976 -18.762 1.00 12.38 ? 188 GLY C O 1 ATOM 2483 N N . ALA C 3 42 ? 25.473 -24.291 -18.468 1.00 11.53 ? 189 ALA C N 1 ATOM 2484 C CA . ALA C 3 42 ? 25.053 -24.663 -19.785 1.00 11.51 ? 189 ALA C CA 1 ATOM 2485 C C . ALA C 3 42 ? 23.830 -23.818 -20.100 1.00 12.20 ? 189 ALA C C 1 ATOM 2486 O O . ALA C 3 42 ? 23.335 -23.097 -19.229 1.00 12.14 ? 189 ALA C O 1 ATOM 2487 C CB . ALA C 3 42 ? 24.767 -26.119 -19.848 1.00 11.25 ? 189 ALA C CB 1 ATOM 2488 N N . THR C 3 43 ? 23.451 -23.841 -21.378 1.00 12.51 ? 190 THR C N 1 ATOM 2489 C CA . THR C 3 43 ? 22.504 -22.929 -21.945 1.00 12.97 ? 190 THR C CA 1 ATOM 2490 C C . THR C 3 43 ? 21.468 -23.714 -22.766 1.00 13.99 ? 190 THR C C 1 ATOM 2491 O O . THR C 3 43 ? 21.791 -24.383 -23.724 1.00 14.25 ? 190 THR C O 1 ATOM 2492 C CB . THR C 3 43 ? 23.255 -21.869 -22.824 1.00 13.31 ? 190 THR C CB 1 ATOM 2493 O OG1 . THR C 3 43 ? 24.097 -21.026 -22.000 1.00 14.17 ? 190 THR C OG1 1 ATOM 2494 C CG2 . THR C 3 43 ? 22.282 -20.973 -23.510 1.00 14.70 ? 190 THR C CG2 1 ATOM 2495 N N . LEU C 3 44 ? 20.202 -23.598 -22.397 1.00 15.92 ? 191 LEU C N 1 ATOM 2496 C CA . LEU C 3 44 ? 19.124 -24.327 -23.122 1.00 16.58 ? 191 LEU C CA 1 ATOM 2497 C C . LEU C 3 44 ? 18.838 -23.615 -24.426 1.00 17.19 ? 191 LEU C C 1 ATOM 2498 O O . LEU C 3 44 ? 18.576 -22.447 -24.431 1.00 17.12 ? 191 LEU C O 1 ATOM 2499 C CB . LEU C 3 44 ? 17.897 -24.349 -22.221 1.00 16.91 ? 191 LEU C CB 1 ATOM 2500 C CG . LEU C 3 44 ? 16.714 -25.200 -22.576 1.00 17.51 ? 191 LEU C CG 1 ATOM 2501 C CD1 . LEU C 3 44 ? 17.060 -26.676 -22.539 1.00 17.70 ? 191 LEU C CD1 1 ATOM 2502 C CD2 . LEU C 3 44 ? 15.575 -24.822 -21.601 1.00 18.03 ? 191 LEU C CD2 1 ATOM 2503 N N . ILE C 3 45 ? 18.973 -24.309 -25.558 1.00 19.41 ? 192 ILE C N 1 ATOM 2504 C CA . ILE C 3 45 ? 18.768 -23.702 -26.877 1.00 19.25 ? 192 ILE C CA 1 ATOM 2505 C C . ILE C 3 45 ? 17.545 -24.294 -27.642 1.00 23.13 ? 192 ILE C C 1 ATOM 2506 O O . ILE C 3 45 ? 17.137 -23.775 -28.664 1.00 22.61 ? 192 ILE C O 1 ATOM 2507 C CB . ILE C 3 45 ? 19.987 -23.872 -27.768 1.00 20.60 ? 192 ILE C CB 1 ATOM 2508 C CG1 . ILE C 3 45 ? 20.370 -25.333 -27.830 1.00 19.24 ? 192 ILE C CG1 1 ATOM 2509 C CG2 . ILE C 3 45 ? 21.175 -23.113 -27.206 1.00 22.38 ? 192 ILE C CG2 1 ATOM 2510 C CD1 . ILE C 3 45 ? 20.988 -25.721 -29.096 1.00 20.45 ? 192 ILE C CD1 1 ATOM 2511 N N . ASN C 3 46 ? 17.009 -25.429 -27.215 1.00 23.64 ? 193 ASN C N 1 ATOM 2512 C CA . ASN C 3 46 ? 15.609 -25.751 -27.541 1.00 23.32 ? 193 ASN C CA 1 ATOM 2513 C C . ASN C 3 46 ? 15.070 -26.620 -26.443 1.00 22.77 ? 193 ASN C C 1 ATOM 2514 O O . ASN C 3 46 ? 15.715 -26.791 -25.393 1.00 23.61 ? 193 ASN C O 1 ATOM 2515 C CB . ASN C 3 46 ? 15.452 -26.342 -28.958 1.00 23.69 ? 193 ASN C CB 1 ATOM 2516 C CG . ASN C 3 46 ? 16.114 -27.726 -29.108 1.00 25.70 ? 193 ASN C CG 1 ATOM 2517 O OD1 . ASN C 3 46 ? 16.175 -28.509 -28.201 1.00 23.30 ? 193 ASN C OD1 1 ATOM 2518 N ND2 . ASN C 3 46 ? 16.596 -27.999 -30.271 1.00 28.31 ? 193 ASN C ND2 1 ATOM 2519 N N . GLU C 3 47 ? 13.952 -27.255 -26.701 1.00 21.91 ? 194 GLU C N 1 ATOM 2520 C CA . GLU C 3 47 ? 13.287 -28.029 -25.680 1.00 25.46 ? 194 GLU C CA 1 ATOM 2521 C C . GLU C 3 47 ? 14.094 -29.265 -25.150 1.00 20.60 ? 194 GLU C C 1 ATOM 2522 O O . GLU C 3 47 ? 13.811 -29.760 -24.075 1.00 20.94 ? 194 GLU C O 1 ATOM 2523 C CB . GLU C 3 47 ? 11.843 -28.377 -26.141 1.00 27.02 ? 194 GLU C CB 1 ATOM 2524 C CG . GLU C 3 47 ? 10.915 -27.161 -26.010 1.00 30.14 ? 194 GLU C CG 1 ATOM 2525 C CD . GLU C 3 47 ? 9.500 -27.351 -26.575 1.00 38.13 ? 194 GLU C CD 1 ATOM 2526 O OE1 . GLU C 3 47 ? 9.102 -28.493 -26.897 1.00 35.61 ? 194 GLU C OE1 1 ATOM 2527 O OE2 . GLU C 3 47 ? 8.779 -26.314 -26.707 1.00 54.13 ? 194 GLU C OE2 1 ATOM 2528 N N . GLN C 3 48 ? 15.097 -29.695 -25.897 1.00 16.75 ? 195 GLN C N 1 ATOM 2529 C CA . GLN C 3 48 ? 15.829 -30.906 -25.604 1.00 16.97 ? 195 GLN C CA 1 ATOM 2530 C C . GLN C 3 48 ? 17.354 -30.836 -25.713 1.00 15.05 ? 195 GLN C C 1 ATOM 2531 O O . GLN C 3 48 ? 17.993 -31.863 -25.625 1.00 15.56 ? 195 GLN C O 1 ATOM 2532 C CB . GLN C 3 48 ? 15.322 -32.033 -26.537 1.00 19.41 ? 195 GLN C CB 1 ATOM 2533 C CG . GLN C 3 48 ? 15.386 -33.433 -25.946 1.00 20.94 ? 195 GLN C CG 1 ATOM 2534 C CD . GLN C 3 48 ? 14.654 -34.523 -26.778 1.00 21.27 ? 195 GLN C CD 1 ATOM 2535 O OE1 . GLN C 3 48 ? 14.854 -35.741 -26.590 1.00 22.63 ? 195 GLN C OE1 1 ATOM 2536 N NE2 . GLN C 3 48 ? 13.873 -34.099 -27.666 1.00 21.38 ? 195 GLN C NE2 1 ATOM 2537 N N . TRP C 3 49 ? 17.949 -29.669 -25.934 1.00 13.67 ? 196 TRP C N 1 ATOM 2538 C CA . TRP C 3 49 ? 19.370 -29.586 -26.211 1.00 13.48 ? 196 TRP C CA 1 ATOM 2539 C C . TRP C 3 49 ? 19.891 -28.313 -25.542 1.00 14.48 ? 196 TRP C C 1 ATOM 2540 O O . TRP C 3 49 ? 19.192 -27.259 -25.514 1.00 13.37 ? 196 TRP C O 1 ATOM 2541 C CB . TRP C 3 49 ? 19.632 -29.495 -27.732 1.00 15.98 ? 196 TRP C CB 1 ATOM 2542 C CG . TRP C 3 49 ? 19.436 -30.757 -28.589 1.00 16.01 ? 196 TRP C CG 1 ATOM 2543 C CD1 . TRP C 3 49 ? 18.251 -31.193 -29.156 1.00 17.19 ? 196 TRP C CD1 1 ATOM 2544 C CD2 . TRP C 3 49 ? 20.447 -31.679 -29.017 1.00 16.47 ? 196 TRP C CD2 1 ATOM 2545 N NE1 . TRP C 3 49 ? 18.467 -32.325 -29.882 1.00 16.23 ? 196 TRP C NE1 1 ATOM 2546 C CE2 . TRP C 3 49 ? 19.801 -32.657 -29.812 1.00 16.96 ? 196 TRP C CE2 1 ATOM 2547 C CE3 . TRP C 3 49 ? 21.818 -31.811 -28.759 1.00 16.60 ? 196 TRP C CE3 1 ATOM 2548 C CZ2 . TRP C 3 49 ? 20.480 -33.688 -30.393 1.00 15.73 ? 196 TRP C CZ2 1 ATOM 2549 C CZ3 . TRP C 3 49 ? 22.503 -32.840 -29.313 1.00 16.35 ? 196 TRP C CZ3 1 ATOM 2550 C CH2 . TRP C 3 49 ? 21.821 -33.803 -30.142 1.00 16.56 ? 196 TRP C CH2 1 ATOM 2551 N N . LEU C 3 50 ? 21.113 -28.431 -25.033 1.00 14.42 ? 197 LEU C N 1 ATOM 2552 C CA . LEU C 3 50 ? 21.818 -27.378 -24.375 1.00 14.74 ? 197 LEU C CA 1 ATOM 2553 C C . LEU C 3 50 ? 23.187 -27.226 -25.033 1.00 15.70 ? 197 LEU C C 1 ATOM 2554 O O . LEU C 3 50 ? 23.813 -28.190 -25.452 1.00 15.27 ? 197 LEU C O 1 ATOM 2555 C CB . LEU C 3 50 ? 22.026 -27.672 -22.907 1.00 14.25 ? 197 LEU C CB 1 ATOM 2556 C CG . LEU C 3 50 ? 20.711 -27.774 -22.139 1.00 13.95 ? 197 LEU C CG 1 ATOM 2557 C CD1 . LEU C 3 50 ? 20.309 -29.255 -22.062 1.00 13.91 ? 197 LEU C CD1 1 ATOM 2558 C CD2 . LEU C 3 50 ? 20.688 -27.181 -20.749 1.00 14.73 ? 197 LEU C CD2 1 ATOM 2559 N N . LEU C 3 51 ? 23.648 -25.983 -25.078 1.00 16.54 ? 198 LEU C N 1 ATOM 2560 C CA . LEU C 3 51 ? 25.115 -25.729 -25.297 1.00 15.47 ? 198 LEU C CA 1 ATOM 2561 C C . LEU C 3 51 ? 25.891 -25.600 -24.015 1.00 14.14 ? 198 LEU C C 1 ATOM 2562 O O . LEU C 3 51 ? 25.391 -25.056 -22.976 1.00 15.81 ? 198 LEU C O 1 ATOM 2563 C CB . LEU C 3 51 ? 25.293 -24.455 -26.102 1.00 14.93 ? 198 LEU C CB 1 ATOM 2564 C CG . LEU C 3 51 ? 25.074 -24.498 -27.635 1.00 14.32 ? 198 LEU C CG 1 ATOM 2565 C CD1 . LEU C 3 51 ? 24.879 -23.151 -28.223 1.00 13.99 ? 198 LEU C CD1 1 ATOM 2566 C CD2 . LEU C 3 51 ? 26.136 -25.276 -28.383 1.00 16.42 ? 198 LEU C CD2 1 ATOM 2567 N N . THR C 3 52 ? 27.161 -26.011 -24.082 1.00 14.20 ? 199 THR C N 1 ATOM 2568 C CA . THR C 3 52 ? 28.089 -25.779 -22.955 1.00 13.23 ? 199 THR C CA 1 ATOM 2569 C C . THR C 3 52 ? 29.463 -25.828 -23.564 1.00 13.28 ? 199 THR C C 1 ATOM 2570 O O . THR C 3 52 ? 29.572 -25.843 -24.777 1.00 14.22 ? 199 THR C O 1 ATOM 2571 C CB . THR C 3 52 ? 27.927 -26.788 -21.814 1.00 13.51 ? 199 THR C CB 1 ATOM 2572 O OG1 . THR C 3 52 ? 28.818 -26.434 -20.759 1.00 13.07 ? 199 THR C OG1 1 ATOM 2573 C CG2 . THR C 3 52 ? 28.222 -28.218 -22.249 1.00 13.15 ? 199 THR C CG2 1 ATOM 2574 N N . THR C 3 53 ? 30.518 -25.798 -22.778 1.00 12.92 ? 200 THR C N 1 ATOM 2575 C CA . THR C 3 53 ? 31.833 -25.859 -23.392 1.00 13.74 ? 200 THR C CA 1 ATOM 2576 C C . THR C 3 53 ? 32.451 -27.234 -23.290 1.00 13.47 ? 200 THR C C 1 ATOM 2577 O O . THR C 3 53 ? 32.093 -28.026 -22.423 1.00 13.97 ? 200 THR C O 1 ATOM 2578 C CB . THR C 3 53 ? 32.841 -24.854 -22.763 1.00 14.12 ? 200 THR C CB 1 ATOM 2579 O OG1 . THR C 3 53 ? 33.122 -25.195 -21.386 1.00 13.56 ? 200 THR C OG1 1 ATOM 2580 C CG2 . THR C 3 53 ? 32.325 -23.420 -22.821 1.00 14.52 ? 200 THR C CG2 1 ATOM 2581 N N . ALA C 3 54 ? 33.451 -27.448 -24.123 1.00 14.29 ? 201 ALA C N 1 ATOM 2582 C CA . ALA C 3 54 ? 34.178 -28.671 -24.124 1.00 16.35 ? 201 ALA C CA 1 ATOM 2583 C C . ALA C 3 54 ? 35.000 -28.751 -22.854 1.00 17.67 ? 201 ALA C C 1 ATOM 2584 O O . ALA C 3 54 ? 35.041 -29.822 -22.252 1.00 14.82 ? 201 ALA C O 1 ATOM 2585 C CB . ALA C 3 54 ? 35.073 -28.808 -25.332 1.00 15.75 ? 201 ALA C CB 1 ATOM 2586 N N . LYS C 3 55 ? 35.635 -27.650 -22.436 1.00 15.94 ? 202 LYS C N 1 ATOM 2587 C CA . LYS C 3 55 ? 36.376 -27.721 -21.192 1.00 16.53 ? 202 LYS C CA 1 ATOM 2588 C C . LYS C 3 55 ? 35.482 -28.115 -19.998 1.00 18.42 ? 202 LYS C C 1 ATOM 2589 O O . LYS C 3 55 ? 35.964 -28.773 -19.044 1.00 19.21 ? 202 LYS C O 1 ATOM 2590 C CB . LYS C 3 55 ? 37.032 -26.379 -20.888 1.00 19.59 ? 202 LYS C CB 1 ATOM 2591 C CG . LYS C 3 55 ? 38.190 -26.033 -21.856 1.00 23.06 ? 202 LYS C CG 1 ATOM 2592 C CD . LYS C 3 55 ? 38.937 -24.794 -21.423 1.00 25.07 ? 202 LYS C CD 1 ATOM 2593 C CE . LYS C 3 55 ? 39.832 -24.234 -22.505 1.00 26.76 ? 202 LYS C CE 1 ATOM 2594 N NZ . LYS C 3 55 ? 40.966 -25.164 -22.713 1.00 29.26 ? 202 LYS C NZ 1 ATOM 2595 N N . ASN C 3 56 ? 34.259 -27.600 -19.965 1.00 15.33 ? 203 ASN C N 1 ATOM 2596 C CA . ASN C 3 56 ? 33.321 -27.933 -18.878 1.00 15.74 ? 203 ASN C CA 1 ATOM 2597 C C . ASN C 3 56 ? 33.103 -29.443 -18.824 1.00 17.20 ? 203 ASN C C 1 ATOM 2598 O O . ASN C 3 56 ? 33.185 -30.043 -17.711 1.00 16.31 ? 203 ASN C O 1 ATOM 2599 C CB . ASN C 3 56 ? 31.969 -27.288 -19.057 1.00 15.67 ? 203 ASN C CB 1 ATOM 2600 C CG . ASN C 3 56 ? 31.951 -25.830 -18.692 1.00 14.59 ? 203 ASN C CG 1 ATOM 2601 O OD1 . ASN C 3 56 ? 32.951 -25.233 -18.240 1.00 13.51 ? 203 ASN C OD1 1 ATOM 2602 N ND2 . ASN C 3 56 ? 30.775 -25.258 -18.810 1.00 13.90 ? 203 ASN C ND2 1 ATOM 2603 N N . LEU C 3 57 ? 32.856 -30.022 -20.017 1.00 14.76 ? 204 LEU C N 1 ATOM 2604 C CA . LEU C 3 57 ? 32.599 -31.423 -20.166 1.00 15.39 ? 204 LEU C CA 1 ATOM 2605 C C . LEU C 3 57 ? 33.789 -32.304 -19.768 1.00 16.67 ? 204 LEU C C 1 ATOM 2606 O O . LEU C 3 57 ? 33.581 -33.376 -19.243 1.00 17.59 ? 204 LEU C O 1 ATOM 2607 C CB . LEU C 3 57 ? 32.210 -31.752 -21.604 1.00 14.09 ? 204 LEU C CB 1 ATOM 2608 C CG . LEU C 3 57 ? 30.857 -31.191 -22.007 1.00 13.55 ? 204 LEU C CG 1 ATOM 2609 C CD1 . LEU C 3 57 ? 30.558 -31.236 -23.519 1.00 13.60 ? 204 LEU C CD1 1 ATOM 2610 C CD2 . LEU C 3 57 ? 29.775 -31.895 -21.243 1.00 13.68 ? 204 LEU C CD2 1 ATOM 2611 N N . PHE C 3 58 ? 35.004 -31.846 -20.021 1.00 16.60 ? 205 PHE C N 1 ATOM 2612 C CA . PHE C 3 58 ? 36.215 -32.592 -19.649 1.00 19.37 ? 205 PHE C CA 1 ATOM 2613 C C . PHE C 3 58 ? 36.669 -32.527 -18.168 1.00 19.71 ? 205 PHE C C 1 ATOM 2614 O O . PHE C 3 58 ? 37.655 -33.213 -17.791 1.00 18.18 ? 205 PHE C O 1 ATOM 2615 C CB . PHE C 3 58 ? 37.402 -32.194 -20.568 1.00 18.27 ? 205 PHE C CB 1 ATOM 2616 C CG . PHE C 3 58 ? 37.403 -32.934 -21.855 1.00 18.20 ? 205 PHE C CG 1 ATOM 2617 C CD1 . PHE C 3 58 ? 37.958 -34.191 -21.939 1.00 17.71 ? 205 PHE C CD1 1 ATOM 2618 C CD2 . PHE C 3 58 ? 36.732 -32.441 -22.948 1.00 18.89 ? 205 PHE C CD2 1 ATOM 2619 C CE1 . PHE C 3 58 ? 37.919 -34.922 -23.105 1.00 16.65 ? 205 PHE C CE1 1 ATOM 2620 C CE2 . PHE C 3 58 ? 36.688 -33.154 -24.143 1.00 18.24 ? 205 PHE C CE2 1 ATOM 2621 C CZ . PHE C 3 58 ? 37.276 -34.407 -24.220 1.00 18.03 ? 205 PHE C CZ 1 ATOM 2622 N N . LEU C 3 59 ? 36.030 -31.704 -17.349 1.00 21.16 ? 206 LEU C N 1 ATOM 2623 C CA . LEU C 3 59 ? 36.482 -31.575 -15.945 1.00 20.32 ? 206 LEU C CA 1 ATOM 2624 C C . LEU C 3 59 ? 36.443 -32.975 -15.321 1.00 21.71 ? 206 LEU C C 1 ATOM 2625 O O . LEU C 3 59 ? 35.416 -33.711 -15.484 1.00 23.37 ? 206 LEU C O 1 ATOM 2626 C CB . LEU C 3 59 ? 35.532 -30.676 -15.179 1.00 22.60 ? 206 LEU C CB 1 ATOM 2627 C CG . LEU C 3 59 ? 35.638 -29.179 -15.533 1.00 23.84 ? 206 LEU C CG 1 ATOM 2628 C CD1 . LEU C 3 59 ? 34.674 -28.388 -14.679 1.00 25.31 ? 206 LEU C CD1 1 ATOM 2629 C CD2 . LEU C 3 59 ? 37.081 -28.679 -15.262 1.00 26.02 ? 206 LEU C CD2 1 ATOM 2630 N N . ASN C 3 60 ? 37.550 -33.375 -14.693 1.00 22.15 ? 207 ASN C N 1 ATOM 2631 C CA . ASN C 3 60 ? 37.654 -34.664 -13.973 1.00 21.60 ? 207 ASN C CA 1 ATOM 2632 C C . ASN C 3 60 ? 37.706 -35.847 -14.884 1.00 22.00 ? 207 ASN C C 1 ATOM 2633 O O . ASN C 3 60 ? 37.379 -36.912 -14.468 1.00 20.38 ? 207 ASN C O 1 ATOM 2634 C CB . ASN C 3 60 ? 36.542 -34.835 -12.910 1.00 21.33 ? 207 ASN C CB 1 ATOM 2635 C CG . ASN C 3 60 ? 36.822 -36.025 -11.883 1.00 23.62 ? 207 ASN C CG 1 ATOM 2636 O OD1 . ASN C 3 60 ? 37.918 -36.249 -11.290 1.00 26.25 ? 207 ASN C OD1 1 ATOM 2637 N ND2 . ASN C 3 60 ? 35.777 -36.769 -11.671 1.00 24.35 ? 207 ASN C ND2 1 ATOM 2638 N N . HIS C 3 61 ? 38.053 -35.630 -16.167 1.00 22.77 ? 208 HIS C N 1 ATOM 2639 C CA . HIS C 3 61 ? 38.275 -36.680 -17.127 1.00 20.55 ? 208 HIS C CA 1 ATOM 2640 C C . HIS C 3 61 ? 39.631 -36.555 -17.771 1.00 21.21 ? 208 HIS C C 1 ATOM 2641 O O . HIS C 3 61 ? 40.190 -35.468 -17.908 1.00 20.13 ? 208 HIS C O 1 ATOM 2642 C CB . HIS C 3 61 ? 37.232 -36.669 -18.254 1.00 20.72 ? 208 HIS C CB 1 ATOM 2643 C CG . HIS C 3 61 ? 35.898 -37.159 -17.837 1.00 21.19 ? 208 HIS C CG 1 ATOM 2644 N ND1 . HIS C 3 61 ? 35.568 -38.505 -17.829 1.00 23.85 ? 208 HIS C ND1 1 ATOM 2645 C CD2 . HIS C 3 61 ? 34.839 -36.499 -17.324 1.00 21.42 ? 208 HIS C CD2 1 ATOM 2646 C CE1 . HIS C 3 61 ? 34.330 -38.629 -17.386 1.00 23.56 ? 208 HIS C CE1 1 ATOM 2647 N NE2 . HIS C 3 61 ? 33.877 -37.431 -17.042 1.00 21.85 ? 208 HIS C NE2 1 ATOM 2648 N N . SER C 3 62 ? 40.088 -37.685 -18.230 1.00 22.10 ? 209 SER C N 1 ATOM 2649 C CA . SER C 3 62 ? 41.256 -37.801 -19.025 1.00 26.92 ? 209 SER C CA 1 ATOM 2650 C C . SER C 3 62 ? 41.046 -37.060 -20.352 1.00 26.82 ? 209 SER C C 1 ATOM 2651 O O . SER C 3 62 ? 39.945 -37.092 -20.956 1.00 22.19 ? 209 SER C O 1 ATOM 2652 C CB . SER C 3 62 ? 41.545 -39.281 -19.302 1.00 27.38 ? 209 SER C CB 1 ATOM 2653 O OG . SER C 3 62 ? 42.039 -39.418 -20.627 1.00 30.05 ? 209 SER C OG 1 ATOM 2654 N N . GLU C 3 63 ? 42.109 -36.394 -20.805 1.00 29.53 ? 210 GLU C N 1 ATOM 2655 C CA . GLU C 3 63 ? 42.042 -35.685 -22.083 1.00 35.78 ? 210 GLU C CA 1 ATOM 2656 C C . GLU C 3 63 ? 41.800 -36.672 -23.248 1.00 30.42 ? 210 GLU C C 1 ATOM 2657 O O . GLU C 3 63 ? 41.475 -36.237 -24.311 1.00 31.49 ? 210 GLU C O 1 ATOM 2658 C CB . GLU C 3 63 ? 43.256 -34.779 -22.311 1.00 38.32 ? 210 GLU C CB 1 ATOM 2659 C CG . GLU C 3 63 ? 44.525 -35.551 -22.569 1.00 45.69 ? 210 GLU C CG 1 ATOM 2660 C CD . GLU C 3 63 ? 45.772 -34.815 -22.088 1.00 49.64 ? 210 GLU C CD 1 ATOM 2661 O OE1 . GLU C 3 63 ? 45.704 -33.637 -21.623 1.00 57.08 ? 210 GLU C OE1 1 ATOM 2662 O OE2 . GLU C 3 63 ? 46.837 -35.446 -22.162 1.00 54.00 ? 210 GLU C OE2 1 ATOM 2663 N N . ASN C 3 64 ? 41.858 -37.984 -23.029 1.00 28.77 ? 211 ASN C N 1 ATOM 2664 C CA . ASN C 3 64 ? 41.346 -38.932 -24.003 1.00 26.83 ? 211 ASN C CA 1 ATOM 2665 C C . ASN C 3 64 ? 39.892 -39.453 -23.838 1.00 26.70 ? 211 ASN C C 1 ATOM 2666 O O . ASN C 3 64 ? 39.475 -40.309 -24.605 1.00 26.93 ? 211 ASN C O 1 ATOM 2667 C CB . ASN C 3 64 ? 42.272 -40.115 -24.093 1.00 32.25 ? 211 ASN C CB 1 ATOM 2668 C CG . ASN C 3 64 ? 43.613 -39.743 -24.621 1.00 35.46 ? 211 ASN C CG 1 ATOM 2669 O OD1 . ASN C 3 64 ? 43.758 -38.688 -25.232 1.00 33.90 ? 211 ASN C OD1 1 ATOM 2670 N ND2 . ASN C 3 64 ? 44.640 -40.560 -24.331 1.00 42.36 ? 211 ASN C ND2 1 ATOM 2671 N N . ALA C 3 65 ? 39.106 -38.979 -22.886 1.00 22.53 ? 212 ALA C N 1 ATOM 2672 C CA . ALA C 3 65 ? 37.727 -39.449 -22.788 1.00 23.01 ? 212 ALA C CA 1 ATOM 2673 C C . ALA C 3 65 ? 36.907 -39.095 -24.018 1.00 23.45 ? 212 ALA C C 1 ATOM 2674 O O . ALA C 3 65 ? 37.197 -38.140 -24.670 1.00 22.03 ? 212 ALA C O 1 ATOM 2675 C CB . ALA C 3 65 ? 37.071 -38.875 -21.553 1.00 23.43 ? 212 ALA C CB 1 ATOM 2676 N N . THR C 3 66 ? 35.903 -39.916 -24.323 1.00 24.30 ? 213 THR C N 1 ATOM 2677 C CA . THR C 3 66 ? 34.953 -39.716 -25.398 1.00 23.46 ? 213 THR C CA 1 ATOM 2678 C C . THR C 3 66 ? 33.623 -39.196 -24.802 1.00 21.72 ? 213 THR C C 1 ATOM 2679 O O . THR C 3 66 ? 33.477 -39.159 -23.604 1.00 19.54 ? 213 THR C O 1 ATOM 2680 C CB . THR C 3 66 ? 34.585 -41.072 -26.050 1.00 24.39 ? 213 THR C CB 1 ATOM 2681 O OG1 . THR C 3 66 ? 33.855 -41.872 -25.088 1.00 28.38 ? 213 THR C OG1 1 ATOM 2682 C CG2 . THR C 3 66 ? 35.793 -41.809 -26.455 1.00 26.24 ? 213 THR C CG2 1 ATOM 2683 N N . ALA C 3 67 ? 32.691 -38.781 -25.654 1.00 19.65 ? 214 ALA C N 1 ATOM 2684 C CA . ALA C 3 67 ? 31.363 -38.291 -25.233 1.00 20.95 ? 214 ALA C CA 1 ATOM 2685 C C . ALA C 3 67 ? 30.674 -39.353 -24.384 1.00 21.72 ? 214 ALA C C 1 ATOM 2686 O O . ALA C 3 67 ? 29.982 -39.018 -23.417 1.00 20.70 ? 214 ALA C O 1 ATOM 2687 C CB . ALA C 3 67 ? 30.482 -37.979 -26.440 1.00 18.73 ? 214 ALA C CB 1 ATOM 2688 N N . LYS C 3 68 ? 30.906 -40.616 -24.722 1.00 23.29 ? 215 LYS C N 1 ATOM 2689 C CA . LYS C 3 68 ? 30.277 -41.707 -23.984 1.00 26.50 ? 215 LYS C CA 1 ATOM 2690 C C . LYS C 3 68 ? 30.815 -41.886 -22.606 1.00 23.22 ? 215 LYS C C 1 ATOM 2691 O O . LYS C 3 68 ? 30.049 -42.161 -21.683 1.00 23.03 ? 215 LYS C O 1 ATOM 2692 C CB . LYS C 3 68 ? 30.328 -43.008 -24.777 1.00 31.08 ? 215 LYS C CB 1 ATOM 2693 C CG . LYS C 3 68 ? 29.351 -42.982 -25.933 1.00 41.88 ? 215 LYS C CG 1 ATOM 2694 C CD . LYS C 3 68 ? 27.894 -42.898 -25.415 1.00 51.51 ? 215 LYS C CD 1 ATOM 2695 C CE . LYS C 3 68 ? 26.797 -42.985 -26.491 1.00 58.50 ? 215 LYS C CE 1 ATOM 2696 N NZ . LYS C 3 68 ? 26.874 -44.255 -27.279 1.00 60.26 ? 215 LYS C NZ 1 ATOM 2697 N N . ASP C 3 69 ? 32.117 -41.712 -22.432 1.00 21.96 ? 216 ASP C N 1 ATOM 2698 C CA . ASP C 3 69 ? 32.689 -41.660 -21.089 1.00 22.44 ? 216 ASP C CA 1 ATOM 2699 C C . ASP C 3 69 ? 32.109 -40.504 -20.270 1.00 20.36 ? 216 ASP C C 1 ATOM 2700 O O . ASP C 3 69 ? 31.949 -40.597 -19.082 1.00 19.60 ? 216 ASP C O 1 ATOM 2701 C CB . ASP C 3 69 ? 34.203 -41.444 -21.144 1.00 25.02 ? 216 ASP C CB 1 ATOM 2702 C CG . ASP C 3 69 ? 34.941 -42.575 -21.867 1.00 30.19 ? 216 ASP C CG 1 ATOM 2703 O OD1 . ASP C 3 69 ? 34.390 -43.695 -21.845 1.00 31.16 ? 216 ASP C OD1 1 ATOM 2704 O OD2 . ASP C 3 69 ? 36.026 -42.326 -22.461 1.00 28.88 ? 216 ASP C OD2 1 ATOM 2705 N N . ILE C 3 70 ? 31.844 -39.381 -20.884 1.00 19.05 ? 217 ILE C N 1 ATOM 2706 C CA . ILE C 3 70 ? 31.621 -38.125 -20.081 1.00 18.78 ? 217 ILE C CA 1 ATOM 2707 C C . ILE C 3 70 ? 30.173 -38.068 -19.581 1.00 16.95 ? 217 ILE C C 1 ATOM 2708 O O . ILE C 3 70 ? 29.860 -37.801 -18.437 1.00 16.55 ? 217 ILE C O 1 ATOM 2709 C CB . ILE C 3 70 ? 31.941 -36.906 -20.962 1.00 19.75 ? 217 ILE C CB 1 ATOM 2710 C CG1 . ILE C 3 70 ? 33.483 -36.761 -21.128 1.00 22.71 ? 217 ILE C CG1 1 ATOM 2711 C CG2 . ILE C 3 70 ? 31.318 -35.654 -20.398 1.00 20.71 ? 217 ILE C CG2 1 ATOM 2712 C CD1 . ILE C 3 70 ? 33.890 -35.748 -22.221 1.00 24.91 ? 217 ILE C CD1 1 ATOM 2713 N N . ALA C 3 71 ? 29.303 -38.397 -20.501 1.00 16.92 ? 218 ALA C N 1 ATOM 2714 C CA . ALA C 3 71 ? 27.860 -38.174 -20.353 1.00 18.37 ? 218 ALA C CA 1 ATOM 2715 C C . ALA C 3 71 ? 27.219 -38.724 -19.051 1.00 17.27 ? 218 ALA C C 1 ATOM 2716 O O . ALA C 3 71 ? 26.505 -37.984 -18.359 1.00 17.82 ? 218 ALA C O 1 ATOM 2717 C CB . ALA C 3 71 ? 27.156 -38.751 -21.583 1.00 17.22 ? 218 ALA C CB 1 ATOM 2718 N N . PRO C 3 72 ? 27.511 -39.969 -18.699 1.00 17.50 ? 219 PRO C N 1 ATOM 2719 C CA . PRO C 3 72 ? 26.957 -40.545 -17.474 1.00 19.37 ? 219 PRO C CA 1 ATOM 2720 C C . PRO C 3 72 ? 27.649 -40.093 -16.197 1.00 20.23 ? 219 PRO C C 1 ATOM 2721 O O . PRO C 3 72 ? 27.265 -40.527 -15.128 1.00 19.13 ? 219 PRO C O 1 ATOM 2722 C CB . PRO C 3 72 ? 27.142 -42.046 -17.671 1.00 20.19 ? 219 PRO C CB 1 ATOM 2723 C CG . PRO C 3 72 ? 28.437 -42.094 -18.411 1.00 22.66 ? 219 PRO C CG 1 ATOM 2724 C CD . PRO C 3 72 ? 28.313 -40.957 -19.431 1.00 20.17 ? 219 PRO C CD 1 ATOM 2725 N N . THR C 3 73 ? 28.641 -39.205 -16.298 1.00 20.29 ? 220 THR C N 1 ATOM 2726 C CA . THR C 3 73 ? 29.271 -38.646 -15.091 1.00 19.56 ? 220 THR C CA 1 ATOM 2727 C C . THR C 3 73 ? 28.836 -37.248 -14.783 1.00 17.28 ? 220 THR C C 1 ATOM 2728 O O . THR C 3 73 ? 29.403 -36.671 -13.852 1.00 20.38 ? 220 THR C O 1 ATOM 2729 C CB . THR C 3 73 ? 30.797 -38.585 -15.233 1.00 17.92 ? 220 THR C CB 1 ATOM 2730 O OG1 . THR C 3 73 ? 31.141 -37.561 -16.173 1.00 17.26 ? 220 THR C OG1 1 ATOM 2731 C CG2 . THR C 3 73 ? 31.263 -39.946 -15.726 1.00 18.30 ? 220 THR C CG2 1 ATOM 2732 N N . LEU C 3 74 ? 27.867 -36.709 -15.524 0.71 16.00 ? 221 LEU C N 1 ATOM 2733 C CA . LEU C 3 74 ? 27.435 -35.329 -15.338 0.87 15.99 ? 221 LEU C CA 1 ATOM 2734 C C . LEU C 3 74 ? 26.106 -35.265 -14.633 0.86 18.01 ? 221 LEU C C 1 ATOM 2735 O O . LEU C 3 74 ? 25.282 -36.163 -14.791 0.84 17.46 ? 221 LEU C O 1 ATOM 2736 C CB . LEU C 3 74 ? 27.180 -34.635 -16.671 1.00 16.47 ? 221 LEU C CB 1 ATOM 2737 C CG . LEU C 3 74 ? 28.341 -34.590 -17.706 1.00 18.88 ? 221 LEU C CG 1 ATOM 2738 C CD1 . LEU C 3 74 ? 27.754 -34.074 -18.999 1.00 18.66 ? 221 LEU C CD1 1 ATOM 2739 C CD2 . LEU C 3 74 ? 29.546 -33.791 -17.281 1.00 18.77 ? 221 LEU C CD2 1 ATOM 2740 N N . THR C 3 75 ? 25.874 -34.179 -13.897 1.00 18.17 ? 222 THR C N 1 ATOM 2741 C CA . THR C 3 75 ? 24.576 -33.881 -13.405 1.00 19.64 ? 222 THR C CA 1 ATOM 2742 C C . THR C 3 75 ? 24.168 -32.541 -13.914 1.00 18.70 ? 222 THR C C 1 ATOM 2743 O O . THR C 3 75 ? 24.941 -31.579 -13.828 1.00 21.53 ? 222 THR C O 1 ATOM 2744 C CB . THR C 3 75 ? 24.529 -33.916 -11.850 1.00 22.60 ? 222 THR C CB 1 ATOM 2745 O OG1 . THR C 3 75 ? 25.055 -35.174 -11.367 1.00 27.89 ? 222 THR C OG1 1 ATOM 2746 C CG2 . THR C 3 75 ? 23.131 -33.704 -11.407 1.00 22.65 ? 222 THR C CG2 1 ATOM 2747 N N . LEU C 3 76 ? 22.902 -32.416 -14.323 1.00 19.51 ? 223 LEU C N 1 ATOM 2748 C CA . LEU C 3 76 ? 22.360 -31.177 -14.908 1.00 17.51 ? 223 LEU C CA 1 ATOM 2749 C C . LEU C 3 76 ? 21.013 -30.766 -14.318 1.00 16.65 ? 223 LEU C C 1 ATOM 2750 O O . LEU C 3 76 ? 20.141 -31.599 -14.128 1.00 13.51 ? 223 LEU C O 1 ATOM 2751 C CB . LEU C 3 76 ? 22.248 -31.435 -16.434 1.00 19.38 ? 223 LEU C CB 1 ATOM 2752 C CG . LEU C 3 76 ? 22.029 -30.261 -17.394 1.00 22.64 ? 223 LEU C CG 1 ATOM 2753 C CD1 . LEU C 3 76 ? 23.132 -29.222 -17.347 1.00 22.35 ? 223 LEU C CD1 1 ATOM 2754 C CD2 . LEU C 3 76 ? 21.882 -30.654 -18.860 1.00 22.04 ? 223 LEU C CD2 1 ATOM 2755 N N . TYR C 3 77 ? 20.849 -29.466 -14.027 1.00 15.34 ? 224 TYR C N 1 ATOM 2756 C CA . TYR C 3 77 ? 19.623 -28.914 -13.550 1.00 14.68 ? 224 TYR C CA 1 ATOM 2757 C C . TYR C 3 77 ? 19.197 -27.726 -14.348 1.00 15.52 ? 224 TYR C C 1 ATOM 2758 O O . TYR C 3 77 ? 20.014 -26.983 -14.830 1.00 13.79 ? 224 TYR C O 1 ATOM 2759 C CB . TYR C 3 77 ? 19.874 -28.379 -12.154 1.00 15.43 ? 224 TYR C CB 1 ATOM 2760 C CG . TYR C 3 77 ? 20.436 -29.385 -11.142 1.00 15.73 ? 224 TYR C CG 1 ATOM 2761 C CD1 . TYR C 3 77 ? 21.808 -29.544 -10.987 1.00 17.46 ? 224 TYR C CD1 1 ATOM 2762 C CD2 . TYR C 3 77 ? 19.582 -30.145 -10.316 1.00 16.31 ? 224 TYR C CD2 1 ATOM 2763 C CE1 . TYR C 3 77 ? 22.355 -30.390 -9.989 1.00 18.71 ? 224 TYR C CE1 1 ATOM 2764 C CE2 . TYR C 3 77 ? 20.099 -31.028 -9.347 1.00 16.89 ? 224 TYR C CE2 1 ATOM 2765 C CZ . TYR C 3 77 ? 21.478 -31.134 -9.172 1.00 17.27 ? 224 TYR C CZ 1 ATOM 2766 O OH . TYR C 3 77 ? 22.031 -31.967 -8.244 1.00 19.00 ? 224 TYR C OH 1 ATOM 2767 N N . VAL C 3 78 ? 17.891 -27.515 -14.402 1.00 15.73 ? 225 VAL C N 1 ATOM 2768 C CA . VAL C 3 78 ? 17.267 -26.364 -15.014 1.00 16.81 ? 225 VAL C CA 1 ATOM 2769 C C . VAL C 3 78 ? 16.247 -25.884 -13.991 1.00 18.89 ? 225 VAL C C 1 ATOM 2770 O O . VAL C 3 78 ? 15.961 -26.573 -13.002 1.00 17.67 ? 225 VAL C O 1 ATOM 2771 C CB . VAL C 3 78 ? 16.575 -26.706 -16.304 1.00 17.34 ? 225 VAL C CB 1 ATOM 2772 C CG1 . VAL C 3 78 ? 17.571 -27.272 -17.312 1.00 19.86 ? 225 VAL C CG1 1 ATOM 2773 C CG2 . VAL C 3 78 ? 15.416 -27.701 -16.069 1.00 17.46 ? 225 VAL C CG2 1 ATOM 2774 N N . GLY C 3 79 ? 15.746 -24.669 -14.206 1.00 18.93 ? 226 GLY C N 1 ATOM 2775 C CA . GLY C 3 79 ? 14.781 -24.074 -13.327 1.00 21.00 ? 226 GLY C CA 1 ATOM 2776 C C . GLY C 3 79 ? 15.112 -24.060 -11.867 1.00 22.96 ? 226 GLY C C 1 ATOM 2777 O O . GLY C 3 79 ? 16.218 -23.682 -11.492 1.00 21.60 ? 226 GLY C O 1 ATOM 2778 N N . LYS C 3 80 ? 14.116 -24.385 -11.035 1.00 25.65 ? 227 LYS C N 1 ATOM 2779 C CA . LYS C 3 80 ? 14.295 -24.391 -9.583 1.00 30.26 ? 227 LYS C CA 1 ATOM 2780 C C . LYS C 3 80 ? 14.892 -25.735 -9.162 1.00 27.66 ? 227 LYS C C 1 ATOM 2781 O O . LYS C 3 80 ? 14.184 -26.645 -8.788 1.00 30.72 ? 227 LYS C O 1 ATOM 2782 C CB . LYS C 3 80 ? 12.950 -24.107 -8.868 1.00 38.38 ? 227 LYS C CB 1 ATOM 2783 C CG . LYS C 3 80 ? 13.013 -23.912 -7.324 1.00 45.88 ? 227 LYS C CG 1 ATOM 2784 C CD . LYS C 3 80 ? 11.630 -24.114 -6.663 1.00 53.20 ? 227 LYS C CD 1 ATOM 2785 C CE . LYS C 3 80 ? 11.505 -23.604 -5.225 1.00 54.71 ? 227 LYS C CE 1 ATOM 2786 N NZ . LYS C 3 80 ? 12.438 -24.285 -4.284 1.00 55.89 ? 227 LYS C NZ 1 ATOM 2787 N N . LYS C 3 81 ? 16.195 -25.872 -9.278 1.00 28.02 ? 228 LYS C N 1 ATOM 2788 C CA . LYS C 3 81 ? 16.894 -27.145 -8.993 1.00 31.11 ? 228 LYS C CA 1 ATOM 2789 C C . LYS C 3 81 ? 16.238 -28.439 -9.548 1.00 26.30 ? 228 LYS C C 1 ATOM 2790 O O . LYS C 3 81 ? 16.205 -29.456 -8.876 1.00 25.83 ? 228 LYS C O 1 ATOM 2791 C CB . LYS C 3 81 ? 17.047 -27.289 -7.491 1.00 38.00 ? 228 LYS C CB 1 ATOM 2792 C CG . LYS C 3 81 ? 18.016 -26.315 -6.835 1.00 45.78 ? 228 LYS C CG 1 ATOM 2793 C CD . LYS C 3 81 ? 18.561 -26.948 -5.544 1.00 52.07 ? 228 LYS C CD 1 ATOM 2794 C CE . LYS C 3 81 ? 18.726 -25.947 -4.400 1.00 54.26 ? 228 LYS C CE 1 ATOM 2795 N NZ . LYS C 3 81 ? 20.084 -25.342 -4.493 1.00 59.60 ? 228 LYS C NZ 1 ATOM 2796 N N . GLN C 3 82 ? 15.761 -28.391 -10.784 1.00 26.49 ? 229 GLN C N 1 ATOM 2797 C CA . GLN C 3 82 ? 15.178 -29.556 -11.479 1.00 23.83 ? 229 GLN C CA 1 ATOM 2798 C C . GLN C 3 82 ? 16.194 -30.416 -12.250 1.00 21.53 ? 229 GLN C C 1 ATOM 2799 O O . GLN C 3 82 ? 16.603 -30.081 -13.371 1.00 17.48 ? 229 GLN C O 1 ATOM 2800 C CB . GLN C 3 82 ? 14.057 -29.113 -12.397 1.00 26.90 ? 229 GLN C CB 1 ATOM 2801 C CG . GLN C 3 82 ? 12.851 -28.537 -11.637 1.00 35.96 ? 229 GLN C CG 1 ATOM 2802 C CD . GLN C 3 82 ? 12.122 -29.588 -10.774 1.00 45.94 ? 229 GLN C CD 1 ATOM 2803 O OE1 . GLN C 3 82 ? 12.270 -29.596 -9.548 1.00 59.57 ? 229 GLN C OE1 1 ATOM 2804 N NE2 . GLN C 3 82 ? 11.328 -30.478 -11.411 1.00 52.87 ? 229 GLN C NE2 1 ATOM 2805 N N . LEU C 3 83 ? 16.566 -31.543 -11.659 1.00 17.89 ? 230 LEU C N 1 ATOM 2806 C CA . LEU C 3 83 ? 17.458 -32.473 -12.338 1.00 18.94 ? 230 LEU C CA 1 ATOM 2807 C C . LEU C 3 83 ? 16.823 -32.961 -13.639 1.00 18.59 ? 230 LEU C C 1 ATOM 2808 O O . LEU C 3 83 ? 15.716 -33.505 -13.665 1.00 17.95 ? 230 LEU C O 1 ATOM 2809 C CB . LEU C 3 83 ? 17.888 -33.624 -11.411 1.00 17.51 ? 230 LEU C CB 1 ATOM 2810 C CG . LEU C 3 83 ? 18.877 -34.647 -11.964 1.00 16.78 ? 230 LEU C CG 1 ATOM 2811 C CD1 . LEU C 3 83 ? 19.647 -35.232 -10.777 1.00 17.31 ? 230 LEU C CD1 1 ATOM 2812 C CD2 . LEU C 3 83 ? 18.297 -35.813 -12.779 1.00 17.03 ? 230 LEU C CD2 1 ATOM 2813 N N . VAL C 3 84 ? 17.526 -32.794 -14.731 1.00 16.66 ? 231 VAL C N 1 ATOM 2814 C CA . VAL C 3 84 ? 17.118 -33.407 -15.968 1.00 16.38 ? 231 VAL C CA 1 ATOM 2815 C C . VAL C 3 84 ? 18.095 -34.479 -16.390 1.00 16.62 ? 231 VAL C C 1 ATOM 2816 O O . VAL C 3 84 ? 19.311 -34.338 -16.241 1.00 15.75 ? 231 VAL C O 1 ATOM 2817 C CB . VAL C 3 84 ? 16.927 -32.356 -17.075 1.00 17.92 ? 231 VAL C CB 1 ATOM 2818 C CG1 . VAL C 3 84 ? 15.792 -31.432 -16.709 1.00 17.56 ? 231 VAL C CG1 1 ATOM 2819 C CG2 . VAL C 3 84 ? 18.175 -31.556 -17.332 1.00 18.71 ? 231 VAL C CG2 1 ATOM 2820 N N . GLU C 3 85 ? 17.584 -35.547 -16.991 1.00 16.09 ? 232 GLU C N 1 ATOM 2821 C CA . GLU C 3 85 ? 18.439 -36.640 -17.383 1.00 17.18 ? 232 GLU C CA 1 ATOM 2822 C C . GLU C 3 85 ? 18.980 -36.438 -18.796 1.00 17.57 ? 232 GLU C C 1 ATOM 2823 O O . GLU C 3 85 ? 18.243 -36.099 -19.689 1.00 17.45 ? 232 GLU C O 1 ATOM 2824 C CB . GLU C 3 85 ? 17.649 -37.975 -17.325 1.00 19.53 ? 232 GLU C CB 1 ATOM 2825 C CG . GLU C 3 85 ? 17.281 -38.430 -15.906 1.00 19.24 ? 232 GLU C CG 1 ATOM 2826 C CD . GLU C 3 85 ? 16.526 -39.793 -15.872 1.00 22.99 ? 232 GLU C CD 1 ATOM 2827 O OE1 . GLU C 3 85 ? 15.615 -40.022 -15.004 1.00 23.28 ? 232 GLU C OE1 1 ATOM 2828 O OE2 . GLU C 3 85 ? 16.900 -40.674 -16.664 1.00 21.29 ? 232 GLU C OE2 1 ATOM 2829 N N . ILE C 3 86 ? 20.266 -36.705 -18.970 1.00 16.60 ? 233 ILE C N 1 ATOM 2830 C CA . ILE C 3 86 ? 20.948 -36.567 -20.216 1.00 17.91 ? 233 ILE C CA 1 ATOM 2831 C C . ILE C 3 86 ? 20.953 -37.874 -21.019 1.00 17.37 ? 233 ILE C C 1 ATOM 2832 O O . ILE C 3 86 ? 21.239 -38.936 -20.477 1.00 19.82 ? 233 ILE C O 1 ATOM 2833 C CB . ILE C 3 86 ? 22.412 -36.138 -19.913 1.00 17.34 ? 233 ILE C CB 1 ATOM 2834 C CG1 . ILE C 3 86 ? 22.414 -34.745 -19.267 1.00 17.10 ? 233 ILE C CG1 1 ATOM 2835 C CG2 . ILE C 3 86 ? 23.282 -36.147 -21.188 1.00 16.82 ? 233 ILE C CG2 1 ATOM 2836 C CD1 . ILE C 3 86 ? 23.813 -34.369 -18.680 1.00 19.61 ? 233 ILE C CD1 1 ATOM 2837 N N . GLU C 3 87 ? 20.674 -37.782 -22.304 1.00 17.71 ? 234 GLU C N 1 ATOM 2838 C CA . GLU C 3 87 ? 20.747 -38.919 -23.201 1.00 19.12 ? 234 GLU C CA 1 ATOM 2839 C C . GLU C 3 87 ? 22.166 -39.042 -23.757 1.00 19.43 ? 234 GLU C C 1 ATOM 2840 O O . GLU C 3 87 ? 22.732 -40.099 -23.775 1.00 18.51 ? 234 GLU C O 1 ATOM 2841 C CB . GLU C 3 87 ? 19.806 -38.669 -24.374 1.00 21.07 ? 234 GLU C CB 1 ATOM 2842 C CG . GLU C 3 87 ? 19.923 -39.738 -25.467 1.00 25.63 ? 234 GLU C CG 1 ATOM 2843 C CD . GLU C 3 87 ? 18.706 -39.702 -26.408 1.00 29.25 ? 234 GLU C CD 1 ATOM 2844 O OE1 . GLU C 3 87 ? 18.857 -39.817 -27.635 1.00 35.85 ? 234 GLU C OE1 1 ATOM 2845 O OE2 . GLU C 3 87 ? 17.586 -39.508 -25.912 1.00 32.68 ? 234 GLU C OE2 1 ATOM 2846 N N . LYS C 3 88 ? 22.715 -37.971 -24.332 1.00 19.93 ? 235 LYS C N 1 ATOM 2847 C CA . LYS C 3 88 ? 24.119 -37.977 -24.738 1.00 19.35 ? 235 LYS C CA 1 ATOM 2848 C C . LYS C 3 88 ? 24.798 -36.623 -24.845 1.00 17.09 ? 235 LYS C C 1 ATOM 2849 O O . LYS C 3 88 ? 24.161 -35.607 -24.799 1.00 14.41 ? 235 LYS C O 1 ATOM 2850 C CB . LYS C 3 88 ? 24.263 -38.619 -26.095 1.00 24.09 ? 235 LYS C CB 1 ATOM 2851 C CG . LYS C 3 88 ? 23.638 -37.813 -27.183 1.00 27.25 ? 235 LYS C CG 1 ATOM 2852 C CD . LYS C 3 88 ? 23.818 -38.552 -28.509 1.00 31.84 ? 235 LYS C CD 1 ATOM 2853 C CE . LYS C 3 88 ? 22.679 -38.139 -29.411 1.00 36.80 ? 235 LYS C CE 1 ATOM 2854 N NZ . LYS C 3 88 ? 21.990 -39.329 -30.056 1.00 43.10 ? 235 LYS C NZ 1 ATOM 2855 N N . VAL C 3 89 ? 26.084 -36.666 -25.133 1.00 15.94 ? 236 VAL C N 1 ATOM 2856 C CA . VAL C 3 89 ? 26.866 -35.457 -25.302 1.00 17.65 ? 236 VAL C CA 1 ATOM 2857 C C . VAL C 3 89 ? 27.467 -35.524 -26.683 1.00 17.89 ? 236 VAL C C 1 ATOM 2858 O O . VAL C 3 89 ? 27.798 -36.633 -27.117 1.00 16.12 ? 236 VAL C O 1 ATOM 2859 C CB . VAL C 3 89 ? 27.925 -35.459 -24.192 1.00 17.16 ? 236 VAL C CB 1 ATOM 2860 C CG1 . VAL C 3 89 ? 29.136 -34.682 -24.558 1.00 20.92 ? 236 VAL C CG1 1 ATOM 2861 C CG2 . VAL C 3 89 ? 27.287 -34.928 -22.924 1.00 17.35 ? 236 VAL C CG2 1 ATOM 2862 N N . VAL C 3 90 ? 27.537 -34.358 -27.392 1.00 16.31 ? 237 VAL C N 1 ATOM 2863 C CA . VAL C 3 90 ? 28.226 -34.316 -28.645 1.00 18.38 ? 237 VAL C CA 1 ATOM 2864 C C . VAL C 3 90 ? 29.329 -33.237 -28.622 1.00 18.09 ? 237 VAL C C 1 ATOM 2865 O O . VAL C 3 90 ? 29.025 -32.079 -28.569 1.00 19.02 ? 237 VAL C O 1 ATOM 2866 C CB . VAL C 3 90 ? 27.330 -34.101 -29.870 1.00 18.51 ? 237 VAL C CB 1 ATOM 2867 C CG1 . VAL C 3 90 ? 28.213 -34.194 -31.155 1.00 18.65 ? 237 VAL C CG1 1 ATOM 2868 C CG2 . VAL C 3 90 ? 26.250 -35.168 -29.945 1.00 18.23 ? 237 VAL C CG2 1 ATOM 2869 N N . LEU C 3 91 ? 30.580 -33.636 -28.724 1.00 17.40 ? 238 LEU C N 1 ATOM 2870 C CA . LEU C 3 91 ? 31.693 -32.689 -28.679 1.00 19.54 ? 238 LEU C CA 1 ATOM 2871 C C . LEU C 3 91 ? 31.867 -31.998 -30.019 1.00 18.67 ? 238 LEU C C 1 ATOM 2872 O O . LEU C 3 91 ? 31.695 -32.618 -31.045 1.00 17.44 ? 238 LEU C O 1 ATOM 2873 C CB . LEU C 3 91 ? 32.982 -33.395 -28.262 1.00 19.78 ? 238 LEU C CB 1 ATOM 2874 C CG . LEU C 3 91 ? 33.080 -33.720 -26.745 1.00 19.13 ? 238 LEU C CG 1 ATOM 2875 C CD1 . LEU C 3 91 ? 34.231 -34.637 -26.528 1.00 18.82 ? 238 LEU C CD1 1 ATOM 2876 C CD2 . LEU C 3 91 ? 33.313 -32.504 -25.875 1.00 19.45 ? 238 LEU C CD2 1 ATOM 2877 N N . HIS C 3 92 ? 32.186 -30.708 -30.035 1.00 16.58 ? 239 HIS C N 1 ATOM 2878 C CA . HIS C 3 92 ? 32.482 -30.099 -31.302 1.00 16.84 ? 239 HIS C CA 1 ATOM 2879 C C . HIS C 3 92 ? 33.692 -30.818 -31.936 1.00 16.64 ? 239 HIS C C 1 ATOM 2880 O O . HIS C 3 92 ? 34.660 -31.115 -31.304 1.00 14.99 ? 239 HIS C O 1 ATOM 2881 C CB . HIS C 3 92 ? 32.800 -28.603 -31.159 1.00 16.29 ? 239 HIS C CB 1 ATOM 2882 C CG . HIS C 3 92 ? 32.790 -27.888 -32.471 1.00 15.90 ? 239 HIS C CG 1 ATOM 2883 N ND1 . HIS C 3 92 ? 33.865 -27.903 -33.322 1.00 15.58 ? 239 HIS C ND1 1 ATOM 2884 C CD2 . HIS C 3 92 ? 31.858 -27.128 -33.068 1.00 16.24 ? 239 HIS C CD2 1 ATOM 2885 C CE1 . HIS C 3 92 ? 33.601 -27.175 -34.382 1.00 15.35 ? 239 HIS C CE1 1 ATOM 2886 N NE2 . HIS C 3 92 ? 32.381 -26.693 -34.260 1.00 14.43 ? 239 HIS C NE2 1 ATOM 2887 N N . PRO C 3 93 ? 33.659 -31.076 -33.220 1.00 18.31 ? 240 PRO C N 1 ATOM 2888 C CA . PRO C 3 93 ? 34.804 -31.909 -33.719 1.00 19.34 ? 240 PRO C CA 1 ATOM 2889 C C . PRO C 3 93 ? 36.101 -31.159 -33.745 1.00 18.42 ? 240 PRO C C 1 ATOM 2890 O O . PRO C 3 93 ? 37.136 -31.739 -33.738 1.00 19.09 ? 240 PRO C O 1 ATOM 2891 C CB . PRO C 3 93 ? 34.370 -32.266 -35.186 1.00 21.98 ? 240 PRO C CB 1 ATOM 2892 C CG . PRO C 3 93 ? 33.320 -31.249 -35.510 1.00 19.73 ? 240 PRO C CG 1 ATOM 2893 C CD . PRO C 3 93 ? 32.596 -30.948 -34.212 1.00 19.83 ? 240 PRO C CD 1 ATOM 2894 N N . ASN C 3 94 ? 36.076 -29.840 -33.729 1.00 17.48 ? 241 ASN C N 1 ATOM 2895 C CA . ASN C 3 94 ? 37.290 -29.093 -33.499 1.00 19.07 ? 241 ASN C CA 1 ATOM 2896 C C . ASN C 3 94 ? 37.301 -28.321 -32.185 1.00 18.99 ? 241 ASN C C 1 ATOM 2897 O O . ASN C 3 94 ? 37.564 -27.104 -32.148 1.00 17.27 ? 241 ASN C O 1 ATOM 2898 C CB . ASN C 3 94 ? 37.463 -28.113 -34.654 1.00 20.09 ? 241 ASN C CB 1 ATOM 2899 C CG . ASN C 3 94 ? 37.445 -28.805 -36.004 1.00 20.51 ? 241 ASN C CG 1 ATOM 2900 O OD1 . ASN C 3 94 ? 38.062 -29.848 -36.179 1.00 19.97 ? 241 ASN C OD1 1 ATOM 2901 N ND2 . ASN C 3 94 ? 36.742 -28.219 -36.956 1.00 21.41 ? 241 ASN C ND2 1 ATOM 2902 N N . TYR C 3 95 ? 37.031 -29.029 -31.097 1.00 17.42 ? 242 TYR C N 1 ATOM 2903 C CA . TYR C 3 95 ? 36.866 -28.344 -29.822 1.00 16.88 ? 242 TYR C CA 1 ATOM 2904 C C . TYR C 3 95 ? 38.097 -27.612 -29.232 1.00 17.84 ? 242 TYR C C 1 ATOM 2905 O O . TYR C 3 95 ? 37.909 -26.777 -28.348 1.00 19.22 ? 242 TYR C O 1 ATOM 2906 C CB . TYR C 3 95 ? 36.171 -29.265 -28.797 1.00 16.67 ? 242 TYR C CB 1 ATOM 2907 C CG . TYR C 3 95 ? 36.974 -30.441 -28.356 1.00 18.46 ? 242 TYR C CG 1 ATOM 2908 C CD1 . TYR C 3 95 ? 37.976 -30.318 -27.403 1.00 19.13 ? 242 TYR C CD1 1 ATOM 2909 C CD2 . TYR C 3 95 ? 36.723 -31.687 -28.880 1.00 20.23 ? 242 TYR C CD2 1 ATOM 2910 C CE1 . TYR C 3 95 ? 38.687 -31.418 -26.974 1.00 20.67 ? 242 TYR C CE1 1 ATOM 2911 C CE2 . TYR C 3 95 ? 37.412 -32.796 -28.435 1.00 20.86 ? 242 TYR C CE2 1 ATOM 2912 C CZ . TYR C 3 95 ? 38.373 -32.640 -27.479 1.00 21.00 ? 242 TYR C CZ 1 ATOM 2913 O OH . TYR C 3 95 ? 39.030 -33.749 -27.143 1.00 22.68 ? 242 TYR C OH 1 ATOM 2914 N N . SER C 3 96 ? 39.322 -27.887 -29.706 1.00 18.69 ? 243 SER C N 1 ATOM 2915 C CA . SER C 3 96 ? 40.501 -27.095 -29.313 1.00 18.39 ? 243 SER C CA 1 ATOM 2916 C C . SER C 3 96 ? 40.480 -25.699 -29.946 1.00 18.31 ? 243 SER C C 1 ATOM 2917 O O . SER C 3 96 ? 41.187 -24.822 -29.527 1.00 14.92 ? 243 SER C O 1 ATOM 2918 C CB . SER C 3 96 ? 41.815 -27.806 -29.672 1.00 18.25 ? 243 SER C CB 1 ATOM 2919 O OG . SER C 3 96 ? 41.922 -29.073 -29.018 1.00 20.03 ? 243 SER C OG 1 ATOM 2920 N N . GLN C 3 97 ? 39.670 -25.503 -30.984 1.00 17.98 ? 244 GLN C N 1 ATOM 2921 C CA . GLN C 3 97 ? 39.567 -24.210 -31.594 1.00 17.98 ? 244 GLN C CA 1 ATOM 2922 C C . GLN C 3 97 ? 38.222 -23.529 -31.222 1.00 16.60 ? 244 GLN C C 1 ATOM 2923 O O . GLN C 3 97 ? 38.182 -22.343 -31.027 1.00 14.82 ? 244 GLN C O 1 ATOM 2924 C CB . GLN C 3 97 ? 39.621 -24.405 -33.110 1.00 19.18 ? 244 GLN C CB 1 ATOM 2925 C CG . GLN C 3 97 ? 39.469 -23.184 -33.965 1.00 20.44 ? 244 GLN C CG 1 ATOM 2926 C CD . GLN C 3 97 ? 39.325 -23.530 -35.447 1.00 20.75 ? 244 GLN C CD 1 ATOM 2927 O OE1 . GLN C 3 97 ? 38.869 -24.617 -35.805 1.00 23.17 ? 244 GLN C OE1 1 ATOM 2928 N NE2 . GLN C 3 97 ? 39.686 -22.599 -36.302 1.00 21.06 ? 244 GLN C NE2 1 ATOM 2929 N N . VAL C 3 98 ? 37.151 -24.316 -31.203 1.00 15.89 ? 245 VAL C N 1 ATOM 2930 C CA . VAL C 3 98 ? 35.780 -23.889 -30.902 1.00 17.09 ? 245 VAL C CA 1 ATOM 2931 C C . VAL C 3 98 ? 35.315 -24.660 -29.647 1.00 14.63 ? 245 VAL C C 1 ATOM 2932 O O . VAL C 3 98 ? 34.891 -25.835 -29.756 1.00 13.39 ? 245 VAL C O 1 ATOM 2933 C CB . VAL C 3 98 ? 34.847 -24.300 -32.076 1.00 19.77 ? 245 VAL C CB 1 ATOM 2934 C CG1 . VAL C 3 98 ? 33.525 -23.758 -31.799 1.00 22.34 ? 245 VAL C CG1 1 ATOM 2935 C CG2 . VAL C 3 98 ? 35.383 -23.805 -33.396 1.00 21.67 ? 245 VAL C CG2 1 ATOM 2936 N N . ASP C 3 99 ? 35.433 -23.993 -28.495 1.00 14.29 ? 246 ASP C N 1 ATOM 2937 C CA . ASP C 3 99 ? 35.274 -24.604 -27.152 1.00 14.79 ? 246 ASP C CA 1 ATOM 2938 C C . ASP C 3 99 ? 33.832 -24.943 -26.776 1.00 13.79 ? 246 ASP C C 1 ATOM 2939 O O . ASP C 3 99 ? 33.232 -24.292 -26.001 1.00 12.76 ? 246 ASP C O 1 ATOM 2940 C CB . ASP C 3 99 ? 35.873 -23.662 -26.085 1.00 14.86 ? 246 ASP C CB 1 ATOM 2941 C CG . ASP C 3 99 ? 35.921 -24.321 -24.681 1.00 15.10 ? 246 ASP C CG 1 ATOM 2942 O OD1 . ASP C 3 99 ? 35.880 -25.575 -24.564 1.00 16.43 ? 246 ASP C OD1 1 ATOM 2943 O OD2 . ASP C 3 99 ? 36.052 -23.569 -23.710 1.00 14.48 ? 246 ASP C OD2 1 ATOM 2944 N N . ILE C 3 100 ? 33.301 -26.004 -27.373 1.00 14.84 ? 247 ILE C N 1 ATOM 2945 C CA . ILE C 3 100 ? 31.913 -26.243 -27.386 1.00 16.24 ? 247 ILE C CA 1 ATOM 2946 C C . ILE C 3 100 ? 31.589 -27.714 -27.343 1.00 15.46 ? 247 ILE C C 1 ATOM 2947 O O . ILE C 3 100 ? 32.250 -28.555 -28.014 1.00 13.30 ? 247 ILE C O 1 ATOM 2948 C CB . ILE C 3 100 ? 31.285 -25.618 -28.635 1.00 15.90 ? 247 ILE C CB 1 ATOM 2949 C CG1 . ILE C 3 100 ? 31.238 -24.070 -28.513 1.00 17.45 ? 247 ILE C CG1 1 ATOM 2950 C CG2 . ILE C 3 100 ? 29.904 -26.186 -28.901 1.00 17.94 ? 247 ILE C CG2 1 ATOM 2951 C CD1 . ILE C 3 100 ? 30.196 -23.430 -27.607 1.00 17.63 ? 247 ILE C CD1 1 ATOM 2952 N N . GLY C 3 101 ? 30.508 -27.966 -26.607 1.00 15.91 ? 248 GLY C N 1 ATOM 2953 C CA . GLY C 3 101 ? 29.756 -29.223 -26.776 1.00 15.69 ? 248 GLY C CA 1 ATOM 2954 C C . GLY C 3 101 ? 28.271 -29.073 -26.747 1.00 15.20 ? 248 GLY C C 1 ATOM 2955 O O . GLY C 3 101 ? 27.775 -28.086 -26.211 1.00 15.69 ? 248 GLY C O 1 ATOM 2956 N N . LEU C 3 102 ? 27.534 -30.059 -27.270 1.00 14.66 ? 249 LEU C N 1 ATOM 2957 C CA . LEU C 3 102 ? 26.085 -30.046 -27.073 1.00 16.38 ? 249 LEU C CA 1 ATOM 2958 C C . LEU C 3 102 ? 25.675 -31.165 -26.121 1.00 18.14 ? 249 LEU C C 1 ATOM 2959 O O . LEU C 3 102 ? 26.261 -32.262 -26.161 1.00 17.33 ? 249 LEU C O 1 ATOM 2960 C CB . LEU C 3 102 ? 25.321 -30.281 -28.393 1.00 15.96 ? 249 LEU C CB 1 ATOM 2961 C CG . LEU C 3 102 ? 25.324 -29.108 -29.385 1.00 15.28 ? 249 LEU C CG 1 ATOM 2962 C CD1 . LEU C 3 102 ? 24.983 -29.527 -30.812 1.00 15.37 ? 249 LEU C CD1 1 ATOM 2963 C CD2 . LEU C 3 102 ? 24.325 -28.089 -28.902 1.00 16.22 ? 249 LEU C CD2 1 ATOM 2964 N N . ILE C 3 103 ? 24.575 -30.898 -25.407 1.00 16.91 ? 250 ILE C N 1 ATOM 2965 C CA . ILE C 3 103 ? 24.020 -31.869 -24.507 1.00 18.82 ? 250 ILE C CA 1 ATOM 2966 C C . ILE C 3 103 ? 22.618 -32.215 -24.983 1.00 16.75 ? 250 ILE C C 1 ATOM 2967 O O . ILE C 3 103 ? 21.821 -31.320 -25.161 1.00 15.69 ? 250 ILE C O 1 ATOM 2968 C CB . ILE C 3 103 ? 23.949 -31.332 -23.094 1.00 17.29 ? 250 ILE C CB 1 ATOM 2969 C CG1 . ILE C 3 103 ? 25.368 -31.055 -22.571 1.00 18.85 ? 250 ILE C CG1 1 ATOM 2970 C CG2 . ILE C 3 103 ? 23.137 -32.293 -22.191 1.00 18.50 ? 250 ILE C CG2 1 ATOM 2971 C CD1 . ILE C 3 103 ? 25.359 -30.349 -21.233 1.00 18.05 ? 250 ILE C CD1 1 ATOM 2972 N N . LYS C 3 104 ? 22.326 -33.488 -25.216 1.00 16.20 ? 251 LYS C N 1 ATOM 2973 C CA . LYS C 3 104 ? 20.885 -33.903 -25.517 1.00 16.02 ? 251 LYS C CA 1 ATOM 2974 C C . LYS C 3 104 ? 20.172 -34.533 -24.328 1.00 15.11 ? 251 LYS C C 1 ATOM 2975 O O . LYS C 3 104 ? 20.670 -35.453 -23.737 1.00 17.98 ? 251 LYS C O 1 ATOM 2976 C CB . LYS C 3 104 ? 20.797 -34.810 -26.763 1.00 16.91 ? 251 LYS C CB 1 ATOM 2977 C CG . LYS C 3 104 ? 19.354 -35.113 -27.205 1.00 20.51 ? 251 LYS C CG 1 ATOM 2978 C CD . LYS C 3 104 ? 19.274 -36.222 -28.275 1.00 21.27 ? 251 LYS C CD 1 ATOM 2979 C CE . LYS C 3 104 ? 17.800 -36.529 -28.608 1.00 24.24 ? 251 LYS C CE 1 ATOM 2980 N NZ . LYS C 3 104 ? 17.675 -37.663 -29.539 1.00 25.56 ? 251 LYS C NZ 1 ATOM 2981 N N . LEU C 3 105 ? 19.006 -34.038 -23.986 1.00 16.46 ? 252 LEU C N 1 ATOM 2982 C CA . LEU C 3 105 ? 18.229 -34.590 -22.929 1.00 18.87 ? 252 LEU C CA 1 ATOM 2983 C C . LEU C 3 105 ? 17.385 -35.823 -23.400 1.00 20.72 ? 252 LEU C C 1 ATOM 2984 O O . LEU C 3 105 ? 17.070 -35.977 -24.609 1.00 20.39 ? 252 LEU C O 1 ATOM 2985 C CB . LEU C 3 105 ? 17.344 -33.550 -22.321 1.00 17.19 ? 252 LEU C CB 1 ATOM 2986 C CG . LEU C 3 105 ? 18.022 -32.347 -21.768 1.00 18.36 ? 252 LEU C CG 1 ATOM 2987 C CD1 . LEU C 3 105 ? 16.985 -31.355 -21.247 1.00 18.24 ? 252 LEU C CD1 1 ATOM 2988 C CD2 . LEU C 3 105 ? 18.985 -32.672 -20.657 1.00 20.01 ? 252 LEU C CD2 1 ATOM 2989 N N . LYS C 3 106 ? 17.102 -36.717 -22.472 1.00 21.35 ? 253 LYS C N 1 ATOM 2990 C CA . LYS C 3 106 ? 16.317 -37.897 -22.822 1.00 22.18 ? 253 LYS C CA 1 ATOM 2991 C C . LYS C 3 106 ? 14.920 -37.445 -23.136 1.00 21.76 ? 253 LYS C C 1 ATOM 2992 O O . LYS C 3 106 ? 14.297 -38.047 -23.937 1.00 23.91 ? 253 LYS C O 1 ATOM 2993 C CB . LYS C 3 106 ? 16.253 -38.952 -21.720 1.00 23.50 ? 253 LYS C CB 1 ATOM 2994 C CG . LYS C 3 106 ? 17.544 -39.700 -21.402 1.00 24.51 ? 253 LYS C CG 1 ATOM 2995 C CD . LYS C 3 106 ? 17.283 -40.589 -20.208 1.00 25.05 ? 253 LYS C CD 1 ATOM 2996 C CE . LYS C 3 106 ? 18.526 -41.291 -19.659 1.00 26.19 ? 253 LYS C CE 1 ATOM 2997 N NZ . LYS C 3 106 ? 18.229 -41.853 -18.299 1.00 25.17 ? 253 LYS C NZ 1 ATOM 2998 N N . GLN C 3 107 ? 14.422 -36.352 -22.584 1.00 20.64 ? 254 GLN C N 1 ATOM 2999 C CA . GLN C 3 107 ? 13.113 -35.912 -23.023 1.00 23.08 ? 254 GLN C CA 1 ATOM 3000 C C . GLN C 3 107 ? 13.022 -34.381 -23.012 1.00 25.57 ? 254 GLN C C 1 ATOM 3001 O O . GLN C 3 107 ? 13.902 -33.704 -22.424 1.00 20.30 ? 254 GLN C O 1 ATOM 3002 C CB . GLN C 3 107 ? 12.071 -36.500 -22.117 1.00 28.16 ? 254 GLN C CB 1 ATOM 3003 C CG . GLN C 3 107 ? 12.198 -35.959 -20.708 1.00 34.13 ? 254 GLN C CG 1 ATOM 3004 C CD . GLN C 3 107 ? 11.052 -36.397 -19.811 1.00 42.38 ? 254 GLN C CD 1 ATOM 3005 O OE1 . GLN C 3 107 ? 10.163 -37.129 -20.230 1.00 40.95 ? 254 GLN C OE1 1 ATOM 3006 N NE2 . GLN C 3 107 ? 11.092 -35.958 -18.551 1.00 46.85 ? 254 GLN C NE2 1 ATOM 3007 N N . LYS C 3 108 ? 11.998 -33.845 -23.683 1.00 24.28 ? 255 LYS C N 1 ATOM 3008 C CA . LYS C 3 108 ? 11.835 -32.408 -23.802 1.00 26.07 ? 255 LYS C CA 1 ATOM 3009 C C . LYS C 3 108 ? 11.468 -31.869 -22.437 1.00 26.81 ? 255 LYS C C 1 ATOM 3010 O O . LYS C 3 108 ? 10.783 -32.560 -21.719 1.00 28.47 ? 255 LYS C O 1 ATOM 3011 C CB . LYS C 3 108 ? 10.709 -32.077 -24.793 1.00 30.14 ? 255 LYS C CB 1 ATOM 3012 C CG . LYS C 3 108 ? 10.933 -32.661 -26.176 1.00 34.41 ? 255 LYS C CG 1 ATOM 3013 C CD . LYS C 3 108 ? 9.733 -32.385 -27.076 1.00 38.52 ? 255 LYS C CD 1 ATOM 3014 C CE . LYS C 3 108 ? 10.021 -32.755 -28.502 1.00 42.25 ? 255 LYS C CE 1 ATOM 3015 N NZ . LYS C 3 108 ? 9.226 -31.848 -29.379 1.00 52.01 ? 255 LYS C NZ 1 ATOM 3016 N N . VAL C 3 109 ? 11.920 -30.663 -22.085 1.00 21.73 ? 256 VAL C N 1 ATOM 3017 C CA . VAL C 3 109 ? 11.535 -30.017 -20.833 1.00 25.76 ? 256 VAL C CA 1 ATOM 3018 C C . VAL C 3 109 ? 10.169 -29.407 -21.049 1.00 25.56 ? 256 VAL C C 1 ATOM 3019 O O . VAL C 3 109 ? 9.815 -29.146 -22.161 1.00 30.72 ? 256 VAL C O 1 ATOM 3020 C CB . VAL C 3 109 ? 12.524 -28.920 -20.386 1.00 23.54 ? 256 VAL C CB 1 ATOM 3021 C CG1 . VAL C 3 109 ? 13.911 -29.498 -20.212 1.00 25.30 ? 256 VAL C CG1 1 ATOM 3022 C CG2 . VAL C 3 109 ? 12.622 -27.757 -21.372 1.00 26.02 ? 256 VAL C CG2 1 ATOM 3023 N N . SER C 3 110 ? 9.385 -29.206 -20.031 1.00 27.59 ? 257 SER C N 1 ATOM 3024 C CA . SER C 3 110 ? 8.187 -28.391 -20.253 1.00 33.05 ? 257 SER C CA 1 ATOM 3025 C C . SER C 3 110 ? 8.533 -26.983 -19.888 1.00 30.82 ? 257 SER C C 1 ATOM 3026 O O . SER C 3 110 ? 9.080 -26.689 -18.828 1.00 31.52 ? 257 SER C O 1 ATOM 3027 C CB . SER C 3 110 ? 6.924 -28.867 -19.510 1.00 38.87 ? 257 SER C CB 1 ATOM 3028 O OG . SER C 3 110 ? 7.280 -29.413 -18.288 1.00 37.60 ? 257 SER C OG 1 ATOM 3029 N N . VAL C 3 111 ? 8.244 -26.135 -20.842 1.00 30.97 ? 258 VAL C N 1 ATOM 3030 C CA . VAL C 3 111 ? 8.593 -24.760 -20.823 1.00 30.93 ? 258 VAL C CA 1 ATOM 3031 C C . VAL C 3 111 ? 7.615 -24.061 -19.915 1.00 35.39 ? 258 VAL C C 1 ATOM 3032 O O . VAL C 3 111 ? 6.425 -24.415 -19.881 1.00 33.55 ? 258 VAL C O 1 ATOM 3033 C CB . VAL C 3 111 ? 8.483 -24.216 -22.249 1.00 32.91 ? 258 VAL C CB 1 ATOM 3034 C CG1 . VAL C 3 111 ? 8.805 -22.724 -22.322 1.00 33.93 ? 258 VAL C CG1 1 ATOM 3035 C CG2 . VAL C 3 111 ? 9.393 -25.027 -23.138 1.00 32.92 ? 258 VAL C CG2 1 ATOM 3036 N N . ASN C 3 112 ? 8.126 -23.070 -19.188 1.00 30.40 ? 259 ASN C N 1 ATOM 3037 C CA . ASN C 3 112 ? 7.346 -22.228 -18.316 1.00 28.75 ? 259 ASN C CA 1 ATOM 3038 C C . ASN C 3 112 ? 8.158 -20.970 -18.010 1.00 29.07 ? 259 ASN C C 1 ATOM 3039 O O . ASN C 3 112 ? 9.130 -20.684 -18.696 1.00 29.07 ? 259 ASN C O 1 ATOM 3040 C CB . ASN C 3 112 ? 6.997 -22.976 -17.048 1.00 30.44 ? 259 ASN C CB 1 ATOM 3041 C CG . ASN C 3 112 ? 8.219 -23.474 -16.284 1.00 28.17 ? 259 ASN C CG 1 ATOM 3042 O OD1 . ASN C 3 112 ? 9.193 -22.765 -15.984 1.00 29.11 ? 259 ASN C OD1 1 ATOM 3043 N ND2 . ASN C 3 112 ? 8.134 -24.712 -15.915 1.00 26.97 ? 259 ASN C ND2 1 ATOM 3044 N N . GLU C 3 113 ? 7.766 -20.228 -17.006 1.00 28.99 ? 260 GLU C N 1 ATOM 3045 C CA . GLU C 3 113 ? 8.410 -18.997 -16.651 1.00 29.86 ? 260 GLU C CA 1 ATOM 3046 C C . GLU C 3 113 ? 9.877 -19.179 -16.159 1.00 28.62 ? 260 GLU C C 1 ATOM 3047 O O . GLU C 3 113 ? 10.634 -18.270 -16.280 1.00 23.48 ? 260 GLU C O 1 ATOM 3048 C CB . GLU C 3 113 ? 7.529 -18.329 -15.619 1.00 38.25 ? 260 GLU C CB 1 ATOM 3049 C CG . GLU C 3 113 ? 8.162 -17.407 -14.593 1.00 47.95 ? 260 GLU C CG 1 ATOM 3050 C CD . GLU C 3 113 ? 7.122 -16.483 -13.934 1.00 57.79 ? 260 GLU C CD 1 ATOM 3051 O OE1 . GLU C 3 113 ? 6.149 -16.095 -14.618 1.00 64.40 ? 260 GLU C OE1 1 ATOM 3052 O OE2 . GLU C 3 113 ? 7.272 -16.125 -12.742 1.00 61.53 ? 260 GLU C OE2 1 ATOM 3053 N N . ARG C 3 114 ? 10.270 -20.351 -15.676 1.00 26.93 ? 261 ARG C N 1 ATOM 3054 C CA . ARG C 3 114 ? 11.618 -20.584 -15.140 1.00 28.24 ? 261 ARG C CA 1 ATOM 3055 C C . ARG C 3 114 ? 12.521 -21.399 -16.063 1.00 25.94 ? 261 ARG C C 1 ATOM 3056 O O . ARG C 3 114 ? 13.734 -21.446 -15.886 1.00 26.58 ? 261 ARG C O 1 ATOM 3057 C CB . ARG C 3 114 ? 11.507 -21.267 -13.775 1.00 31.16 ? 261 ARG C CB 1 ATOM 3058 C CG . ARG C 3 114 ? 10.945 -20.373 -12.684 1.00 34.68 ? 261 ARG C CG 1 ATOM 3059 C CD . ARG C 3 114 ? 10.672 -21.150 -11.410 1.00 46.58 ? 261 ARG C CD 1 ATOM 3060 N NE . ARG C 3 114 ? 9.794 -20.406 -10.495 1.00 56.57 ? 261 ARG C NE 1 ATOM 3061 C CZ . ARG C 3 114 ? 9.453 -20.805 -9.273 1.00 61.56 ? 261 ARG C CZ 1 ATOM 3062 N NH1 . ARG C 3 114 ? 9.923 -21.947 -8.782 1.00 72.25 ? 261 ARG C NH1 1 ATOM 3063 N NH2 . ARG C 3 114 ? 8.646 -20.056 -8.529 1.00 60.96 ? 261 ARG C NH2 1 ATOM 3064 N N . VAL C 3 115 ? 11.905 -22.091 -17.019 1.00 26.43 ? 262 VAL C N 1 ATOM 3065 C CA . VAL C 3 115 ? 12.599 -22.945 -17.969 1.00 23.30 ? 262 VAL C CA 1 ATOM 3066 C C . VAL C 3 115 ? 12.177 -22.577 -19.410 1.00 24.44 ? 262 VAL C C 1 ATOM 3067 O O . VAL C 3 115 ? 11.068 -22.873 -19.848 1.00 24.93 ? 262 VAL C O 1 ATOM 3068 C CB . VAL C 3 115 ? 12.292 -24.419 -17.684 1.00 22.75 ? 262 VAL C CB 1 ATOM 3069 C CG1 . VAL C 3 115 ? 13.090 -25.338 -18.595 1.00 21.15 ? 262 VAL C CG1 1 ATOM 3070 C CG2 . VAL C 3 115 ? 12.543 -24.744 -16.196 1.00 22.31 ? 262 VAL C CG2 1 ATOM 3071 N N . MET C 3 116 ? 13.079 -21.971 -20.178 1.00 20.73 ? 263 MET C N 1 ATOM 3072 C CA . MET C 3 116 ? 12.753 -21.672 -21.564 1.00 21.71 ? 263 MET C CA 1 ATOM 3073 C C . MET C 3 116 ? 14.041 -21.466 -22.335 1.00 21.20 ? 263 MET C C 1 ATOM 3074 O O . MET C 3 116 ? 14.951 -20.761 -21.823 1.00 16.93 ? 263 MET C O 1 ATOM 3075 C CB . MET C 3 116 ? 11.909 -20.405 -21.645 1.00 25.40 ? 263 MET C CB 1 ATOM 3076 C CG . MET C 3 116 ? 11.704 -19.881 -23.076 1.00 30.86 ? 263 MET C CG 1 ATOM 3077 S SD . MET C 3 116 ? 10.917 -18.279 -23.067 1.00 34.36 ? 263 MET C SD 1 ATOM 3078 C CE . MET C 3 116 ? 9.258 -18.691 -22.481 1.00 40.07 ? 263 MET C CE 1 ATOM 3079 N N . PRO C 3 117 ? 14.099 -22.028 -23.567 1.00 18.39 ? 264 PRO C N 1 ATOM 3080 C CA . PRO C 3 117 ? 15.333 -21.879 -24.318 1.00 19.28 ? 264 PRO C CA 1 ATOM 3081 C C . PRO C 3 117 ? 15.490 -20.430 -24.857 1.00 17.74 ? 264 PRO C C 1 ATOM 3082 O O . PRO C 3 117 ? 14.534 -19.706 -25.019 1.00 14.79 ? 264 PRO C O 1 ATOM 3083 C CB . PRO C 3 117 ? 15.191 -22.865 -25.512 1.00 20.50 ? 264 PRO C CB 1 ATOM 3084 C CG . PRO C 3 117 ? 13.771 -23.269 -25.565 1.00 19.96 ? 264 PRO C CG 1 ATOM 3085 C CD . PRO C 3 117 ? 13.125 -22.914 -24.236 1.00 18.29 ? 264 PRO C CD 1 ATOM 3086 N N . ILE C 3 118 ? 16.739 -20.062 -25.079 1.00 16.18 ? 265 ILE C N 1 ATOM 3087 C CA . ILE C 3 118 ? 17.096 -18.879 -25.726 1.00 15.89 ? 265 ILE C CA 1 ATOM 3088 C C . ILE C 3 118 ? 17.214 -19.166 -27.215 1.00 17.48 ? 265 ILE C C 1 ATOM 3089 O O . ILE C 3 118 ? 17.526 -20.284 -27.574 1.00 19.85 ? 265 ILE C O 1 ATOM 3090 C CB . ILE C 3 118 ? 18.415 -18.354 -25.163 1.00 14.28 ? 265 ILE C CB 1 ATOM 3091 C CG1 . ILE C 3 118 ? 18.667 -16.876 -25.565 1.00 15.55 ? 265 ILE C CG1 1 ATOM 3092 C CG2 . ILE C 3 118 ? 19.577 -19.218 -25.578 1.00 14.30 ? 265 ILE C CG2 1 ATOM 3093 C CD1 . ILE C 3 118 ? 19.757 -16.225 -24.690 1.00 16.40 ? 265 ILE C CD1 1 ATOM 3094 N N . CYS C 3 119 ? 16.991 -18.163 -28.087 1.00 17.45 ? 266 CYS C N 1 ATOM 3095 C CA . CYS C 3 119 ? 17.015 -18.395 -29.509 1.00 18.34 ? 266 CYS C CA 1 ATOM 3096 C C . CYS C 3 119 ? 18.414 -18.299 -30.017 1.00 20.95 ? 266 CYS C C 1 ATOM 3097 O O . CYS C 3 119 ? 19.262 -17.539 -29.453 1.00 18.47 ? 266 CYS C O 1 ATOM 3098 C CB . CYS C 3 119 ? 16.181 -17.389 -30.288 1.00 21.34 ? 266 CYS C CB 1 ATOM 3099 S SG . CYS C 3 119 ? 14.501 -17.242 -29.779 1.00 25.02 ? 266 CYS C SG 1 ATOM 3100 N N . LEU C 3 120 ? 18.707 -19.113 -31.011 1.00 19.02 ? 267 LEU C N 1 ATOM 3101 C CA . LEU C 3 120 ? 19.970 -19.006 -31.688 1.00 21.52 ? 267 LEU C CA 1 ATOM 3102 C C . LEU C 3 120 ? 19.886 -17.969 -32.821 1.00 22.94 ? 267 LEU C C 1 ATOM 3103 O O . LEU C 3 120 ? 18.917 -17.952 -33.530 1.00 22.41 ? 267 LEU C O 1 ATOM 3104 C CB . LEU C 3 120 ? 20.357 -20.305 -32.348 1.00 25.47 ? 267 LEU C CB 1 ATOM 3105 C CG . LEU C 3 120 ? 20.423 -21.546 -31.482 1.00 29.86 ? 267 LEU C CG 1 ATOM 3106 C CD1 . LEU C 3 120 ? 20.565 -22.733 -32.448 1.00 32.86 ? 267 LEU C CD1 1 ATOM 3107 C CD2 . LEU C 3 120 ? 21.555 -21.456 -30.484 1.00 28.93 ? 267 LEU C CD2 1 ATOM 3108 N N . PRO C 3 121 ? 20.888 -17.113 -32.979 1.00 21.87 ? 268 PRO C N 1 ATOM 3109 C CA . PRO C 3 121 ? 20.712 -16.032 -33.926 1.00 25.59 ? 268 PRO C CA 1 ATOM 3110 C C . PRO C 3 121 ? 21.276 -16.411 -35.272 1.00 24.50 ? 268 PRO C C 1 ATOM 3111 O O . PRO C 3 121 ? 22.323 -17.076 -35.348 1.00 27.73 ? 268 PRO C O 1 ATOM 3112 C CB . PRO C 3 121 ? 21.557 -14.901 -33.331 1.00 23.59 ? 268 PRO C CB 1 ATOM 3113 C CG . PRO C 3 121 ? 22.699 -15.644 -32.676 1.00 23.33 ? 268 PRO C CG 1 ATOM 3114 C CD . PRO C 3 121 ? 22.124 -16.975 -32.201 1.00 24.56 ? 268 PRO C CD 1 ATOM 3115 N N . SER C 3 122 ? 20.646 -15.902 -36.309 1.00 27.90 ? 269 SER C N 1 ATOM 3116 C CA . SER C 3 122 ? 21.264 -15.913 -37.637 1.00 31.97 ? 269 SER C CA 1 ATOM 3117 C C . SER C 3 122 ? 22.089 -14.641 -37.832 1.00 29.84 ? 269 SER C C 1 ATOM 3118 O O . SER C 3 122 ? 23.177 -14.719 -38.419 1.00 28.88 ? 269 SER C O 1 ATOM 3119 C CB . SER C 3 122 ? 20.209 -16.097 -38.749 1.00 34.68 ? 269 SER C CB 1 ATOM 3120 O OG . SER C 3 122 ? 19.258 -15.015 -38.779 1.00 34.32 ? 269 SER C OG 1 ATOM 3121 N N . LYS C 3 123 ? 21.599 -13.499 -37.325 1.00 28.77 ? 270 LYS C N 1 ATOM 3122 C CA . LYS C 3 123 ? 22.424 -12.229 -37.303 1.00 25.89 ? 270 LYS C CA 1 ATOM 3123 C C . LYS C 3 123 ? 23.607 -12.245 -36.333 1.00 26.31 ? 270 LYS C C 1 ATOM 3124 O O . LYS C 3 123 ? 23.576 -12.915 -35.247 1.00 22.82 ? 270 LYS C O 1 ATOM 3125 C CB . LYS C 3 123 ? 21.563 -11.028 -36.978 1.00 26.05 ? 270 LYS C CB 1 ATOM 3126 C CG . LYS C 3 123 ? 20.633 -10.650 -38.121 1.00 27.07 ? 270 LYS C CG 1 ATOM 3127 C CD . LYS C 3 123 ? 19.567 -9.701 -37.622 1.00 28.97 ? 270 LYS C CD 1 ATOM 3128 C CE . LYS C 3 123 ? 18.683 -9.262 -38.789 1.00 26.44 ? 270 LYS C CE 1 ATOM 3129 N NZ . LYS C 3 123 ? 17.955 -8.084 -38.310 1.00 29.30 ? 270 LYS C NZ 1 ATOM 3130 N N . ASP C 3 124 ? 24.665 -11.537 -36.729 1.00 22.41 ? 271 ASP C N 1 ATOM 3131 C CA . ASP C 3 124 ? 25.864 -11.422 -35.904 1.00 21.96 ? 271 ASP C CA 1 ATOM 3132 C C . ASP C 3 124 ? 25.750 -10.140 -35.095 1.00 20.84 ? 271 ASP C C 1 ATOM 3133 O O . ASP C 3 124 ? 25.968 -9.031 -35.602 1.00 19.84 ? 271 ASP C O 1 ATOM 3134 C CB . ASP C 3 124 ? 27.110 -11.391 -36.768 1.00 22.04 ? 271 ASP C CB 1 ATOM 3135 C CG . ASP C 3 124 ? 28.375 -11.250 -35.955 1.00 24.38 ? 271 ASP C CG 1 ATOM 3136 O OD1 . ASP C 3 124 ? 28.335 -11.151 -34.713 1.00 20.98 ? 271 ASP C OD1 1 ATOM 3137 O OD2 . ASP C 3 124 ? 29.438 -11.349 -36.566 1.00 28.02 ? 271 ASP C OD2 1 ATOM 3138 N N . TYR C 3 125 ? 25.364 -10.287 -33.830 1.00 20.03 ? 272 TYR C N 1 ATOM 3139 C CA . TYR C 3 125 ? 25.138 -9.111 -32.965 1.00 19.02 ? 272 TYR C CA 1 ATOM 3140 C C . TYR C 3 125 ? 26.441 -8.654 -32.271 1.00 17.72 ? 272 TYR C C 1 ATOM 3141 O O . TYR C 3 125 ? 26.404 -7.774 -31.410 1.00 16.96 ? 272 TYR C O 1 ATOM 3142 C CB . TYR C 3 125 ? 24.072 -9.421 -31.911 1.00 19.90 ? 272 TYR C CB 1 ATOM 3143 C CG . TYR C 3 125 ? 22.698 -9.709 -32.464 1.00 22.72 ? 272 TYR C CG 1 ATOM 3144 C CD1 . TYR C 3 125 ? 22.022 -8.779 -33.257 1.00 23.29 ? 272 TYR C CD1 1 ATOM 3145 C CD2 . TYR C 3 125 ? 22.062 -10.912 -32.187 1.00 23.11 ? 272 TYR C CD2 1 ATOM 3146 C CE1 . TYR C 3 125 ? 20.758 -9.058 -33.754 1.00 24.92 ? 272 TYR C CE1 1 ATOM 3147 C CE2 . TYR C 3 125 ? 20.825 -11.219 -32.705 1.00 25.21 ? 272 TYR C CE2 1 ATOM 3148 C CZ . TYR C 3 125 ? 20.168 -10.280 -33.488 1.00 25.84 ? 272 TYR C CZ 1 ATOM 3149 O OH . TYR C 3 125 ? 18.958 -10.594 -33.976 1.00 25.95 ? 272 TYR C OH 1 ATOM 3150 N N . ALA C 3 126 ? 27.580 -9.251 -32.590 1.00 17.36 ? 273 ALA C N 1 ATOM 3151 C CA . ALA C 3 126 ? 28.793 -9.012 -31.801 1.00 15.91 ? 273 ALA C CA 1 ATOM 3152 C C . ALA C 3 126 ? 29.621 -7.811 -32.309 1.00 17.24 ? 273 ALA C C 1 ATOM 3153 O O . ALA C 3 126 ? 30.810 -7.915 -32.502 1.00 15.57 ? 273 ALA C O 1 ATOM 3154 C CB . ALA C 3 126 ? 29.669 -10.246 -31.732 1.00 16.58 ? 273 ALA C CB 1 ATOM 3155 N N . GLU C 3 127 ? 28.972 -6.684 -32.578 1.00 18.11 ? 274 GLU C N 1 ATOM 3156 C CA . GLU C 3 127 ? 29.710 -5.463 -32.936 1.00 16.92 ? 274 GLU C CA 1 ATOM 3157 C C . GLU C 3 127 ? 30.441 -5.001 -31.698 1.00 14.65 ? 274 GLU C C 1 ATOM 3158 O O . GLU C 3 127 ? 29.950 -5.070 -30.572 1.00 13.67 ? 274 GLU C O 1 ATOM 3159 C CB . GLU C 3 127 ? 28.736 -4.335 -33.293 1.00 17.83 ? 274 GLU C CB 1 ATOM 3160 C CG . GLU C 3 127 ? 27.984 -4.464 -34.622 1.00 18.56 ? 274 GLU C CG 1 ATOM 3161 C CD . GLU C 3 127 ? 26.616 -5.177 -34.543 1.00 18.69 ? 274 GLU C CD 1 ATOM 3162 O OE1 . GLU C 3 127 ? 26.244 -5.678 -33.461 1.00 19.61 ? 274 GLU C OE1 1 ATOM 3163 O OE2 . GLU C 3 127 ? 25.914 -5.283 -35.577 1.00 18.56 ? 274 GLU C OE2 1 ATOM 3164 N N . VAL C 3 128 ? 31.632 -4.493 -31.872 1.00 16.37 ? 275 VAL C N 1 ATOM 3165 C CA . VAL C 3 128 ? 32.300 -3.892 -30.751 1.00 17.65 ? 275 VAL C CA 1 ATOM 3166 C C . VAL C 3 128 ? 31.390 -2.813 -30.066 1.00 17.63 ? 275 VAL C C 1 ATOM 3167 O O . VAL C 3 128 ? 30.773 -2.038 -30.748 1.00 14.55 ? 275 VAL C O 1 ATOM 3168 C CB . VAL C 3 128 ? 33.674 -3.356 -31.144 1.00 21.11 ? 275 VAL C CB 1 ATOM 3169 C CG1 . VAL C 3 128 ? 34.502 -4.358 -31.957 1.00 20.55 ? 275 VAL C CG1 1 ATOM 3170 C CG2 . VAL C 3 128 ? 33.526 -2.026 -31.862 1.00 25.24 ? 275 VAL C CG2 1 ATOM 3171 N N . GLY C 3 129 ? 31.232 -2.875 -28.737 1.00 14.57 ? 276 GLY C N 1 ATOM 3172 C CA . GLY C 3 129 ? 30.413 -1.956 -28.018 1.00 15.49 ? 276 GLY C CA 1 ATOM 3173 C C . GLY C 3 129 ? 28.980 -2.439 -27.822 1.00 15.30 ? 276 GLY C C 1 ATOM 3174 O O . GLY C 3 129 ? 28.179 -1.792 -27.149 1.00 15.44 ? 276 GLY C O 1 ATOM 3175 N N . ARG C 3 130 ? 28.645 -3.536 -28.469 1.00 15.79 ? 277 ARG C N 1 ATOM 3176 C CA . ARG C 3 130 ? 27.334 -4.159 -28.207 1.00 16.54 ? 277 ARG C CA 1 ATOM 3177 C C . ARG C 3 130 ? 27.211 -4.563 -26.720 1.00 15.81 ? 277 ARG C C 1 ATOM 3178 O O . ARG C 3 130 ? 28.091 -5.270 -26.214 1.00 13.85 ? 277 ARG C O 1 ATOM 3179 C CB . ARG C 3 130 ? 27.162 -5.369 -29.091 1.00 16.65 ? 277 ARG C CB 1 ATOM 3180 C CG . ARG C 3 130 ? 26.047 -6.298 -28.633 1.00 17.79 ? 277 ARG C CG 1 ATOM 3181 C CD . ARG C 3 130 ? 24.673 -5.755 -29.081 1.00 17.54 ? 277 ARG C CD 1 ATOM 3182 N NE . ARG C 3 130 ? 24.539 -5.872 -30.524 1.00 17.73 ? 277 ARG C NE 1 ATOM 3183 C CZ . ARG C 3 130 ? 23.459 -5.520 -31.210 1.00 16.65 ? 277 ARG C CZ 1 ATOM 3184 N NH1 . ARG C 3 130 ? 22.464 -4.973 -30.586 1.00 17.82 ? 277 ARG C NH1 1 ATOM 3185 N NH2 . ARG C 3 130 ? 23.451 -5.628 -32.521 1.00 16.16 ? 277 ARG C NH2 1 ATOM 3186 N N . VAL C 3 131 ? 26.153 -4.079 -26.057 1.00 14.55 ? 278 VAL C N 1 ATOM 3187 C CA . VAL C 3 131 ? 25.845 -4.420 -24.646 1.00 14.88 ? 278 VAL C CA 1 ATOM 3188 C C . VAL C 3 131 ? 25.029 -5.743 -24.547 1.00 15.54 ? 278 VAL C C 1 ATOM 3189 O O . VAL C 3 131 ? 23.983 -5.879 -25.187 1.00 14.74 ? 278 VAL C O 1 ATOM 3190 C CB . VAL C 3 131 ? 25.066 -3.301 -23.957 1.00 15.79 ? 278 VAL C CB 1 ATOM 3191 C CG1 . VAL C 3 131 ? 24.654 -3.639 -22.467 1.00 15.87 ? 278 VAL C CG1 1 ATOM 3192 C CG2 . VAL C 3 131 ? 25.911 -2.078 -23.985 1.00 14.86 ? 278 VAL C CG2 1 ATOM 3193 N N . GLY C 3 132 ? 25.598 -6.769 -23.871 1.00 14.91 ? 279 GLY C N 1 ATOM 3194 C CA . GLY C 3 132 ? 24.837 -7.956 -23.531 1.00 14.96 ? 279 GLY C CA 1 ATOM 3195 C C . GLY C 3 132 ? 24.881 -8.281 -22.061 1.00 15.36 ? 279 GLY C C 1 ATOM 3196 O O . GLY C 3 132 ? 25.437 -7.533 -21.246 1.00 14.71 ? 279 GLY C O 1 ATOM 3197 N N . TYR C 3 133 ? 24.212 -9.384 -21.758 1.00 14.89 ? 280 TYR C N 1 ATOM 3198 C CA . TYR C 3 133 ? 23.957 -9.860 -20.393 1.00 17.76 ? 280 TYR C CA 1 ATOM 3199 C C . TYR C 3 133 ? 24.468 -11.297 -20.295 1.00 15.55 ? 280 TYR C C 1 ATOM 3200 O O . TYR C 3 133 ? 24.113 -12.112 -21.172 1.00 14.76 ? 280 TYR C O 1 ATOM 3201 C CB . TYR C 3 133 ? 22.468 -9.855 -20.068 1.00 18.53 ? 280 TYR C CB 1 ATOM 3202 C CG . TYR C 3 133 ? 21.762 -8.508 -20.231 1.00 21.96 ? 280 TYR C CG 1 ATOM 3203 C CD1 . TYR C 3 133 ? 21.317 -8.045 -21.495 1.00 27.85 ? 280 TYR C CD1 1 ATOM 3204 C CD2 . TYR C 3 133 ? 21.574 -7.706 -19.161 1.00 26.04 ? 280 TYR C CD2 1 ATOM 3205 C CE1 . TYR C 3 133 ? 20.655 -6.800 -21.636 1.00 31.19 ? 280 TYR C CE1 1 ATOM 3206 C CE2 . TYR C 3 133 ? 20.970 -6.473 -19.273 1.00 31.51 ? 280 TYR C CE2 1 ATOM 3207 C CZ . TYR C 3 133 ? 20.477 -6.033 -20.481 1.00 34.52 ? 280 TYR C CZ 1 ATOM 3208 O OH . TYR C 3 133 ? 19.846 -4.810 -20.478 1.00 33.51 ? 280 TYR C OH 1 ATOM 3209 N N . VAL C 3 134 ? 25.316 -11.561 -19.312 1.00 14.03 ? 281 VAL C N 1 ATOM 3210 C CA . VAL C 3 134 ? 25.886 -12.911 -19.110 1.00 15.42 ? 281 VAL C CA 1 ATOM 3211 C C . VAL C 3 134 ? 25.549 -13.336 -17.682 1.00 15.52 ? 281 VAL C C 1 ATOM 3212 O O . VAL C 3 134 ? 25.959 -12.662 -16.696 1.00 15.22 ? 281 VAL C O 1 ATOM 3213 C CB . VAL C 3 134 ? 27.425 -13.005 -19.306 1.00 15.49 ? 281 VAL C CB 1 ATOM 3214 C CG1 . VAL C 3 134 ? 27.853 -14.484 -19.228 1.00 14.24 ? 281 VAL C CG1 1 ATOM 3215 C CG2 . VAL C 3 134 ? 27.783 -12.490 -20.660 1.00 19.33 ? 281 VAL C CG2 1 ATOM 3216 N N . SER C 3 135 ? 24.707 -14.352 -17.587 1.00 16.70 ? 282 SER C N 1 ATOM 3217 C CA . SER C 3 135 ? 24.284 -14.905 -16.307 1.00 17.11 ? 282 SER C CA 1 ATOM 3218 C C . SER C 3 135 ? 25.195 -16.044 -15.969 1.00 17.34 ? 282 SER C C 1 ATOM 3219 O O . SER C 3 135 ? 25.797 -16.653 -16.860 1.00 18.47 ? 282 SER C O 1 ATOM 3220 C CB . SER C 3 135 ? 22.814 -15.368 -16.358 1.00 16.57 ? 282 SER C CB 1 ATOM 3221 O OG . SER C 3 135 ? 22.563 -16.309 -17.384 1.00 17.03 ? 282 SER C OG 1 ATOM 3222 N N . GLY C 3 136 ? 25.305 -16.367 -14.687 1.00 16.25 ? 283 GLY C N 1 ATOM 3223 C CA . GLY C 3 136 ? 26.103 -17.502 -14.340 1.00 16.15 ? 283 GLY C CA 1 ATOM 3224 C C . GLY C 3 136 ? 26.009 -17.959 -12.880 1.00 15.49 ? 283 GLY C C 1 ATOM 3225 O O . GLY C 3 136 ? 25.621 -17.160 -12.034 1.00 16.04 ? 283 GLY C O 1 ATOM 3226 N N . TRP C 3 137 ? 26.397 -19.220 -12.655 1.00 15.22 ? 284 TRP C N 1 ATOM 3227 C CA . TRP C 3 137 ? 26.421 -19.895 -11.330 1.00 16.32 ? 284 TRP C CA 1 ATOM 3228 C C . TRP C 3 137 ? 27.860 -19.996 -10.797 1.00 17.11 ? 284 TRP C C 1 ATOM 3229 O O . TRP C 3 137 ? 28.148 -20.799 -9.906 1.00 16.82 ? 284 TRP C O 1 ATOM 3230 C CB . TRP C 3 137 ? 25.826 -21.292 -11.463 1.00 17.96 ? 284 TRP C CB 1 ATOM 3231 C CG . TRP C 3 137 ? 24.323 -21.329 -11.641 1.00 19.52 ? 284 TRP C CG 1 ATOM 3232 C CD1 . TRP C 3 137 ? 23.665 -21.705 -12.770 1.00 20.71 ? 284 TRP C CD1 1 ATOM 3233 C CD2 . TRP C 3 137 ? 23.333 -20.924 -10.709 1.00 21.43 ? 284 TRP C CD2 1 ATOM 3234 N NE1 . TRP C 3 137 ? 22.311 -21.641 -12.568 1.00 22.54 ? 284 TRP C NE1 1 ATOM 3235 C CE2 . TRP C 3 137 ? 22.081 -21.103 -11.330 1.00 22.19 ? 284 TRP C CE2 1 ATOM 3236 C CE3 . TRP C 3 137 ? 23.365 -20.383 -9.404 1.00 23.54 ? 284 TRP C CE3 1 ATOM 3237 C CZ2 . TRP C 3 137 ? 20.856 -20.799 -10.676 1.00 22.55 ? 284 TRP C CZ2 1 ATOM 3238 C CZ3 . TRP C 3 137 ? 22.124 -20.128 -8.743 1.00 22.10 ? 284 TRP C CZ3 1 ATOM 3239 C CH2 . TRP C 3 137 ? 20.914 -20.339 -9.389 1.00 22.72 ? 284 TRP C CH2 1 ATOM 3240 N N . GLY C 3 138 ? 28.772 -19.256 -11.427 1.00 18.58 ? 285 GLY C N 1 ATOM 3241 C CA . GLY C 3 138 ? 30.179 -19.260 -11.072 1.00 19.93 ? 285 GLY C CA 1 ATOM 3242 C C . GLY C 3 138 ? 30.499 -18.712 -9.703 1.00 19.65 ? 285 GLY C C 1 ATOM 3243 O O . GLY C 3 138 ? 29.642 -18.260 -8.934 1.00 22.50 ? 285 GLY C O 1 ATOM 3244 N N . ARG C 3 139 ? 31.773 -18.670 -9.410 1.00 20.71 ? 286 ARG C N 1 ATOM 3245 C CA . ARG C 3 139 ? 32.218 -18.228 -8.098 1.00 17.53 ? 286 ARG C CA 1 ATOM 3246 C C . ARG C 3 139 ? 32.127 -16.738 -8.006 1.00 18.79 ? 286 ARG C C 1 ATOM 3247 O O . ARG C 3 139 ? 32.386 -16.055 -8.976 1.00 15.94 ? 286 ARG C O 1 ATOM 3248 C CB . ARG C 3 139 ? 33.663 -18.673 -7.890 1.00 18.40 ? 286 ARG C CB 1 ATOM 3249 C CG . ARG C 3 139 ? 33.778 -20.186 -7.663 1.00 18.07 ? 286 ARG C CG 1 ATOM 3250 C CD . ARG C 3 139 ? 35.196 -20.582 -7.392 1.00 18.51 ? 286 ARG C CD 1 ATOM 3251 N NE . ARG C 3 139 ? 35.388 -22.037 -7.463 1.00 17.93 ? 286 ARG C NE 1 ATOM 3252 C CZ . ARG C 3 139 ? 35.412 -22.878 -6.404 1.00 19.83 ? 286 ARG C CZ 1 ATOM 3253 N NH1 . ARG C 3 139 ? 35.251 -22.427 -5.142 1.00 17.71 ? 286 ARG C NH1 1 ATOM 3254 N NH2 . ARG C 3 139 ? 35.685 -24.207 -6.610 1.00 18.21 ? 286 ARG C NH2 1 ATOM 3255 N N . ASN C 3 140 ? 31.805 -16.259 -6.801 1.00 19.33 ? 287 ASN C N 1 ATOM 3256 C CA . ASN C 3 140 ? 31.615 -14.847 -6.500 1.00 17.96 ? 287 ASN C CA 1 ATOM 3257 C C . ASN C 3 140 ? 32.852 -14.252 -5.862 1.00 18.00 ? 287 ASN C C 1 ATOM 3258 O O . ASN C 3 140 ? 33.925 -14.884 -5.817 1.00 16.00 ? 287 ASN C O 1 ATOM 3259 C CB . ASN C 3 140 ? 30.363 -14.683 -5.575 1.00 17.27 ? 287 ASN C CB 1 ATOM 3260 C CG . ASN C 3 140 ? 30.511 -15.395 -4.222 1.00 18.86 ? 287 ASN C CG 1 ATOM 3261 O OD1 . ASN C 3 140 ? 31.625 -15.753 -3.785 1.00 15.20 ? 287 ASN C OD1 1 ATOM 3262 N ND2 . ASN C 3 140 ? 29.376 -15.568 -3.515 1.00 18.84 ? 287 ASN C ND2 1 ATOM 3263 N N . ALA C 3 141 ? 32.719 -13.019 -5.359 1.00 18.15 ? 288 ALA C N 1 ATOM 3264 C CA . ALA C 3 141 ? 33.819 -12.330 -4.709 1.00 21.00 ? 288 ALA C CA 1 ATOM 3265 C C . ALA C 3 141 ? 34.399 -13.035 -3.498 1.00 21.71 ? 288 ALA C C 1 ATOM 3266 O O . ALA C 3 141 ? 35.477 -12.696 -3.124 1.00 20.90 ? 288 ALA C O 1 ATOM 3267 C CB . ALA C 3 141 ? 33.429 -10.921 -4.335 1.00 22.03 ? 288 ALA C CB 1 ATOM 3268 N N . ASN C 3 142 ? 33.708 -14.018 -2.906 1.00 19.75 ? 289 ASN C N 1 ATOM 3269 C CA . ASN C 3 142 ? 34.317 -14.820 -1.808 1.00 21.26 ? 289 ASN C CA 1 ATOM 3270 C C . ASN C 3 142 ? 34.869 -16.175 -2.319 1.00 19.97 ? 289 ASN C C 1 ATOM 3271 O O . ASN C 3 142 ? 35.236 -17.059 -1.531 1.00 18.02 ? 289 ASN C O 1 ATOM 3272 C CB . ASN C 3 142 ? 33.273 -15.079 -0.710 1.00 20.65 ? 289 ASN C CB 1 ATOM 3273 C CG . ASN C 3 142 ? 32.702 -13.809 -0.145 1.00 21.87 ? 289 ASN C CG 1 ATOM 3274 O OD1 . ASN C 3 142 ? 33.443 -12.987 0.391 1.00 22.88 ? 289 ASN C OD1 1 ATOM 3275 N ND2 . ASN C 3 142 ? 31.396 -13.602 -0.324 1.00 23.93 ? 289 ASN C ND2 1 ATOM 3276 N N . PHE C 3 143 ? 34.876 -16.350 -3.646 1.00 17.97 ? 290 PHE C N 1 ATOM 3277 C CA . PHE C 3 143 ? 35.272 -17.587 -4.269 1.00 17.22 ? 290 PHE C CA 1 ATOM 3278 C C . PHE C 3 143 ? 34.338 -18.768 -3.885 1.00 17.78 ? 290 PHE C C 1 ATOM 3279 O O . PHE C 3 143 ? 34.747 -19.905 -3.912 1.00 17.59 ? 290 PHE C O 1 ATOM 3280 C CB . PHE C 3 143 ? 36.758 -17.924 -4.049 1.00 16.69 ? 290 PHE C CB 1 ATOM 3281 C CG . PHE C 3 143 ? 37.719 -17.288 -5.051 1.00 19.04 ? 290 PHE C CG 1 ATOM 3282 C CD1 . PHE C 3 143 ? 37.295 -16.325 -5.966 1.00 22.83 ? 290 PHE C CD1 1 ATOM 3283 C CD2 . PHE C 3 143 ? 39.067 -17.574 -4.996 1.00 19.92 ? 290 PHE C CD2 1 ATOM 3284 C CE1 . PHE C 3 143 ? 38.172 -15.732 -6.846 1.00 23.62 ? 290 PHE C CE1 1 ATOM 3285 C CE2 . PHE C 3 143 ? 39.956 -16.998 -5.899 1.00 23.44 ? 290 PHE C CE2 1 ATOM 3286 C CZ . PHE C 3 143 ? 39.499 -16.071 -6.817 1.00 24.62 ? 290 PHE C CZ 1 ATOM 3287 N N . LYS C 3 144 ? 33.083 -18.480 -3.604 1.00 20.23 ? 291 LYS C N 1 ATOM 3288 C CA . LYS C 3 144 ? 32.077 -19.523 -3.354 1.00 24.50 ? 291 LYS C CA 1 ATOM 3289 C C . LYS C 3 144 ? 31.167 -19.547 -4.554 1.00 23.05 ? 291 LYS C C 1 ATOM 3290 O O . LYS C 3 144 ? 30.851 -18.445 -5.098 1.00 16.52 ? 291 LYS C O 1 ATOM 3291 C CB . LYS C 3 144 ? 31.234 -19.212 -2.096 1.00 28.80 ? 291 LYS C CB 1 ATOM 3292 C CG . LYS C 3 144 ? 32.074 -19.395 -0.840 1.00 36.39 ? 291 LYS C CG 1 ATOM 3293 C CD . LYS C 3 144 ? 31.635 -18.589 0.396 1.00 45.59 ? 291 LYS C CD 1 ATOM 3294 C CE . LYS C 3 144 ? 30.920 -19.469 1.397 1.00 53.39 ? 291 LYS C CE 1 ATOM 3295 N NZ . LYS C 3 144 ? 29.771 -20.068 0.664 1.00 59.30 ? 291 LYS C NZ 1 ATOM 3296 N N . PHE C 3 145 ? 30.768 -20.771 -4.963 1.00 20.38 ? 292 PHE C N 1 ATOM 3297 C CA . PHE C 3 145 ? 29.717 -20.898 -5.995 1.00 21.60 ? 292 PHE C CA 1 ATOM 3298 C C . PHE C 3 145 ? 28.491 -20.184 -5.549 1.00 22.67 ? 292 PHE C C 1 ATOM 3299 O O . PHE C 3 145 ? 28.019 -20.337 -4.406 1.00 20.18 ? 292 PHE C O 1 ATOM 3300 C CB . PHE C 3 145 ? 29.413 -22.351 -6.350 1.00 20.24 ? 292 PHE C CB 1 ATOM 3301 C CG . PHE C 3 145 ? 30.508 -23.003 -7.064 1.00 18.60 ? 292 PHE C CG 1 ATOM 3302 C CD1 . PHE C 3 145 ? 30.906 -22.550 -8.290 1.00 20.50 ? 292 PHE C CD1 1 ATOM 3303 C CD2 . PHE C 3 145 ? 31.190 -24.023 -6.485 1.00 18.36 ? 292 PHE C CD2 1 ATOM 3304 C CE1 . PHE C 3 145 ? 31.967 -23.145 -8.972 1.00 19.01 ? 292 PHE C CE1 1 ATOM 3305 C CE2 . PHE C 3 145 ? 32.184 -24.649 -7.159 1.00 18.32 ? 292 PHE C CE2 1 ATOM 3306 C CZ . PHE C 3 145 ? 32.597 -24.203 -8.380 1.00 18.72 ? 292 PHE C CZ 1 ATOM 3307 N N . THR C 3 146 ? 27.980 -19.317 -6.412 1.00 26.71 ? 293 THR C N 1 ATOM 3308 C CA . THR C 3 146 ? 26.933 -18.414 -5.940 1.00 23.21 ? 293 THR C CA 1 ATOM 3309 C C . THR C 3 146 ? 25.646 -19.223 -5.615 1.00 23.72 ? 293 THR C C 1 ATOM 3310 O O . THR C 3 146 ? 25.215 -20.064 -6.390 1.00 23.66 ? 293 THR C O 1 ATOM 3311 C CB . THR C 3 146 ? 26.671 -17.271 -6.958 1.00 22.83 ? 293 THR C CB 1 ATOM 3312 O OG1 . THR C 3 146 ? 25.713 -16.374 -6.371 1.00 21.46 ? 293 THR C OG1 1 ATOM 3313 C CG2 . THR C 3 146 ? 26.080 -17.833 -8.251 1.00 21.22 ? 293 THR C CG2 1 ATOM 3314 N N . ASP C 3 147 ? 25.018 -18.914 -4.493 1.00 26.37 ? 294 ASP C N 1 ATOM 3315 C CA . ASP C 3 147 ? 23.712 -19.481 -4.108 1.00 29.36 ? 294 ASP C CA 1 ATOM 3316 C C . ASP C 3 147 ? 22.522 -18.985 -4.948 1.00 28.59 ? 294 ASP C C 1 ATOM 3317 O O . ASP C 3 147 ? 21.547 -19.704 -5.167 1.00 33.37 ? 294 ASP C O 1 ATOM 3318 C CB . ASP C 3 147 ? 23.439 -19.092 -2.643 1.00 35.64 ? 294 ASP C CB 1 ATOM 3319 C CG . ASP C 3 147 ? 24.109 -20.029 -1.662 1.00 41.18 ? 294 ASP C CG 1 ATOM 3320 O OD1 . ASP C 3 147 ? 24.318 -21.202 -2.040 1.00 39.13 ? 294 ASP C OD1 1 ATOM 3321 O OD2 . ASP C 3 147 ? 24.406 -19.593 -0.520 1.00 52.94 ? 294 ASP C OD2 1 ATOM 3322 N N . HIS C 3 148 ? 22.639 -17.758 -5.450 1.00 23.21 ? 295 HIS C N 1 ATOM 3323 C CA . HIS C 3 148 ? 21.594 -17.139 -6.188 1.00 24.41 ? 295 HIS C CA 1 ATOM 3324 C C . HIS C 3 148 ? 22.201 -16.623 -7.522 1.00 23.48 ? 295 HIS C C 1 ATOM 3325 O O . HIS C 3 148 ? 23.395 -16.159 -7.611 1.00 20.64 ? 295 HIS C O 1 ATOM 3326 C CB . HIS C 3 148 ? 21.007 -15.991 -5.370 1.00 29.87 ? 295 HIS C CB 1 ATOM 3327 C CG . HIS C 3 148 ? 20.546 -16.406 -3.997 1.00 33.08 ? 295 HIS C CG 1 ATOM 3328 N ND1 . HIS C 3 148 ? 21.341 -16.278 -2.868 1.00 39.08 ? 295 HIS C ND1 1 ATOM 3329 C CD2 . HIS C 3 148 ? 19.425 -17.051 -3.593 1.00 33.12 ? 295 HIS C CD2 1 ATOM 3330 C CE1 . HIS C 3 148 ? 20.716 -16.788 -1.826 1.00 36.41 ? 295 HIS C CE1 1 ATOM 3331 N NE2 . HIS C 3 148 ? 19.556 -17.278 -2.245 1.00 36.99 ? 295 HIS C NE2 1 ATOM 3332 N N . LEU C 3 149 ? 21.362 -16.634 -8.542 1.00 19.01 ? 296 LEU C N 1 ATOM 3333 C CA . LEU C 3 149 ? 21.816 -16.247 -9.865 1.00 20.15 ? 296 LEU C CA 1 ATOM 3334 C C . LEU C 3 149 ? 22.087 -14.759 -9.941 1.00 19.41 ? 296 LEU C C 1 ATOM 3335 O O . LEU C 3 149 ? 21.380 -13.924 -9.334 1.00 18.81 ? 296 LEU C O 1 ATOM 3336 C CB . LEU C 3 149 ? 20.832 -16.741 -10.939 1.00 18.46 ? 296 LEU C CB 1 ATOM 3337 C CG . LEU C 3 149 ? 21.327 -16.767 -12.405 1.00 19.05 ? 296 LEU C CG 1 ATOM 3338 C CD1 . LEU C 3 149 ? 22.431 -17.831 -12.718 1.00 17.77 ? 296 LEU C CD1 1 ATOM 3339 C CD2 . LEU C 3 149 ? 20.135 -16.997 -13.363 1.00 18.74 ? 296 LEU C CD2 1 ATOM 3340 N N . LYS C 3 150 ? 23.088 -14.428 -10.743 1.00 23.31 ? 297 LYS C N 1 ATOM 3341 C CA . LYS C 3 150 ? 23.596 -13.058 -10.883 1.00 22.70 ? 297 LYS C CA 1 ATOM 3342 C C . LYS C 3 150 ? 23.974 -12.918 -12.346 1.00 20.33 ? 297 LYS C C 1 ATOM 3343 O O . LYS C 3 150 ? 24.051 -13.921 -13.067 1.00 19.12 ? 297 LYS C O 1 ATOM 3344 C CB . LYS C 3 150 ? 24.800 -12.840 -9.934 1.00 27.81 ? 297 LYS C CB 1 ATOM 3345 C CG . LYS C 3 150 ? 25.956 -13.761 -10.290 1.00 32.18 ? 297 LYS C CG 1 ATOM 3346 C CD . LYS C 3 150 ? 26.944 -14.059 -9.170 1.00 45.60 ? 297 LYS C CD 1 ATOM 3347 C CE . LYS C 3 150 ? 28.043 -15.080 -9.594 1.00 45.25 ? 297 LYS C CE 1 ATOM 3348 N NZ . LYS C 3 150 ? 28.316 -15.085 -11.087 1.00 49.65 ? 297 LYS C NZ 1 ATOM 3349 N N . TYR C 3 151 ? 24.096 -11.698 -12.829 1.00 15.59 ? 298 TYR C N 1 ATOM 3350 C CA . TYR C 3 151 ? 24.582 -11.520 -14.160 1.00 15.99 ? 298 TYR C CA 1 ATOM 3351 C C . TYR C 3 151 ? 25.576 -10.364 -14.271 1.00 16.54 ? 298 TYR C C 1 ATOM 3352 O O . TYR C 3 151 ? 25.668 -9.539 -13.393 1.00 14.95 ? 298 TYR C O 1 ATOM 3353 C CB . TYR C 3 151 ? 23.429 -11.401 -15.161 1.00 15.85 ? 298 TYR C CB 1 ATOM 3354 C CG . TYR C 3 151 ? 22.541 -10.203 -15.025 1.00 15.61 ? 298 TYR C CG 1 ATOM 3355 C CD1 . TYR C 3 151 ? 21.465 -10.205 -14.140 1.00 17.39 ? 298 TYR C CD1 1 ATOM 3356 C CD2 . TYR C 3 151 ? 22.728 -9.056 -15.794 1.00 17.24 ? 298 TYR C CD2 1 ATOM 3357 C CE1 . TYR C 3 151 ? 20.621 -9.105 -14.034 1.00 16.15 ? 298 TYR C CE1 1 ATOM 3358 C CE2 . TYR C 3 151 ? 21.867 -7.952 -15.690 1.00 16.37 ? 298 TYR C CE2 1 ATOM 3359 C CZ . TYR C 3 151 ? 20.801 -8.020 -14.844 1.00 16.44 ? 298 TYR C CZ 1 ATOM 3360 O OH . TYR C 3 151 ? 19.980 -6.928 -14.707 1.00 19.37 ? 298 TYR C OH 1 ATOM 3361 N N . VAL C 3 152 ? 26.289 -10.301 -15.388 1.00 17.82 ? 299 VAL C N 1 ATOM 3362 C CA . VAL C 3 152 ? 27.069 -9.124 -15.720 1.00 18.52 ? 299 VAL C CA 1 ATOM 3363 C C . VAL C 3 152 ? 26.555 -8.523 -17.018 1.00 16.40 ? 299 VAL C C 1 ATOM 3364 O O . VAL C 3 152 ? 26.243 -9.223 -17.982 1.00 15.08 ? 299 VAL C O 1 ATOM 3365 C CB . VAL C 3 152 ? 28.588 -9.361 -15.745 1.00 21.42 ? 299 VAL C CB 1 ATOM 3366 C CG1 . VAL C 3 152 ? 29.042 -9.921 -14.385 1.00 24.87 ? 299 VAL C CG1 1 ATOM 3367 C CG2 . VAL C 3 152 ? 28.942 -10.390 -16.802 1.00 26.35 ? 299 VAL C CG2 1 ATOM 3368 N N . MET C 3 153 ? 26.443 -7.211 -16.990 1.00 14.09 ? 300 MET C N 1 ATOM 3369 C CA . MET C 3 153 ? 26.091 -6.418 -18.130 1.00 17.11 ? 300 MET C CA 1 ATOM 3370 C C . MET C 3 153 ? 27.398 -5.874 -18.696 1.00 15.34 ? 300 MET C C 1 ATOM 3371 O O . MET C 3 153 ? 28.104 -5.126 -18.007 1.00 15.94 ? 300 MET C O 1 ATOM 3372 C CB . MET C 3 153 ? 25.184 -5.269 -17.679 1.00 20.07 ? 300 MET C CB 1 ATOM 3373 C CG . MET C 3 153 ? 24.781 -4.351 -18.808 1.00 26.10 ? 300 MET C CG 1 ATOM 3374 S SD . MET C 3 153 ? 23.762 -2.900 -18.257 1.00 36.77 ? 300 MET C SD 1 ATOM 3375 C CE . MET C 3 153 ? 22.306 -3.691 -18.773 1.00 31.23 ? 300 MET C CE 1 ATOM 3376 N N . LEU C 3 154 ? 27.688 -6.192 -19.940 1.00 14.92 ? 301 LEU C N 1 ATOM 3377 C CA . LEU C 3 154 ? 29.067 -5.947 -20.536 1.00 16.57 ? 301 LEU C CA 1 ATOM 3378 C C . LEU C 3 154 ? 29.021 -5.679 -22.018 1.00 15.30 ? 301 LEU C C 1 ATOM 3379 O O . LEU C 3 154 ? 28.169 -6.237 -22.698 1.00 13.00 ? 301 LEU C O 1 ATOM 3380 C CB . LEU C 3 154 ? 29.958 -7.187 -20.443 1.00 18.86 ? 301 LEU C CB 1 ATOM 3381 C CG . LEU C 3 154 ? 30.425 -7.614 -19.104 1.00 25.46 ? 301 LEU C CG 1 ATOM 3382 C CD1 . LEU C 3 154 ? 31.182 -8.964 -19.298 1.00 25.42 ? 301 LEU C CD1 1 ATOM 3383 C CD2 . LEU C 3 154 ? 31.276 -6.547 -18.378 1.00 27.72 ? 301 LEU C CD2 1 ATOM 3384 N N . PRO C 3 155 ? 29.977 -4.838 -22.537 1.00 15.55 ? 302 PRO C N 1 ATOM 3385 C CA . PRO C 3 155 ? 30.120 -4.612 -23.957 1.00 14.32 ? 302 PRO C CA 1 ATOM 3386 C C . PRO C 3 155 ? 31.099 -5.584 -24.639 1.00 14.32 ? 302 PRO C C 1 ATOM 3387 O O . PRO C 3 155 ? 32.196 -5.889 -24.087 1.00 15.47 ? 302 PRO C O 1 ATOM 3388 C CB . PRO C 3 155 ? 30.702 -3.196 -24.014 1.00 14.71 ? 302 PRO C CB 1 ATOM 3389 C CG . PRO C 3 155 ? 31.402 -2.955 -22.756 1.00 14.72 ? 302 PRO C CG 1 ATOM 3390 C CD . PRO C 3 155 ? 31.016 -4.115 -21.807 1.00 15.60 ? 302 PRO C CD 1 ATOM 3391 N N . VAL C 3 156 ? 30.823 -5.912 -25.881 1.00 13.05 ? 303 VAL C N 1 ATOM 3392 C CA . VAL C 3 156 ? 31.808 -6.559 -26.724 1.00 14.67 ? 303 VAL C CA 1 ATOM 3393 C C . VAL C 3 156 ? 33.042 -5.626 -26.917 1.00 14.99 ? 303 VAL C C 1 ATOM 3394 O O . VAL C 3 156 ? 32.891 -4.450 -27.175 1.00 14.29 ? 303 VAL C O 1 ATOM 3395 C CB . VAL C 3 156 ? 31.213 -6.999 -28.057 1.00 15.21 ? 303 VAL C CB 1 ATOM 3396 C CG1 . VAL C 3 156 ? 32.256 -7.643 -28.979 1.00 15.27 ? 303 VAL C CG1 1 ATOM 3397 C CG2 . VAL C 3 156 ? 30.027 -7.966 -27.832 1.00 14.30 ? 303 VAL C CG2 1 ATOM 3398 N N . ALA C 3 157 ? 34.244 -6.168 -26.758 1.00 13.74 ? 304 ALA C N 1 ATOM 3399 C CA . ALA C 3 157 ? 35.444 -5.395 -26.786 1.00 14.80 ? 304 ALA C CA 1 ATOM 3400 C C . ALA C 3 157 ? 36.162 -5.618 -28.102 1.00 15.67 ? 304 ALA C C 1 ATOM 3401 O O . ALA C 3 157 ? 35.906 -6.559 -28.817 1.00 17.42 ? 304 ALA C O 1 ATOM 3402 C CB . ALA C 3 157 ? 36.340 -5.798 -25.654 1.00 15.64 ? 304 ALA C CB 1 ATOM 3403 N N . ASP C 3 158 ? 37.040 -4.714 -28.405 1.00 16.61 ? 305 ASP C N 1 ATOM 3404 C CA . ASP C 3 158 ? 37.896 -4.756 -29.600 1.00 19.70 ? 305 ASP C CA 1 ATOM 3405 C C . ASP C 3 158 ? 38.791 -5.988 -29.581 1.00 19.36 ? 305 ASP C C 1 ATOM 3406 O O . ASP C 3 158 ? 39.521 -6.239 -28.612 1.00 20.78 ? 305 ASP C O 1 ATOM 3407 C CB . ASP C 3 158 ? 38.765 -3.480 -29.610 1.00 22.26 ? 305 ASP C CB 1 ATOM 3408 C CG . ASP C 3 158 ? 39.687 -3.409 -30.822 1.00 26.45 ? 305 ASP C CG 1 ATOM 3409 O OD1 . ASP C 3 158 ? 40.773 -4.018 -30.918 1.00 27.01 ? 305 ASP C OD1 1 ATOM 3410 O OD2 . ASP C 3 158 ? 39.225 -2.767 -31.742 1.00 30.91 ? 305 ASP C OD2 1 ATOM 3411 N N . GLN C 3 159 ? 38.724 -6.776 -30.638 1.00 20.29 ? 306 GLN C N 1 ATOM 3412 C CA . GLN C 3 159 ? 39.403 -8.081 -30.734 1.00 21.28 ? 306 GLN C CA 1 ATOM 3413 C C . GLN C 3 159 ? 40.952 -7.937 -30.617 1.00 20.16 ? 306 GLN C C 1 ATOM 3414 O O . GLN C 3 159 ? 41.631 -8.672 -29.907 1.00 18.19 ? 306 GLN C O 1 ATOM 3415 C CB . GLN C 3 159 ? 39.042 -8.730 -32.092 1.00 22.84 ? 306 GLN C CB 1 ATOM 3416 C CG . GLN C 3 159 ? 39.513 -10.189 -32.268 1.00 22.51 ? 306 GLN C CG 1 ATOM 3417 C CD . GLN C 3 159 ? 38.766 -11.151 -31.377 1.00 25.12 ? 306 GLN C CD 1 ATOM 3418 O OE1 . GLN C 3 159 ? 37.952 -10.753 -30.553 1.00 25.01 ? 306 GLN C OE1 1 ATOM 3419 N NE2 . GLN C 3 159 ? 39.011 -12.438 -31.559 1.00 27.16 ? 306 GLN C NE2 1 ATOM 3420 N N . ASP C 3 160 ? 41.506 -6.957 -31.293 1.00 21.64 ? 307 ASP C N 1 ATOM 3421 C CA . ASP C 3 160 ? 42.952 -6.728 -31.229 1.00 23.70 ? 307 ASP C CA 1 ATOM 3422 C C . ASP C 3 160 ? 43.388 -6.306 -29.844 1.00 21.35 ? 307 ASP C C 1 ATOM 3423 O O . ASP C 3 160 ? 44.463 -6.752 -29.341 1.00 18.91 ? 307 ASP C O 1 ATOM 3424 C CB . ASP C 3 160 ? 43.371 -5.689 -32.286 1.00 28.43 ? 307 ASP C CB 1 ATOM 3425 C CG . ASP C 3 160 ? 43.670 -6.307 -33.659 1.00 36.20 ? 307 ASP C CG 1 ATOM 3426 O OD1 . ASP C 3 160 ? 43.129 -7.398 -33.986 1.00 39.86 ? 307 ASP C OD1 1 ATOM 3427 O OD2 . ASP C 3 160 ? 44.492 -5.689 -34.417 1.00 45.72 ? 307 ASP C OD2 1 ATOM 3428 N N . GLN C 3 161 ? 42.560 -5.492 -29.171 1.00 20.84 ? 308 GLN C N 1 ATOM 3429 C CA . GLN C 3 161 ? 42.929 -5.075 -27.785 1.00 21.85 ? 308 GLN C CA 1 ATOM 3430 C C . GLN C 3 161 ? 43.012 -6.339 -26.916 1.00 17.88 ? 308 GLN C C 1 ATOM 3431 O O . GLN C 3 161 ? 43.928 -6.507 -26.084 1.00 15.18 ? 308 GLN C O 1 ATOM 3432 C CB . GLN C 3 161 ? 41.915 -4.144 -27.110 1.00 26.53 ? 308 GLN C CB 1 ATOM 3433 C CG . GLN C 3 161 ? 41.841 -2.716 -27.606 1.00 38.46 ? 308 GLN C CG 1 ATOM 3434 C CD . GLN C 3 161 ? 42.946 -1.909 -26.985 1.00 50.30 ? 308 GLN C CD 1 ATOM 3435 O OE1 . GLN C 3 161 ? 43.740 -1.251 -27.673 1.00 56.16 ? 308 GLN C OE1 1 ATOM 3436 N NE2 . GLN C 3 161 ? 43.034 -1.981 -25.663 1.00 50.77 ? 308 GLN C NE2 1 ATOM 3437 N N . CYS C 3 162 ? 42.011 -7.196 -27.066 1.00 15.99 ? 309 CYS C N 1 ATOM 3438 C CA . CYS C 3 162 ? 41.888 -8.390 -26.221 1.00 16.87 ? 309 CYS C CA 1 ATOM 3439 C C . CYS C 3 162 ? 43.060 -9.347 -26.552 1.00 16.18 ? 309 CYS C C 1 ATOM 3440 O O . CYS C 3 162 ? 43.641 -9.963 -25.645 1.00 16.35 ? 309 CYS C O 1 ATOM 3441 C CB . CYS C 3 162 ? 40.565 -9.066 -26.498 1.00 17.84 ? 309 CYS C CB 1 ATOM 3442 S SG . CYS C 3 162 ? 40.263 -10.568 -25.517 1.00 21.57 ? 309 CYS C SG 1 ATOM 3443 N N . ILE C 3 163 ? 43.391 -9.495 -27.829 1.00 15.69 ? 310 ILE C N 1 ATOM 3444 C CA . ILE C 3 163 ? 44.549 -10.356 -28.221 1.00 17.60 ? 310 ILE C CA 1 ATOM 3445 C C . ILE C 3 163 ? 45.861 -9.848 -27.647 1.00 18.35 ? 310 ILE C C 1 ATOM 3446 O O . ILE C 3 163 ? 46.697 -10.638 -27.151 1.00 17.62 ? 310 ILE C O 1 ATOM 3447 C CB . ILE C 3 163 ? 44.646 -10.488 -29.755 1.00 19.06 ? 310 ILE C CB 1 ATOM 3448 C CG1 . ILE C 3 163 ? 43.470 -11.331 -30.253 1.00 21.06 ? 310 ILE C CG1 1 ATOM 3449 C CG2 . ILE C 3 163 ? 45.993 -11.111 -30.174 1.00 20.73 ? 310 ILE C CG2 1 ATOM 3450 C CD1 . ILE C 3 163 ? 43.345 -11.480 -31.789 1.00 22.39 ? 310 ILE C CD1 1 ATOM 3451 N N . ARG C 3 164 ? 46.017 -8.526 -27.624 1.00 18.16 ? 311 ARG C N 1 ATOM 3452 C CA . ARG C 3 164 ? 47.285 -7.978 -27.117 1.00 19.24 ? 311 ARG C CA 1 ATOM 3453 C C . ARG C 3 164 ? 47.341 -8.189 -25.611 1.00 17.40 ? 311 ARG C C 1 ATOM 3454 O O . ARG C 3 164 ? 48.379 -8.501 -25.058 1.00 14.34 ? 311 ARG C O 1 ATOM 3455 C CB . ARG C 3 164 ? 47.439 -6.505 -27.524 1.00 18.94 ? 311 ARG C CB 1 ATOM 3456 C CG . ARG C 3 164 ? 47.785 -6.372 -28.982 1.00 22.20 ? 311 ARG C CG 1 ATOM 3457 C CD . ARG C 3 164 ? 48.179 -4.957 -29.436 1.00 25.37 ? 311 ARG C CD 1 ATOM 3458 N NE . ARG C 3 164 ? 47.263 -3.893 -29.131 1.00 31.71 ? 311 ARG C NE 1 ATOM 3459 C CZ . ARG C 3 164 ? 46.184 -3.472 -29.855 1.00 40.00 ? 311 ARG C CZ 1 ATOM 3460 N NH1 . ARG C 3 164 ? 45.745 -4.014 -31.011 1.00 35.96 ? 311 ARG C NH1 1 ATOM 3461 N NH2 . ARG C 3 164 ? 45.492 -2.433 -29.380 1.00 38.93 ? 311 ARG C NH2 1 ATOM 3462 N N . HIS C 3 165 ? 46.191 -8.042 -24.945 1.00 16.15 ? 312 HIS C N 1 ATOM 3463 C CA . HIS C 3 165 ? 46.132 -8.280 -23.527 1.00 15.95 ? 312 HIS C CA 1 ATOM 3464 C C . HIS C 3 165 ? 46.639 -9.661 -23.062 1.00 16.02 ? 312 HIS C C 1 ATOM 3465 O O . HIS C 3 165 ? 47.353 -9.768 -22.023 1.00 15.16 ? 312 HIS C O 1 ATOM 3466 C CB . HIS C 3 165 ? 44.700 -8.039 -23.055 1.00 17.45 ? 312 HIS C CB 1 ATOM 3467 C CG . HIS C 3 165 ? 44.501 -8.136 -21.565 1.00 17.58 ? 312 HIS C CG 1 ATOM 3468 N ND1 . HIS C 3 165 ? 44.794 -7.100 -20.691 1.00 18.88 ? 312 HIS C ND1 1 ATOM 3469 C CD2 . HIS C 3 165 ? 43.992 -9.130 -20.801 1.00 17.57 ? 312 HIS C CD2 1 ATOM 3470 C CE1 . HIS C 3 165 ? 44.498 -7.466 -19.454 1.00 18.06 ? 312 HIS C CE1 1 ATOM 3471 N NE2 . HIS C 3 165 ? 44.024 -8.708 -19.494 1.00 17.46 ? 312 HIS C NE2 1 ATOM 3472 N N . TYR C 3 166 ? 46.215 -10.704 -23.760 1.00 14.99 ? 313 TYR C N 1 ATOM 3473 C CA . TYR C 3 166 ? 46.488 -12.081 -23.346 1.00 15.73 ? 313 TYR C CA 1 ATOM 3474 C C . TYR C 3 166 ? 47.703 -12.627 -24.053 1.00 15.74 ? 313 TYR C C 1 ATOM 3475 O O . TYR C 3 166 ? 48.357 -13.474 -23.500 1.00 15.05 ? 313 TYR C O 1 ATOM 3476 C CB . TYR C 3 166 ? 45.307 -13.035 -23.648 1.00 14.37 ? 313 TYR C CB 1 ATOM 3477 C CG . TYR C 3 166 ? 44.162 -12.848 -22.697 1.00 14.69 ? 313 TYR C CG 1 ATOM 3478 C CD1 . TYR C 3 166 ? 44.280 -13.242 -21.380 1.00 14.66 ? 313 TYR C CD1 1 ATOM 3479 C CD2 . TYR C 3 166 ? 42.956 -12.297 -23.095 1.00 13.33 ? 313 TYR C CD2 1 ATOM 3480 C CE1 . TYR C 3 166 ? 43.237 -13.040 -20.485 1.00 14.86 ? 313 TYR C CE1 1 ATOM 3481 C CE2 . TYR C 3 166 ? 41.897 -12.129 -22.196 1.00 14.46 ? 313 TYR C CE2 1 ATOM 3482 C CZ . TYR C 3 166 ? 42.050 -12.530 -20.894 1.00 13.81 ? 313 TYR C CZ 1 ATOM 3483 O OH . TYR C 3 166 ? 41.017 -12.399 -19.938 1.00 14.09 ? 313 TYR C OH 1 ATOM 3484 N N . GLU C 3 167 ? 48.012 -12.105 -25.251 1.00 16.65 ? 314 GLU C N 1 ATOM 3485 C CA . GLU C 3 167 ? 49.072 -12.684 -26.071 1.00 17.63 ? 314 GLU C CA 1 ATOM 3486 C C . GLU C 3 167 ? 50.206 -11.723 -26.497 1.00 19.37 ? 314 GLU C C 1 ATOM 3487 O O . GLU C 3 167 ? 51.234 -12.151 -27.161 1.00 19.34 ? 314 GLU C O 1 ATOM 3488 C CB . GLU C 3 167 ? 48.453 -13.357 -27.292 1.00 17.06 ? 314 GLU C CB 1 ATOM 3489 C CG . GLU C 3 167 ? 47.522 -14.476 -26.914 1.00 17.16 ? 314 GLU C CG 1 ATOM 3490 C CD . GLU C 3 167 ? 46.865 -15.226 -28.090 1.00 17.85 ? 314 GLU C CD 1 ATOM 3491 O OE1 . GLU C 3 167 ? 47.006 -14.834 -29.280 1.00 17.93 ? 314 GLU C OE1 1 ATOM 3492 O OE2 . GLU C 3 167 ? 46.105 -16.181 -27.837 1.00 16.18 ? 314 GLU C OE2 1 ATOM 3493 N N . GLY C 3 168 ? 50.095 -10.480 -26.042 1.00 19.29 ? 315 GLY C N 1 ATOM 3494 C CA . GLY C 3 168 ? 51.090 -9.434 -26.291 1.00 18.84 ? 315 GLY C CA 1 ATOM 3495 C C . GLY C 3 168 ? 51.040 -8.870 -27.688 1.00 18.84 ? 315 GLY C C 1 ATOM 3496 O O . GLY C 3 168 ? 51.254 -7.738 -27.836 1.00 25.13 ? 315 GLY C O 1 ATOM 3497 N N . SER C 3 169 ? 50.682 -9.619 -28.722 1.00 18.81 ? 316 SER C N 1 ATOM 3498 C CA . SER C 3 169 ? 50.780 -9.136 -30.083 1.00 19.47 ? 316 SER C CA 1 ATOM 3499 C C . SER C 3 169 ? 49.835 -9.901 -30.932 1.00 18.11 ? 316 SER C C 1 ATOM 3500 O O . SER C 3 169 ? 49.579 -11.069 -30.641 1.00 17.35 ? 316 SER C O 1 ATOM 3501 C CB . SER C 3 169 ? 52.213 -9.357 -30.662 1.00 21.21 ? 316 SER C CB 1 ATOM 3502 O OG . SER C 3 169 ? 52.286 -9.048 -32.052 1.00 18.76 ? 316 SER C OG 1 ATOM 3503 N N . THR C 3 170 ? 49.353 -9.273 -32.003 1.00 17.67 ? 317 THR C N 1 ATOM 3504 C CA . THR C 3 170 ? 48.616 -9.998 -33.047 1.00 18.72 ? 317 THR C CA 1 ATOM 3505 C C . THR C 3 170 ? 49.508 -10.791 -34.005 1.00 20.51 ? 317 THR C C 1 ATOM 3506 O O . THR C 3 170 ? 49.009 -11.585 -34.845 1.00 22.05 ? 317 THR C O 1 ATOM 3507 C CB . THR C 3 170 ? 47.703 -9.059 -33.853 1.00 18.45 ? 317 THR C CB 1 ATOM 3508 O OG1 . THR C 3 170 ? 48.453 -8.001 -34.470 1.00 19.06 ? 317 THR C OG1 1 ATOM 3509 C CG2 . THR C 3 170 ? 46.691 -8.426 -32.915 1.00 19.67 ? 317 THR C CG2 1 ATOM 3510 N N . VAL C 3 171 ? 50.802 -10.546 -33.932 1.00 21.94 ? 318 VAL C N 1 ATOM 3511 C CA . VAL C 3 171 ? 51.743 -11.187 -34.829 1.00 23.73 ? 318 VAL C CA 1 ATOM 3512 C C . VAL C 3 171 ? 52.256 -12.481 -34.211 1.00 22.22 ? 318 VAL C C 1 ATOM 3513 O O . VAL C 3 171 ? 52.804 -12.460 -33.138 1.00 22.04 ? 318 VAL C O 1 ATOM 3514 C CB . VAL C 3 171 ? 52.916 -10.219 -35.167 1.00 26.57 ? 318 VAL C CB 1 ATOM 3515 C CG1 . VAL C 3 171 ? 53.914 -10.888 -36.098 1.00 26.10 ? 318 VAL C CG1 1 ATOM 3516 C CG2 . VAL C 3 171 ? 52.357 -8.935 -35.834 1.00 26.96 ? 318 VAL C CG2 1 ATOM 3517 N N . PRO C 3 172 ? 52.090 -13.628 -34.917 1.00 24.68 ? 319 PRO C N 1 ATOM 3518 C CA . PRO C 3 172 ? 52.373 -14.914 -34.308 1.00 24.78 ? 319 PRO C CA 1 ATOM 3519 C C . PRO C 3 172 ? 53.772 -15.001 -33.723 1.00 25.69 ? 319 PRO C C 1 ATOM 3520 O O . PRO C 3 172 ? 53.930 -15.382 -32.554 1.00 24.78 ? 319 PRO C O 1 ATOM 3521 C CB . PRO C 3 172 ? 52.152 -15.909 -35.453 1.00 23.35 ? 319 PRO C CB 1 ATOM 3522 C CG . PRO C 3 172 ? 51.173 -15.282 -36.308 1.00 25.46 ? 319 PRO C CG 1 ATOM 3523 C CD . PRO C 3 172 ? 51.364 -13.787 -36.186 1.00 25.75 ? 319 PRO C CD 1 ATOM 3524 N N . GLU C 3 173 ? 54.782 -14.541 -34.450 1.00 25.89 ? 320 GLU C N 1 ATOM 3525 C CA . GLU C 3 173 ? 56.146 -14.645 -33.910 1.00 27.13 ? 320 GLU C CA 1 ATOM 3526 C C . GLU C 3 173 ? 56.436 -13.709 -32.762 1.00 28.29 ? 320 GLU C C 1 ATOM 3527 O O . GLU C 3 173 ? 57.463 -13.911 -32.070 1.00 24.25 ? 320 GLU C O 1 ATOM 3528 C CB . GLU C 3 173 ? 57.224 -14.466 -34.968 1.00 33.85 ? 320 GLU C CB 1 ATOM 3529 C CG . GLU C 3 173 ? 57.077 -13.218 -35.788 1.00 36.86 ? 320 GLU C CG 1 ATOM 3530 C CD . GLU C 3 173 ? 56.352 -13.541 -37.070 1.00 44.00 ? 320 GLU C CD 1 ATOM 3531 O OE1 . GLU C 3 173 ? 55.095 -13.819 -37.042 1.00 32.83 ? 320 GLU C OE1 1 ATOM 3532 O OE2 . GLU C 3 173 ? 57.078 -13.522 -38.112 1.00 55.90 ? 320 GLU C OE2 1 ATOM 3533 N N . LYS C 3 174 ? 55.581 -12.708 -32.504 1.00 24.32 ? 321 LYS C N 1 ATOM 3534 C CA . LYS C 3 174 ? 55.797 -11.875 -31.311 1.00 23.20 ? 321 LYS C CA 1 ATOM 3535 C C . LYS C 3 174 ? 54.976 -12.289 -30.089 1.00 22.19 ? 321 LYS C C 1 ATOM 3536 O O . LYS C 3 174 ? 55.072 -11.650 -29.054 1.00 21.84 ? 321 LYS C O 1 ATOM 3537 C CB . LYS C 3 174 ? 55.512 -10.407 -31.689 1.00 26.73 ? 321 LYS C CB 1 ATOM 3538 C CG . LYS C 3 174 ? 56.410 -9.956 -32.831 1.00 28.73 ? 321 LYS C CG 1 ATOM 3539 C CD . LYS C 3 174 ? 56.314 -8.468 -33.125 1.00 36.24 ? 321 LYS C CD 1 ATOM 3540 C CE . LYS C 3 174 ? 56.708 -8.181 -34.571 1.00 41.83 ? 321 LYS C CE 1 ATOM 3541 N NZ . LYS C 3 174 ? 57.265 -6.814 -34.711 1.00 49.25 ? 321 LYS C NZ 1 ATOM 3542 N N . LYS C 3 175 ? 54.142 -13.334 -30.181 1.00 21.58 ? 322 LYS C N 1 ATOM 3543 C CA . LYS C 3 175 ? 53.233 -13.676 -29.081 1.00 22.62 ? 322 LYS C CA 1 ATOM 3544 C C . LYS C 3 175 ? 53.997 -14.270 -27.966 1.00 22.47 ? 322 LYS C C 1 ATOM 3545 O O . LYS C 3 175 ? 54.973 -14.944 -28.200 1.00 22.97 ? 322 LYS C O 1 ATOM 3546 C CB . LYS C 3 175 ? 52.129 -14.688 -29.513 1.00 22.00 ? 322 LYS C CB 1 ATOM 3547 C CG . LYS C 3 175 ? 51.190 -14.064 -30.509 1.00 19.77 ? 322 LYS C CG 1 ATOM 3548 C CD . LYS C 3 175 ? 49.969 -14.918 -30.796 1.00 21.21 ? 322 LYS C CD 1 ATOM 3549 C CE . LYS C 3 175 ? 49.144 -14.322 -31.910 1.00 21.71 ? 322 LYS C CE 1 ATOM 3550 N NZ . LYS C 3 175 ? 48.156 -13.339 -31.389 1.00 21.44 ? 322 LYS C NZ 1 ATOM 3551 N N . THR C 3 176 ? 53.540 -13.983 -26.757 1.00 21.64 ? 323 THR C N 1 ATOM 3552 C CA . THR C 3 176 ? 54.086 -14.507 -25.524 1.00 23.56 ? 323 THR C CA 1 ATOM 3553 C C . THR C 3 176 ? 52.870 -14.739 -24.644 1.00 22.82 ? 323 THR C C 1 ATOM 3554 O O . THR C 3 176 ? 51.887 -14.021 -24.795 1.00 20.73 ? 323 THR C O 1 ATOM 3555 C CB . THR C 3 176 ? 55.054 -13.512 -24.806 1.00 24.04 ? 323 THR C CB 1 ATOM 3556 O OG1 . THR C 3 176 ? 54.350 -12.291 -24.550 1.00 25.62 ? 323 THR C OG1 1 ATOM 3557 C CG2 . THR C 3 176 ? 56.309 -13.227 -25.664 1.00 25.00 ? 323 THR C CG2 1 ATOM 3558 N N . PRO C 3 177 ? 52.933 -15.703 -23.688 1.00 27.06 ? 324 PRO C N 1 ATOM 3559 C CA . PRO C 3 177 ? 51.753 -15.866 -22.798 1.00 25.38 ? 324 PRO C CA 1 ATOM 3560 C C . PRO C 3 177 ? 51.668 -14.772 -21.761 1.00 23.52 ? 324 PRO C C 1 ATOM 3561 O O . PRO C 3 177 ? 52.265 -14.892 -20.732 1.00 27.70 ? 324 PRO C O 1 ATOM 3562 C CB . PRO C 3 177 ? 51.974 -17.241 -22.155 1.00 27.72 ? 324 PRO C CB 1 ATOM 3563 C CG . PRO C 3 177 ? 53.433 -17.458 -22.201 1.00 30.66 ? 324 PRO C CG 1 ATOM 3564 C CD . PRO C 3 177 ? 53.900 -16.798 -23.501 1.00 31.31 ? 324 PRO C CD 1 ATOM 3565 N N . LYS C 3 178 ? 50.872 -13.759 -22.006 1.00 21.04 ? 325 LYS C N 1 ATOM 3566 C CA . LYS C 3 178 ? 50.740 -12.602 -21.110 1.00 21.47 ? 325 LYS C CA 1 ATOM 3567 C C . LYS C 3 178 ? 49.551 -12.595 -20.221 1.00 18.37 ? 325 LYS C C 1 ATOM 3568 O O . LYS C 3 178 ? 49.352 -11.595 -19.545 1.00 16.79 ? 325 LYS C O 1 ATOM 3569 C CB . LYS C 3 178 ? 50.641 -11.298 -21.932 1.00 25.43 ? 325 LYS C CB 1 ATOM 3570 C CG . LYS C 3 178 ? 51.960 -10.861 -22.543 1.00 32.63 ? 325 LYS C CG 1 ATOM 3571 C CD . LYS C 3 178 ? 51.850 -9.436 -23.129 1.00 38.63 ? 325 LYS C CD 1 ATOM 3572 C CE . LYS C 3 178 ? 52.008 -8.336 -22.095 1.00 43.25 ? 325 LYS C CE 1 ATOM 3573 N NZ . LYS C 3 178 ? 53.437 -7.894 -22.007 1.00 47.74 ? 325 LYS C NZ 1 ATOM 3574 N N . SER C 3 179 ? 48.723 -13.659 -20.189 1.00 16.61 ? 326 SER C N 1 ATOM 3575 C CA . SER C 3 179 ? 47.555 -13.610 -19.390 1.00 14.92 ? 326 SER C CA 1 ATOM 3576 C C . SER C 3 179 ? 47.888 -13.235 -17.936 1.00 15.65 ? 326 SER C C 1 ATOM 3577 O O . SER C 3 179 ? 48.688 -13.938 -17.283 1.00 17.79 ? 326 SER C O 1 ATOM 3578 C CB . SER C 3 179 ? 46.877 -14.986 -19.357 1.00 14.91 ? 326 SER C CB 1 ATOM 3579 O OG . SER C 3 179 ? 45.762 -14.967 -18.508 1.00 13.38 ? 326 SER C OG 1 ATOM 3580 N N . PRO C 3 180 ? 47.256 -12.185 -17.407 1.00 14.46 ? 327 PRO C N 1 ATOM 3581 C CA . PRO C 3 180 ? 47.378 -11.827 -16.008 1.00 14.56 ? 327 PRO C CA 1 ATOM 3582 C C . PRO C 3 180 ? 47.021 -12.959 -14.986 1.00 16.21 ? 327 PRO C C 1 ATOM 3583 O O . PRO C 3 180 ? 47.456 -12.838 -13.827 1.00 16.70 ? 327 PRO C O 1 ATOM 3584 C CB . PRO C 3 180 ? 46.358 -10.687 -15.823 1.00 14.60 ? 327 PRO C CB 1 ATOM 3585 C CG . PRO C 3 180 ? 46.308 -10.041 -17.161 1.00 15.20 ? 327 PRO C CG 1 ATOM 3586 C CD . PRO C 3 180 ? 46.413 -11.202 -18.130 1.00 14.92 ? 327 PRO C CD 1 ATOM 3587 N N . VAL C 3 181 ? 46.282 -13.993 -15.387 1.00 13.84 ? 328 VAL C N 1 ATOM 3588 C CA . VAL C 3 181 ? 45.891 -15.048 -14.449 1.00 15.36 ? 328 VAL C CA 1 ATOM 3589 C C . VAL C 3 181 ? 46.665 -16.355 -14.638 1.00 16.04 ? 328 VAL C C 1 ATOM 3590 O O . VAL C 3 181 ? 46.473 -17.311 -13.903 1.00 18.81 ? 328 VAL C O 1 ATOM 3591 C CB . VAL C 3 181 ? 44.364 -15.287 -14.417 1.00 14.35 ? 328 VAL C CB 1 ATOM 3592 C CG1 . VAL C 3 181 ? 43.628 -14.017 -14.012 1.00 13.82 ? 328 VAL C CG1 1 ATOM 3593 C CG2 . VAL C 3 181 ? 43.864 -15.813 -15.743 1.00 13.97 ? 328 VAL C CG2 1 ATOM 3594 N N . GLY C 3 182 ? 47.574 -16.361 -15.581 1.00 16.80 ? 329 GLY C N 1 ATOM 3595 C CA . GLY C 3 182 ? 48.527 -17.423 -15.737 1.00 17.17 ? 329 GLY C CA 1 ATOM 3596 C C . GLY C 3 182 ? 47.980 -18.590 -16.527 1.00 18.91 ? 329 GLY C C 1 ATOM 3597 O O . GLY C 3 182 ? 48.653 -19.625 -16.573 1.00 18.74 ? 329 GLY C O 1 ATOM 3598 N N . VAL C 3 183 ? 46.760 -18.455 -17.060 1.00 16.64 ? 330 VAL C N 1 ATOM 3599 C CA . VAL C 3 183 ? 46.241 -19.379 -18.082 1.00 19.38 ? 330 VAL C CA 1 ATOM 3600 C C . VAL C 3 183 ? 45.683 -18.593 -19.258 1.00 16.23 ? 330 VAL C C 1 ATOM 3601 O O . VAL C 3 183 ? 45.105 -17.482 -19.107 1.00 13.82 ? 330 VAL C O 1 ATOM 3602 C CB . VAL C 3 183 ? 45.287 -20.536 -17.582 1.00 21.89 ? 330 VAL C CB 1 ATOM 3603 C CG1 . VAL C 3 183 ? 45.112 -20.619 -16.107 1.00 24.00 ? 330 VAL C CG1 1 ATOM 3604 C CG2 . VAL C 3 183 ? 43.994 -20.663 -18.321 1.00 22.98 ? 330 VAL C CG2 1 ATOM 3605 N N . GLN C 3 184 ? 45.901 -19.193 -20.422 1.00 14.48 ? 331 GLN C N 1 ATOM 3606 C CA . GLN C 3 184 ? 45.610 -18.562 -21.722 1.00 15.41 ? 331 GLN C CA 1 ATOM 3607 C C . GLN C 3 184 ? 44.255 -18.953 -22.273 1.00 13.70 ? 331 GLN C C 1 ATOM 3608 O O . GLN C 3 184 ? 43.913 -20.104 -22.283 1.00 16.90 ? 331 GLN C O 1 ATOM 3609 C CB . GLN C 3 184 ? 46.682 -18.930 -22.812 1.00 14.95 ? 331 GLN C CB 1 ATOM 3610 C CG . GLN C 3 184 ? 48.115 -18.426 -22.512 1.00 16.10 ? 331 GLN C CG 1 ATOM 3611 C CD . GLN C 3 184 ? 48.210 -16.924 -22.320 1.00 16.79 ? 331 GLN C CD 1 ATOM 3612 O OE1 . GLN C 3 184 ? 48.814 -16.443 -21.376 1.00 16.81 ? 331 GLN C OE1 1 ATOM 3613 N NE2 . GLN C 3 184 ? 47.532 -16.171 -23.177 1.00 19.58 ? 331 GLN C NE2 1 ATOM 3614 N N . PRO C 3 185 ? 43.484 -17.998 -22.734 1.00 14.76 ? 332 PRO C N 1 ATOM 3615 C CA . PRO C 3 185 ? 42.194 -18.342 -23.355 1.00 15.08 ? 332 PRO C CA 1 ATOM 3616 C C . PRO C 3 185 ? 42.470 -18.883 -24.759 1.00 15.60 ? 332 PRO C C 1 ATOM 3617 O O . PRO C 3 185 ? 43.537 -18.700 -25.277 1.00 11.32 ? 332 PRO C O 1 ATOM 3618 C CB . PRO C 3 185 ? 41.467 -17.005 -23.435 1.00 14.96 ? 332 PRO C CB 1 ATOM 3619 C CG . PRO C 3 185 ? 42.507 -15.950 -23.315 1.00 16.09 ? 332 PRO C CG 1 ATOM 3620 C CD . PRO C 3 185 ? 43.699 -16.545 -22.626 1.00 15.55 ? 332 PRO C CD 1 ATOM 3621 N N . ILE C 3 186 ? 41.441 -19.504 -25.340 1.00 16.31 ? 333 ILE C N 1 ATOM 3622 C CA . ILE C 3 186 ? 41.397 -19.826 -26.729 1.00 15.89 ? 333 ILE C CA 1 ATOM 3623 C C . ILE C 3 186 ? 40.830 -18.605 -27.430 1.00 15.45 ? 333 ILE C C 1 ATOM 3624 O O . ILE C 3 186 ? 39.665 -18.201 -27.203 1.00 14.44 ? 333 ILE C O 1 ATOM 3625 C CB . ILE C 3 186 ? 40.514 -21.046 -26.972 1.00 15.63 ? 333 ILE C CB 1 ATOM 3626 C CG1 . ILE C 3 186 ? 41.213 -22.313 -26.421 1.00 15.78 ? 333 ILE C CG1 1 ATOM 3627 C CG2 . ILE C 3 186 ? 40.284 -21.242 -28.467 1.00 15.55 ? 333 ILE C CG2 1 ATOM 3628 C CD1 . ILE C 3 186 ? 40.223 -23.448 -26.169 1.00 16.04 ? 333 ILE C CD1 1 ATOM 3629 N N . LEU C 3 187 ? 41.680 -17.988 -28.230 1.00 15.89 ? 334 LEU C N 1 ATOM 3630 C CA . LEU C 3 187 ? 41.359 -16.779 -28.943 1.00 15.56 ? 334 LEU C CA 1 ATOM 3631 C C . LEU C 3 187 ? 41.553 -16.898 -30.400 1.00 15.66 ? 334 LEU C C 1 ATOM 3632 O O . LEU C 3 187 ? 42.627 -17.160 -30.832 1.00 16.65 ? 334 LEU C O 1 ATOM 3633 C CB . LEU C 3 187 ? 42.226 -15.625 -28.498 1.00 16.48 ? 334 LEU C CB 1 ATOM 3634 C CG . LEU C 3 187 ? 41.858 -14.854 -27.304 1.00 16.96 ? 334 LEU C CG 1 ATOM 3635 C CD1 . LEU C 3 187 ? 43.090 -14.089 -26.819 1.00 18.03 ? 334 LEU C CD1 1 ATOM 3636 C CD2 . LEU C 3 187 ? 40.736 -13.930 -27.664 1.00 18.30 ? 334 LEU C CD2 1 ATOM 3637 N N . ASN C 3 188 ? 40.519 -16.632 -31.177 1.00 14.83 ? 335 ASN C N 1 ATOM 3638 C CA . ASN C 3 188 ? 40.645 -16.700 -32.624 1.00 15.88 ? 335 ASN C CA 1 ATOM 3639 C C . ASN C 3 188 ? 39.427 -15.984 -33.308 1.00 17.12 ? 335 ASN C C 1 ATOM 3640 O O . ASN C 3 188 ? 38.637 -15.333 -32.664 1.00 14.55 ? 335 ASN C O 1 ATOM 3641 C CB . ASN C 3 188 ? 40.833 -18.167 -33.086 1.00 14.15 ? 335 ASN C CB 1 ATOM 3642 C CG . ASN C 3 188 ? 39.670 -19.077 -32.663 1.00 14.81 ? 335 ASN C CG 1 ATOM 3643 O OD1 . ASN C 3 188 ? 38.504 -18.767 -32.903 1.00 14.35 ? 335 ASN C OD1 1 ATOM 3644 N ND2 . ASN C 3 188 ? 39.993 -20.198 -31.995 1.00 15.33 ? 335 ASN C ND2 1 ATOM 3645 N N . GLU C 3 189 ? 39.299 -16.169 -34.615 1.00 20.25 ? 336 GLU C N 1 ATOM 3646 C CA . GLU C 3 189 ? 38.298 -15.511 -35.427 1.00 23.98 ? 336 GLU C CA 1 ATOM 3647 C C . GLU C 3 189 ? 36.911 -16.124 -35.068 1.00 22.80 ? 336 GLU C C 1 ATOM 3648 O O . GLU C 3 189 ? 35.876 -15.554 -35.383 1.00 21.92 ? 336 GLU C O 1 ATOM 3649 C CB . GLU C 3 189 ? 38.646 -15.710 -36.931 1.00 28.58 ? 336 GLU C CB 1 ATOM 3650 C CG . GLU C 3 189 ? 38.866 -17.199 -37.383 1.00 34.35 ? 336 GLU C CG 1 ATOM 3651 C CD . GLU C 3 189 ? 40.182 -17.949 -36.890 1.00 40.47 ? 336 GLU C CD 1 ATOM 3652 O OE1 . GLU C 3 189 ? 41.186 -17.307 -36.423 1.00 44.60 ? 336 GLU C OE1 1 ATOM 3653 O OE2 . GLU C 3 189 ? 40.240 -19.221 -36.966 1.00 34.79 ? 336 GLU C OE2 1 ATOM 3654 N N . HIS C 3 190 ? 36.879 -17.270 -34.390 1.00 19.79 ? 337 HIS C N 1 ATOM 3655 C CA . HIS C 3 190 ? 35.620 -17.824 -33.882 1.00 18.70 ? 337 HIS C CA 1 ATOM 3656 C C . HIS C 3 190 ? 35.163 -17.309 -32.500 1.00 16.47 ? 337 HIS C C 1 ATOM 3657 O O . HIS C 3 190 ? 34.084 -17.727 -31.990 1.00 17.18 ? 337 HIS C O 1 ATOM 3658 C CB . HIS C 3 190 ? 35.650 -19.346 -33.783 1.00 23.65 ? 337 HIS C CB 1 ATOM 3659 C CG . HIS C 3 190 ? 35.753 -20.083 -35.075 1.00 28.07 ? 337 HIS C CG 1 ATOM 3660 N ND1 . HIS C 3 190 ? 36.816 -19.942 -35.941 1.00 33.85 ? 337 HIS C ND1 1 ATOM 3661 C CD2 . HIS C 3 190 ? 35.021 -21.126 -35.547 1.00 35.41 ? 337 HIS C CD2 1 ATOM 3662 C CE1 . HIS C 3 190 ? 36.677 -20.772 -36.955 1.00 34.16 ? 337 HIS C CE1 1 ATOM 3663 N NE2 . HIS C 3 190 ? 35.622 -21.540 -36.720 1.00 40.53 ? 337 HIS C NE2 1 ATOM 3664 N N . THR C 3 191 ? 35.932 -16.419 -31.885 1.00 15.34 ? 338 THR C N 1 ATOM 3665 C CA . THR C 3 191 ? 35.596 -15.918 -30.556 1.00 15.68 ? 338 THR C CA 1 ATOM 3666 C C . THR C 3 191 ? 35.444 -14.406 -30.519 1.00 15.36 ? 338 THR C C 1 ATOM 3667 O O . THR C 3 191 ? 36.012 -13.765 -31.356 1.00 13.48 ? 338 THR C O 1 ATOM 3668 C CB . THR C 3 191 ? 36.695 -16.307 -29.556 1.00 14.44 ? 338 THR C CB 1 ATOM 3669 O OG1 . THR C 3 191 ? 37.932 -15.690 -29.889 1.00 14.52 ? 338 THR C OG1 1 ATOM 3670 C CG2 . THR C 3 191 ? 36.935 -17.827 -29.543 1.00 15.58 ? 338 THR C CG2 1 ATOM 3671 N N . PHE C 3 192 ? 34.805 -13.866 -29.483 1.00 13.88 ? 339 PHE C N 1 ATOM 3672 C CA . PHE C 3 192 ? 34.870 -12.435 -29.133 1.00 12.77 ? 339 PHE C CA 1 ATOM 3673 C C . PHE C 3 192 ? 35.106 -12.284 -27.621 1.00 12.69 ? 339 PHE C C 1 ATOM 3674 O O . PHE C 3 192 ? 34.942 -13.206 -26.809 1.00 12.58 ? 339 PHE C O 1 ATOM 3675 C CB . PHE C 3 192 ? 33.615 -11.643 -29.612 1.00 12.13 ? 339 PHE C CB 1 ATOM 3676 C CG . PHE C 3 192 ? 32.345 -11.982 -28.859 1.00 12.68 ? 339 PHE C CG 1 ATOM 3677 C CD1 . PHE C 3 192 ? 31.975 -11.334 -27.699 1.00 13.32 ? 339 PHE C CD1 1 ATOM 3678 C CD2 . PHE C 3 192 ? 31.485 -12.945 -29.335 1.00 14.00 ? 339 PHE C CD2 1 ATOM 3679 C CE1 . PHE C 3 192 ? 30.760 -11.656 -27.037 1.00 13.57 ? 339 PHE C CE1 1 ATOM 3680 C CE2 . PHE C 3 192 ? 30.280 -13.274 -28.677 1.00 14.21 ? 339 PHE C CE2 1 ATOM 3681 C CZ . PHE C 3 192 ? 29.927 -12.640 -27.520 1.00 13.64 ? 339 PHE C CZ 1 ATOM 3682 N N . CYS C 3 193 ? 35.582 -11.114 -27.257 1.00 12.48 ? 340 CYS C N 1 ATOM 3683 C CA . CYS C 3 193 ? 35.905 -10.791 -25.938 1.00 13.35 ? 340 CYS C CA 1 ATOM 3684 C C . CYS C 3 193 ? 34.901 -9.812 -25.460 1.00 13.10 ? 340 CYS C C 1 ATOM 3685 O O . CYS C 3 193 ? 34.384 -9.039 -26.257 1.00 12.60 ? 340 CYS C O 1 ATOM 3686 C CB . CYS C 3 193 ? 37.281 -10.134 -25.857 1.00 15.64 ? 340 CYS C CB 1 ATOM 3687 S SG . CYS C 3 193 ? 38.547 -11.314 -26.329 1.00 20.03 ? 340 CYS C SG 1 ATOM 3688 N N . ALA C 3 194 ? 34.582 -9.884 -24.180 1.00 13.77 ? 341 ALA C N 1 ATOM 3689 C CA . ALA C 3 194 ? 33.803 -8.837 -23.580 1.00 17.10 ? 341 ALA C CA 1 ATOM 3690 C C . ALA C 3 194 ? 34.355 -8.317 -22.282 1.00 18.05 ? 341 ALA C C 1 ATOM 3691 O O . ALA C 3 194 ? 35.010 -9.030 -21.554 1.00 20.16 ? 341 ALA C O 1 ATOM 3692 C CB . ALA C 3 194 ? 32.345 -9.186 -23.479 1.00 16.38 ? 341 ALA C CB 1 ATOM 3693 N N . GLY C 3 195 ? 34.140 -7.018 -22.067 1.00 21.65 ? 342 GLY C N 1 ATOM 3694 C CA . GLY C 3 195 ? 34.569 -6.328 -20.826 1.00 23.82 ? 342 GLY C CA 1 ATOM 3695 C C . GLY C 3 195 ? 35.028 -4.915 -21.081 1.00 25.88 ? 342 GLY C C 1 ATOM 3696 O O . GLY C 3 195 ? 35.077 -4.453 -22.221 1.00 22.75 ? 342 GLY C O 1 ATOM 3697 N N . MET C 3 196 ? 35.361 -4.244 -19.983 1.00 32.66 ? 343 MET C N 1 ATOM 3698 C CA . MET C 3 196 ? 35.876 -2.857 -19.930 1.00 32.63 ? 343 MET C CA 1 ATOM 3699 C C . MET C 3 196 ? 36.883 -2.787 -18.742 1.00 33.17 ? 343 MET C C 1 ATOM 3700 O O . MET C 3 196 ? 36.857 -3.664 -17.888 1.00 29.21 ? 343 MET C O 1 ATOM 3701 C CB . MET C 3 196 ? 34.695 -1.850 -19.802 1.00 38.92 ? 343 MET C CB 1 ATOM 3702 C CG . MET C 3 196 ? 33.902 -1.827 -18.496 1.00 43.67 ? 343 MET C CG 1 ATOM 3703 S SD . MET C 3 196 ? 32.897 -0.299 -18.389 1.00 53.62 ? 343 MET C SD 1 ATOM 3704 C CE . MET C 3 196 ? 33.953 1.167 -18.621 1.00 45.38 ? 343 MET C CE 1 ATOM 3705 N N . SER C 3 197 ? 37.798 -1.806 -18.701 1.00 35.22 ? 344 SER C N 1 ATOM 3706 C CA . SER C 3 197 ? 38.672 -1.630 -17.523 1.00 35.92 ? 344 SER C CA 1 ATOM 3707 C C . SER C 3 197 ? 37.874 -1.074 -16.375 1.00 39.08 ? 344 SER C C 1 ATOM 3708 O O . SER C 3 197 ? 37.555 0.130 -16.362 1.00 39.59 ? 344 SER C O 1 ATOM 3709 C CB . SER C 3 197 ? 39.798 -0.643 -17.793 1.00 35.05 ? 344 SER C CB 1 ATOM 3710 O OG . SER C 3 197 ? 40.394 -1.033 -19.000 1.00 38.13 ? 344 SER C OG 1 ATOM 3711 N N . LYS C 3 198 ? 37.563 -1.920 -15.408 1.00 33.24 ? 345 LYS C N 1 ATOM 3712 C CA . LYS C 3 198 ? 36.841 -1.437 -14.252 1.00 34.87 ? 345 LYS C CA 1 ATOM 3713 C C . LYS C 3 198 ? 37.050 -2.450 -13.178 1.00 37.05 ? 345 LYS C C 1 ATOM 3714 O O . LYS C 3 198 ? 36.844 -3.633 -13.438 1.00 32.69 ? 345 LYS C O 1 ATOM 3715 C CB . LYS C 3 198 ? 35.348 -1.356 -14.573 1.00 38.04 ? 345 LYS C CB 1 ATOM 3716 C CG . LYS C 3 198 ? 34.497 -1.182 -13.318 1.00 42.21 ? 345 LYS C CG 1 ATOM 3717 C CD . LYS C 3 198 ? 32.987 -1.146 -13.599 1.00 41.06 ? 345 LYS C CD 1 ATOM 3718 C CE . LYS C 3 198 ? 32.235 -1.033 -12.262 1.00 37.89 ? 345 LYS C CE 1 ATOM 3719 N NZ . LYS C 3 198 ? 30.777 -0.975 -12.468 1.00 34.40 ? 345 LYS C NZ 1 ATOM 3720 N N . TYR C 3 199 ? 37.423 -2.042 -11.974 1.00 34.52 ? 346 TYR C N 1 ATOM 3721 C CA . TYR C 3 199 ? 37.364 -3.029 -10.845 1.00 42.55 ? 346 TYR C CA 1 ATOM 3722 C C . TYR C 3 199 ? 35.928 -3.480 -10.518 1.00 42.84 ? 346 TYR C C 1 ATOM 3723 O O . TYR C 3 199 ? 35.112 -2.723 -9.946 1.00 43.59 ? 346 TYR C O 1 ATOM 3724 C CB . TYR C 3 199 ? 38.026 -2.514 -9.570 1.00 41.47 ? 346 TYR C CB 1 ATOM 3725 C CG . TYR C 3 199 ? 38.315 -3.619 -8.602 1.00 43.10 ? 346 TYR C CG 1 ATOM 3726 C CD1 . TYR C 3 199 ? 38.647 -4.923 -9.059 1.00 46.28 ? 346 TYR C CD1 1 ATOM 3727 C CD2 . TYR C 3 199 ? 38.270 -3.388 -7.213 1.00 44.51 ? 346 TYR C CD2 1 ATOM 3728 C CE1 . TYR C 3 199 ? 38.951 -5.963 -8.147 1.00 45.78 ? 346 TYR C CE1 1 ATOM 3729 C CE2 . TYR C 3 199 ? 38.562 -4.423 -6.300 1.00 47.12 ? 346 TYR C CE2 1 ATOM 3730 C CZ . TYR C 3 199 ? 38.905 -5.701 -6.781 1.00 45.74 ? 346 TYR C CZ 1 ATOM 3731 O OH . TYR C 3 199 ? 39.200 -6.728 -5.921 1.00 53.72 ? 346 TYR C OH 1 ATOM 3732 N N . GLN C 3 200 ? 35.590 -4.700 -10.895 1.00 36.92 ? 347 GLN C N 1 ATOM 3733 C CA . GLN C 3 200 ? 34.179 -5.016 -10.908 1.00 44.40 ? 347 GLN C CA 1 ATOM 3734 C C . GLN C 3 200 ? 34.013 -6.405 -10.489 1.00 41.02 ? 347 GLN C C 1 ATOM 3735 O O . GLN C 3 200 ? 34.986 -7.099 -10.152 1.00 34.88 ? 347 GLN C O 1 ATOM 3736 C CB . GLN C 3 200 ? 33.465 -4.750 -12.282 1.00 53.25 ? 347 GLN C CB 1 ATOM 3737 C CG . GLN C 3 200 ? 34.192 -5.279 -13.530 1.00 65.98 ? 347 GLN C CG 1 ATOM 3738 C CD . GLN C 3 200 ? 33.351 -5.377 -14.821 1.00 78.94 ? 347 GLN C CD 1 ATOM 3739 O OE1 . GLN C 3 200 ? 32.905 -4.358 -15.401 1.00 86.10 ? 347 GLN C OE1 1 ATOM 3740 N NE2 . GLN C 3 200 ? 33.193 -6.616 -15.315 1.00 75.49 ? 347 GLN C NE2 1 ATOM 3741 N N . GLU C 3 201 ? 32.736 -6.720 -10.375 1.00 33.36 ? 348 GLU C N 1 ATOM 3742 C CA . GLU C 3 201 ? 32.269 -8.052 -10.475 1.00 37.31 ? 348 GLU C CA 1 ATOM 3743 C C . GLU C 3 201 ? 32.590 -8.451 -11.931 1.00 32.89 ? 348 GLU C C 1 ATOM 3744 O O . GLU C 3 201 ? 32.413 -7.667 -12.870 1.00 38.39 ? 348 GLU C O 1 ATOM 3745 C CB . GLU C 3 201 ? 30.766 -8.074 -10.177 1.00 40.44 ? 348 GLU C CB 1 ATOM 3746 C CG . GLU C 3 201 ? 30.379 -7.209 -8.966 1.00 42.50 ? 348 GLU C CG 1 ATOM 3747 C CD . GLU C 3 201 ? 29.551 -5.977 -9.328 1.00 40.22 ? 348 GLU C CD 1 ATOM 3748 O OE1 . GLU C 3 201 ? 28.492 -6.010 -8.673 1.00 39.99 ? 348 GLU C OE1 1 ATOM 3749 O OE2 . GLU C 3 201 ? 29.902 -5.037 -10.200 1.00 29.96 ? 348 GLU C OE2 1 ATOM 3750 N N . ASP C 3 202 ? 33.137 -9.637 -12.101 1.00 27.65 ? 349 ASP C N 1 ATOM 3751 C CA . ASP C 3 202 ? 33.556 -10.113 -13.420 1.00 22.45 ? 349 ASP C CA 1 ATOM 3752 C C . ASP C 3 202 ? 33.059 -11.535 -13.465 1.00 21.03 ? 349 ASP C C 1 ATOM 3753 O O . ASP C 3 202 ? 32.596 -12.066 -12.446 1.00 18.60 ? 349 ASP C O 1 ATOM 3754 C CB . ASP C 3 202 ? 35.075 -9.980 -13.554 1.00 22.16 ? 349 ASP C CB 1 ATOM 3755 C CG . ASP C 3 202 ? 35.568 -10.253 -14.968 1.00 24.32 ? 349 ASP C CG 1 ATOM 3756 O OD1 . ASP C 3 202 ? 34.721 -10.250 -15.858 1.00 24.48 ? 349 ASP C OD1 1 ATOM 3757 O OD2 . ASP C 3 202 ? 36.793 -10.493 -15.186 1.00 24.51 ? 349 ASP C OD2 1 ATOM 3758 N N . THR C 3 203 ? 33.110 -12.186 -14.618 1.00 18.90 ? 350 THR C N 1 ATOM 3759 C CA . THR C 3 203 ? 32.837 -13.591 -14.653 1.00 16.08 ? 350 THR C CA 1 ATOM 3760 C C . THR C 3 203 ? 34.028 -14.279 -14.017 1.00 15.80 ? 350 THR C C 1 ATOM 3761 O O . THR C 3 203 ? 35.139 -13.746 -14.001 1.00 13.44 ? 350 THR C O 1 ATOM 3762 C CB . THR C 3 203 ? 32.555 -14.039 -16.095 1.00 14.56 ? 350 THR C CB 1 ATOM 3763 O OG1 . THR C 3 203 ? 33.548 -13.524 -16.911 1.00 13.88 ? 350 THR C OG1 1 ATOM 3764 C CG2 . THR C 3 203 ? 31.143 -13.534 -16.565 1.00 14.02 ? 350 THR C CG2 1 ATOM 3765 N N . CYS C 3 204 ? 33.791 -15.465 -13.451 1.00 16.11 ? 351 CYS C N 1 ATOM 3766 C CA . CYS C 3 204 ? 34.858 -16.213 -12.785 1.00 15.73 ? 351 CYS C CA 1 ATOM 3767 C C . CYS C 3 204 ? 34.464 -17.720 -12.795 1.00 15.07 ? 351 CYS C C 1 ATOM 3768 O O . CYS C 3 204 ? 33.486 -18.110 -13.491 1.00 14.66 ? 351 CYS C O 1 ATOM 3769 C CB . CYS C 3 204 ? 35.131 -15.616 -11.396 1.00 16.05 ? 351 CYS C CB 1 ATOM 3770 S SG . CYS C 3 204 ? 36.632 -16.217 -10.582 1.00 17.84 ? 351 CYS C SG 1 ATOM 3771 N N . TYR C 3 205 ? 35.223 -18.556 -12.099 1.00 13.77 ? 352 TYR C N 1 ATOM 3772 C CA . TYR C 3 205 ? 35.174 -19.997 -12.290 1.00 13.41 ? 352 TYR C CA 1 ATOM 3773 C C . TYR C 3 205 ? 33.747 -20.623 -12.126 1.00 13.70 ? 352 TYR C C 1 ATOM 3774 O O . TYR C 3 205 ? 33.097 -20.426 -11.096 1.00 13.90 ? 352 TYR C O 1 ATOM 3775 C CB . TYR C 3 205 ? 36.143 -20.765 -11.327 1.00 13.93 ? 352 TYR C CB 1 ATOM 3776 C CG . TYR C 3 205 ? 37.493 -20.212 -11.170 1.00 14.79 ? 352 TYR C CG 1 ATOM 3777 C CD1 . TYR C 3 205 ? 38.158 -19.636 -12.230 1.00 14.83 ? 352 TYR C CD1 1 ATOM 3778 C CD2 . TYR C 3 205 ? 38.135 -20.236 -9.925 1.00 15.80 ? 352 TYR C CD2 1 ATOM 3779 C CE1 . TYR C 3 205 ? 39.420 -19.086 -12.051 1.00 16.67 ? 352 TYR C CE1 1 ATOM 3780 C CE2 . TYR C 3 205 ? 39.378 -19.677 -9.732 1.00 14.88 ? 352 TYR C CE2 1 ATOM 3781 C CZ . TYR C 3 205 ? 40.052 -19.117 -10.784 1.00 16.57 ? 352 TYR C CZ 1 ATOM 3782 O OH . TYR C 3 205 ? 41.335 -18.575 -10.617 1.00 17.21 ? 352 TYR C OH 1 ATOM 3783 N N . GLY C 3 206 ? 33.289 -21.280 -13.202 1.00 12.24 ? 353 GLY C N 1 ATOM 3784 C CA . GLY C 3 206 ? 32.026 -21.912 -13.284 1.00 13.20 ? 353 GLY C CA 1 ATOM 3785 C C . GLY C 3 206 ? 31.022 -21.194 -14.167 1.00 12.01 ? 353 GLY C C 1 ATOM 3786 O O . GLY C 3 206 ? 29.971 -21.703 -14.459 1.00 11.69 ? 353 GLY C O 1 ATOM 3787 N N . ASP C 3 207 ? 31.318 -19.976 -14.522 1.00 12.24 ? 354 ASP C N 1 ATOM 3788 C CA . ASP C 3 207 ? 30.436 -19.215 -15.401 1.00 12.58 ? 354 ASP C CA 1 ATOM 3789 C C . ASP C 3 207 ? 30.458 -19.660 -16.876 1.00 12.94 ? 354 ASP C C 1 ATOM 3790 O O . ASP C 3 207 ? 29.476 -19.410 -17.610 1.00 14.09 ? 354 ASP C O 1 ATOM 3791 C CB . ASP C 3 207 ? 30.743 -17.728 -15.323 1.00 13.19 ? 354 ASP C CB 1 ATOM 3792 C CG . ASP C 3 207 ? 30.203 -17.061 -14.049 1.00 15.48 ? 354 ASP C CG 1 ATOM 3793 O OD1 . ASP C 3 207 ? 29.110 -17.446 -13.521 1.00 16.81 ? 354 ASP C OD1 1 ATOM 3794 O OD2 . ASP C 3 207 ? 30.860 -16.078 -13.654 1.00 14.92 ? 354 ASP C OD2 1 ATOM 3795 N N . ALA C 3 208 ? 31.551 -20.264 -17.314 1.00 12.22 ? 355 ALA C N 1 ATOM 3796 C CA . ALA C 3 208 ? 31.642 -20.788 -18.665 1.00 12.76 ? 355 ALA C CA 1 ATOM 3797 C C . ALA C 3 208 ? 30.429 -21.646 -18.940 1.00 12.86 ? 355 ALA C C 1 ATOM 3798 O O . ALA C 3 208 ? 29.934 -22.383 -18.061 1.00 11.32 ? 355 ALA C O 1 ATOM 3799 C CB . ALA C 3 208 ? 32.945 -21.644 -18.849 1.00 11.71 ? 355 ALA C CB 1 ATOM 3800 N N . GLY C 3 209 ? 30.023 -21.629 -20.205 1.00 13.17 ? 356 GLY C N 1 ATOM 3801 C CA . GLY C 3 209 ? 28.863 -22.390 -20.688 1.00 13.24 ? 356 GLY C CA 1 ATOM 3802 C C . GLY C 3 209 ? 27.626 -21.559 -20.702 1.00 12.62 ? 356 GLY C C 1 ATOM 3803 O O . GLY C 3 209 ? 26.607 -21.931 -21.325 1.00 12.77 ? 356 GLY C O 1 ATOM 3804 N N . SER C 3 210 ? 27.695 -20.420 -20.050 1.00 12.13 ? 357 SER C N 1 ATOM 3805 C CA . SER C 3 210 ? 26.571 -19.511 -20.010 1.00 12.41 ? 357 SER C CA 1 ATOM 3806 C C . SER C 3 210 ? 26.538 -18.616 -21.234 1.00 12.77 ? 357 SER C C 1 ATOM 3807 O O . SER C 3 210 ? 27.543 -18.444 -21.892 1.00 12.83 ? 357 SER C O 1 ATOM 3808 C CB . SER C 3 210 ? 26.640 -18.681 -18.742 1.00 13.17 ? 357 SER C CB 1 ATOM 3809 O OG . SER C 3 210 ? 26.629 -19.451 -17.582 1.00 13.53 ? 357 SER C OG 1 ATOM 3810 N N . ALA C 3 211 ? 25.369 -18.071 -21.571 1.00 12.87 ? 358 ALA C N 1 ATOM 3811 C CA . ALA C 3 211 ? 25.215 -17.243 -22.772 1.00 12.65 ? 358 ALA C CA 1 ATOM 3812 C C . ALA C 3 211 ? 25.455 -15.791 -22.523 1.00 12.59 ? 358 ALA C C 1 ATOM 3813 O O . ALA C 3 211 ? 25.054 -15.260 -21.498 1.00 12.67 ? 358 ALA C O 1 ATOM 3814 C CB . ALA C 3 211 ? 23.773 -17.429 -23.312 1.00 13.64 ? 358 ALA C CB 1 ATOM 3815 N N . PHE C 3 212 ? 26.184 -15.172 -23.451 1.00 13.59 ? 359 PHE C N 1 ATOM 3816 C CA . PHE C 3 212 ? 26.169 -13.727 -23.712 1.00 13.20 ? 359 PHE C CA 1 ATOM 3817 C C . PHE C 3 212 ? 24.911 -13.451 -24.536 1.00 13.82 ? 359 PHE C C 1 ATOM 3818 O O . PHE C 3 212 ? 24.859 -13.731 -25.725 1.00 13.59 ? 359 PHE C O 1 ATOM 3819 C CB . PHE C 3 212 ? 27.406 -13.299 -24.492 1.00 12.99 ? 359 PHE C CB 1 ATOM 3820 C CG . PHE C 3 212 ? 27.538 -11.782 -24.661 1.00 14.75 ? 359 PHE C CG 1 ATOM 3821 C CD1 . PHE C 3 212 ? 28.260 -11.023 -23.757 1.00 14.74 ? 359 PHE C CD1 1 ATOM 3822 C CD2 . PHE C 3 212 ? 26.974 -11.127 -25.791 1.00 13.90 ? 359 PHE C CD2 1 ATOM 3823 C CE1 . PHE C 3 212 ? 28.362 -9.625 -23.886 1.00 16.44 ? 359 PHE C CE1 1 ATOM 3824 C CE2 . PHE C 3 212 ? 27.122 -9.723 -25.963 1.00 14.77 ? 359 PHE C CE2 1 ATOM 3825 C CZ . PHE C 3 212 ? 27.820 -8.971 -25.019 1.00 16.04 ? 359 PHE C CZ 1 ATOM 3826 N N . ALA C 3 213 ? 23.885 -12.991 -23.838 1.00 13.22 ? 360 ALA C N 1 ATOM 3827 C CA . ALA C 3 213 ? 22.574 -12.813 -24.396 1.00 13.01 ? 360 ALA C CA 1 ATOM 3828 C C . ALA C 3 213 ? 22.417 -11.372 -24.878 1.00 13.53 ? 360 ALA C C 1 ATOM 3829 O O . ALA C 3 213 ? 22.665 -10.419 -24.122 1.00 12.69 ? 360 ALA C O 1 ATOM 3830 C CB . ALA C 3 213 ? 21.524 -13.103 -23.329 1.00 10.95 ? 360 ALA C CB 1 ATOM 3831 N N . VAL C 3 214 ? 21.919 -11.240 -26.096 1.00 14.01 ? 361 VAL C N 1 ATOM 3832 C CA . VAL C 3 214 ? 21.546 -9.962 -26.681 1.00 14.11 ? 361 VAL C CA 1 ATOM 3833 C C . VAL C 3 214 ? 20.051 -9.869 -26.930 1.00 14.88 ? 361 VAL C C 1 ATOM 3834 O O . VAL C 3 214 ? 19.454 -10.796 -27.418 1.00 14.63 ? 361 VAL C O 1 ATOM 3835 C CB . VAL C 3 214 ? 22.313 -9.765 -28.005 1.00 14.21 ? 361 VAL C CB 1 ATOM 3836 C CG1 . VAL C 3 214 ? 21.784 -8.550 -28.780 1.00 13.54 ? 361 VAL C CG1 1 ATOM 3837 C CG2 . VAL C 3 214 ? 23.802 -9.595 -27.704 1.00 13.91 ? 361 VAL C CG2 1 ATOM 3838 N N . HIS C 3 215 ? 19.453 -8.759 -26.533 1.00 15.21 ? 362 HIS C N 1 ATOM 3839 C CA . HIS C 3 215 ? 18.054 -8.518 -26.704 1.00 16.51 ? 362 HIS C CA 1 ATOM 3840 C C . HIS C 3 215 ? 17.851 -7.729 -27.970 1.00 18.15 ? 362 HIS C C 1 ATOM 3841 O O . HIS C 3 215 ? 18.180 -6.497 -28.027 1.00 17.88 ? 362 HIS C O 1 ATOM 3842 C CB . HIS C 3 215 ? 17.574 -7.655 -25.568 1.00 19.45 ? 362 HIS C CB 1 ATOM 3843 C CG . HIS C 3 215 ? 16.110 -7.452 -25.551 1.00 18.69 ? 362 HIS C CG 1 ATOM 3844 N ND1 . HIS C 3 215 ? 15.500 -6.614 -24.652 1.00 21.07 ? 362 HIS C ND1 1 ATOM 3845 C CD2 . HIS C 3 215 ? 15.117 -8.076 -26.218 1.00 20.66 ? 362 HIS C CD2 1 ATOM 3846 C CE1 . HIS C 3 215 ? 14.190 -6.704 -24.784 1.00 19.58 ? 362 HIS C CE1 1 ATOM 3847 N NE2 . HIS C 3 215 ? 13.941 -7.563 -25.747 1.00 18.38 ? 362 HIS C NE2 1 ATOM 3848 N N . ASP C 3 216 ? 17.330 -8.417 -28.985 1.00 16.57 ? 363 ASP C N 1 ATOM 3849 C CA . ASP C 3 216 ? 16.958 -7.766 -30.246 1.00 19.63 ? 363 ASP C CA 1 ATOM 3850 C C . ASP C 3 216 ? 15.681 -6.990 -30.024 1.00 21.32 ? 363 ASP C C 1 ATOM 3851 O O . ASP C 3 216 ? 14.598 -7.572 -29.723 1.00 23.29 ? 363 ASP C O 1 ATOM 3852 C CB . ASP C 3 216 ? 16.835 -8.794 -31.364 1.00 23.01 ? 363 ASP C CB 1 ATOM 3853 C CG . ASP C 3 216 ? 16.468 -8.147 -32.703 1.00 23.54 ? 363 ASP C CG 1 ATOM 3854 O OD1 . ASP C 3 216 ? 15.481 -7.381 -32.720 1.00 24.41 ? 363 ASP C OD1 1 ATOM 3855 O OD2 . ASP C 3 216 ? 17.148 -8.471 -33.666 1.00 23.45 ? 363 ASP C OD2 1 ATOM 3856 N N . LEU C 3 217 ? 15.820 -5.659 -30.016 1.00 21.63 ? 364 LEU C N 1 ATOM 3857 C CA . LEU C 3 217 ? 14.680 -4.774 -29.652 1.00 23.53 ? 364 LEU C CA 1 ATOM 3858 C C . LEU C 3 217 ? 13.593 -4.711 -30.762 1.00 25.88 ? 364 LEU C C 1 ATOM 3859 O O . LEU C 3 217 ? 12.405 -4.525 -30.482 1.00 30.30 ? 364 LEU C O 1 ATOM 3860 C CB . LEU C 3 217 ? 15.164 -3.385 -29.191 1.00 23.34 ? 364 LEU C CB 1 ATOM 3861 C CG . LEU C 3 217 ? 16.178 -3.373 -28.024 1.00 23.07 ? 364 LEU C CG 1 ATOM 3862 C CD1 . LEU C 3 217 ? 16.785 -2.004 -27.722 1.00 24.46 ? 364 LEU C CD1 1 ATOM 3863 C CD2 . LEU C 3 217 ? 15.554 -3.953 -26.734 1.00 21.99 ? 364 LEU C CD2 1 ATOM 3864 N N . GLU C 3 218 ? 13.945 -4.962 -32.005 1.00 31.61 ? 365 GLU C N 1 ATOM 3865 C CA . GLU C 3 218 ? 12.913 -4.959 -33.071 1.00 35.12 ? 365 GLU C CA 1 ATOM 3866 C C . GLU C 3 218 ? 11.987 -6.164 -32.933 1.00 35.95 ? 365 GLU C C 1 ATOM 3867 O O . GLU C 3 218 ? 10.789 -6.021 -32.979 1.00 36.55 ? 365 GLU C O 1 ATOM 3868 C CB . GLU C 3 218 ? 13.549 -4.952 -34.446 1.00 36.53 ? 365 GLU C CB 1 ATOM 3869 C CG . GLU C 3 218 ? 13.919 -3.559 -34.904 1.00 40.75 ? 365 GLU C CG 1 ATOM 3870 C CD . GLU C 3 218 ? 14.945 -3.578 -36.021 1.00 45.41 ? 365 GLU C CD 1 ATOM 3871 O OE1 . GLU C 3 218 ? 15.872 -4.394 -35.928 1.00 44.22 ? 365 GLU C OE1 1 ATOM 3872 O OE2 . GLU C 3 218 ? 14.884 -2.743 -36.959 1.00 50.43 ? 365 GLU C OE2 1 ATOM 3873 N N . GLU C 3 219 ? 12.552 -7.346 -32.708 1.00 37.12 ? 366 GLU C N 1 ATOM 3874 C CA . GLU C 3 219 ? 11.754 -8.533 -32.550 1.00 32.63 ? 366 GLU C CA 1 ATOM 3875 C C . GLU C 3 219 ? 11.307 -8.671 -31.141 1.00 30.07 ? 366 GLU C C 1 ATOM 3876 O O . GLU C 3 219 ? 10.434 -9.464 -30.833 1.00 30.58 ? 366 GLU C O 1 ATOM 3877 C CB . GLU C 3 219 ? 12.606 -9.728 -32.930 1.00 33.94 ? 366 GLU C CB 1 ATOM 3878 C CG . GLU C 3 219 ? 13.332 -9.508 -34.241 1.00 35.85 ? 366 GLU C CG 1 ATOM 3879 C CD . GLU C 3 219 ? 14.141 -10.710 -34.674 1.00 40.36 ? 366 GLU C CD 1 ATOM 3880 O OE1 . GLU C 3 219 ? 14.172 -11.720 -33.938 1.00 40.75 ? 366 GLU C OE1 1 ATOM 3881 O OE2 . GLU C 3 219 ? 14.773 -10.640 -35.745 1.00 41.69 ? 366 GLU C OE2 1 ATOM 3882 N N . ASP C 3 220 ? 11.934 -7.946 -30.229 1.00 27.89 ? 367 ASP C N 1 ATOM 3883 C CA . ASP C 3 220 ? 11.723 -8.250 -28.807 1.00 29.11 ? 367 ASP C CA 1 ATOM 3884 C C . ASP C 3 220 ? 11.966 -9.745 -28.504 1.00 24.20 ? 367 ASP C C 1 ATOM 3885 O O . ASP C 3 220 ? 11.155 -10.434 -27.919 1.00 23.09 ? 367 ASP C O 1 ATOM 3886 C CB . ASP C 3 220 ? 10.331 -7.807 -28.350 1.00 30.67 ? 367 ASP C CB 1 ATOM 3887 C CG . ASP C 3 220 ? 10.175 -7.852 -26.862 1.00 34.16 ? 367 ASP C CG 1 ATOM 3888 O OD1 . ASP C 3 220 ? 11.198 -7.828 -26.123 1.00 29.30 ? 367 ASP C OD1 1 ATOM 3889 O OD2 . ASP C 3 220 ? 9.018 -7.929 -26.404 1.00 37.37 ? 367 ASP C OD2 1 ATOM 3890 N N . THR C 3 221 ? 13.109 -10.235 -28.932 1.00 22.47 ? 368 THR C N 1 ATOM 3891 C CA . THR C 3 221 ? 13.519 -11.598 -28.664 1.00 21.61 ? 368 THR C CA 1 ATOM 3892 C C . THR C 3 221 ? 14.947 -11.636 -28.108 1.00 18.84 ? 368 THR C C 1 ATOM 3893 O O . THR C 3 221 ? 15.760 -10.794 -28.460 1.00 18.63 ? 368 THR C O 1 ATOM 3894 C CB . THR C 3 221 ? 13.414 -12.361 -29.990 1.00 21.70 ? 368 THR C CB 1 ATOM 3895 O OG1 . THR C 3 221 ? 12.062 -12.284 -30.409 1.00 22.58 ? 368 THR C OG1 1 ATOM 3896 C CG2 . THR C 3 221 ? 13.845 -13.854 -29.860 1.00 21.03 ? 368 THR C CG2 1 ATOM 3897 N N . TRP C 3 222 ? 15.261 -12.644 -27.302 1.00 18.23 ? 369 TRP C N 1 ATOM 3898 C CA . TRP C 3 222 ? 16.588 -12.823 -26.761 1.00 17.48 ? 369 TRP C CA 1 ATOM 3899 C C . TRP C 3 222 ? 17.339 -13.951 -27.471 1.00 18.63 ? 369 TRP C C 1 ATOM 3900 O O . TRP C 3 222 ? 16.814 -15.076 -27.734 1.00 18.74 ? 369 TRP C O 1 ATOM 3901 C CB . TRP C 3 222 ? 16.511 -13.062 -25.276 1.00 18.57 ? 369 TRP C CB 1 ATOM 3902 C CG . TRP C 3 222 ? 15.985 -11.888 -24.495 1.00 18.33 ? 369 TRP C CG 1 ATOM 3903 C CD1 . TRP C 3 222 ? 14.720 -11.460 -24.500 1.00 18.56 ? 369 TRP C CD1 1 ATOM 3904 C CD2 . TRP C 3 222 ? 16.708 -11.004 -23.611 1.00 17.12 ? 369 TRP C CD2 1 ATOM 3905 N NE1 . TRP C 3 222 ? 14.578 -10.417 -23.681 1.00 20.70 ? 369 TRP C NE1 1 ATOM 3906 C CE2 . TRP C 3 222 ? 15.785 -10.070 -23.139 1.00 18.79 ? 369 TRP C CE2 1 ATOM 3907 C CE3 . TRP C 3 222 ? 18.050 -10.884 -23.223 1.00 17.01 ? 369 TRP C CE3 1 ATOM 3908 C CZ2 . TRP C 3 222 ? 16.132 -9.000 -22.252 1.00 17.70 ? 369 TRP C CZ2 1 ATOM 3909 C CZ3 . TRP C 3 222 ? 18.406 -9.842 -22.310 1.00 15.74 ? 369 TRP C CZ3 1 ATOM 3910 C CH2 . TRP C 3 222 ? 17.431 -8.931 -21.824 1.00 17.17 ? 369 TRP C CH2 1 ATOM 3911 N N . TYR C 3 223 ? 18.567 -13.625 -27.806 1.00 15.91 ? 370 TYR C N 1 ATOM 3912 C CA . TYR C 3 223 ? 19.427 -14.468 -28.576 1.00 16.84 ? 370 TYR C CA 1 ATOM 3913 C C . TYR C 3 223 ? 20.740 -14.756 -27.878 1.00 16.80 ? 370 TYR C C 1 ATOM 3914 O O . TYR C 3 223 ? 21.360 -13.857 -27.300 1.00 17.57 ? 370 TYR C O 1 ATOM 3915 C CB . TYR C 3 223 ? 19.754 -13.775 -29.904 1.00 16.68 ? 370 TYR C CB 1 ATOM 3916 C CG . TYR C 3 223 ? 18.574 -13.744 -30.882 1.00 16.88 ? 370 TYR C CG 1 ATOM 3917 C CD1 . TYR C 3 223 ? 18.308 -14.828 -31.677 1.00 18.06 ? 370 TYR C CD1 1 ATOM 3918 C CD2 . TYR C 3 223 ? 17.717 -12.672 -30.939 1.00 18.45 ? 370 TYR C CD2 1 ATOM 3919 C CE1 . TYR C 3 223 ? 17.268 -14.836 -32.590 1.00 19.83 ? 370 TYR C CE1 1 ATOM 3920 C CE2 . TYR C 3 223 ? 16.653 -12.650 -31.835 1.00 21.11 ? 370 TYR C CE2 1 ATOM 3921 C CZ . TYR C 3 223 ? 16.442 -13.758 -32.648 1.00 21.87 ? 370 TYR C CZ 1 ATOM 3922 O OH . TYR C 3 223 ? 15.455 -13.829 -33.542 1.00 26.42 ? 370 TYR C OH 1 ATOM 3923 N N . ALA C 3 224 ? 21.218 -15.991 -27.985 1.00 15.38 ? 371 ALA C N 1 ATOM 3924 C CA . ALA C 3 224 ? 22.585 -16.302 -27.576 1.00 15.89 ? 371 ALA C CA 1 ATOM 3925 C C . ALA C 3 224 ? 23.612 -15.889 -28.613 1.00 15.16 ? 371 ALA C C 1 ATOM 3926 O O . ALA C 3 224 ? 23.805 -16.604 -29.589 1.00 16.62 ? 371 ALA C O 1 ATOM 3927 C CB . ALA C 3 224 ? 22.714 -17.791 -27.290 1.00 16.73 ? 371 ALA C CB 1 ATOM 3928 N N . THR C 3 225 ? 24.322 -14.785 -28.366 1.00 13.69 ? 372 THR C N 1 ATOM 3929 C CA . THR C 3 225 ? 25.344 -14.334 -29.283 1.00 13.65 ? 372 THR C CA 1 ATOM 3930 C C . THR C 3 225 ? 26.710 -14.999 -29.007 1.00 13.55 ? 372 THR C C 1 ATOM 3931 O O . THR C 3 225 ? 27.436 -15.259 -29.919 1.00 12.07 ? 372 THR C O 1 ATOM 3932 C CB . THR C 3 225 ? 25.336 -12.808 -29.306 1.00 14.61 ? 372 THR C CB 1 ATOM 3933 O OG1 . THR C 3 225 ? 24.151 -12.399 -29.988 1.00 16.72 ? 372 THR C OG1 1 ATOM 3934 C CG2 . THR C 3 225 ? 26.546 -12.234 -29.954 1.00 15.04 ? 372 THR C CG2 1 ATOM 3935 N N . GLY C 3 226 ? 27.039 -15.237 -27.717 1.00 12.99 ? 373 GLY C N 1 ATOM 3936 C CA . GLY C 3 226 ? 28.190 -15.977 -27.360 1.00 12.90 ? 373 GLY C CA 1 ATOM 3937 C C . GLY C 3 226 ? 27.947 -16.992 -26.291 1.00 13.20 ? 373 GLY C C 1 ATOM 3938 O O . GLY C 3 226 ? 26.924 -16.949 -25.580 1.00 13.90 ? 373 GLY C O 1 ATOM 3939 N N . ILE C 3 227 ? 28.813 -17.997 -26.231 1.00 13.57 ? 374 ILE C N 1 ATOM 3940 C CA . ILE C 3 227 ? 28.857 -18.913 -25.055 1.00 12.77 ? 374 ILE C CA 1 ATOM 3941 C C . ILE C 3 227 ? 30.181 -18.591 -24.356 1.00 11.66 ? 374 ILE C C 1 ATOM 3942 O O . ILE C 3 227 ? 31.244 -18.669 -24.986 1.00 10.86 ? 374 ILE C O 1 ATOM 3943 C CB . ILE C 3 227 ? 28.874 -20.367 -25.453 1.00 14.77 ? 374 ILE C CB 1 ATOM 3944 C CG1 . ILE C 3 227 ? 27.554 -20.652 -26.235 1.00 15.89 ? 374 ILE C CG1 1 ATOM 3945 C CG2 . ILE C 3 227 ? 29.095 -21.331 -24.202 1.00 15.25 ? 374 ILE C CG2 1 ATOM 3946 C CD1 . ILE C 3 227 ? 26.292 -20.565 -25.394 1.00 16.97 ? 374 ILE C CD1 1 ATOM 3947 N N . LEU C 3 228 ? 30.132 -18.259 -23.076 1.00 10.48 ? 375 LEU C N 1 ATOM 3948 C CA . LEU C 3 228 ? 31.362 -17.950 -22.335 1.00 10.75 ? 375 LEU C CA 1 ATOM 3949 C C . LEU C 3 228 ? 32.315 -19.161 -22.265 1.00 10.94 ? 375 LEU C C 1 ATOM 3950 O O . LEU C 3 228 ? 31.902 -20.291 -21.880 1.00 10.52 ? 375 LEU C O 1 ATOM 3951 C CB . LEU C 3 228 ? 31.053 -17.462 -20.940 1.00 10.91 ? 375 LEU C CB 1 ATOM 3952 C CG . LEU C 3 228 ? 32.256 -17.175 -20.020 1.00 12.02 ? 375 LEU C CG 1 ATOM 3953 C CD1 . LEU C 3 228 ? 33.206 -16.150 -20.614 1.00 12.92 ? 375 LEU C CD1 1 ATOM 3954 C CD2 . LEU C 3 228 ? 31.713 -16.716 -18.683 1.00 11.74 ? 375 LEU C CD2 1 ATOM 3955 N N . SER C 3 229 ? 33.550 -18.955 -22.703 1.00 11.35 ? 376 SER C N 1 ATOM 3956 C CA . SER C 3 229 ? 34.592 -19.979 -22.744 1.00 11.12 ? 376 SER C CA 1 ATOM 3957 C C . SER C 3 229 ? 35.615 -19.730 -21.650 1.00 12.41 ? 376 SER C C 1 ATOM 3958 O O . SER C 3 229 ? 35.875 -20.560 -20.781 1.00 13.47 ? 376 SER C O 1 ATOM 3959 C CB . SER C 3 229 ? 35.280 -20.002 -24.125 1.00 11.60 ? 376 SER C CB 1 ATOM 3960 O OG . SER C 3 229 ? 36.408 -20.899 -24.137 1.00 10.49 ? 376 SER C OG 1 ATOM 3961 N N . PHE C 3 230 ? 36.166 -18.551 -21.669 1.00 12.65 ? 377 PHE C N 1 ATOM 3962 C CA . PHE C 3 230 ? 37.249 -18.211 -20.724 1.00 12.73 ? 377 PHE C CA 1 ATOM 3963 C C . PHE C 3 230 ? 36.611 -17.556 -19.525 1.00 12.53 ? 377 PHE C C 1 ATOM 3964 O O . PHE C 3 230 ? 36.335 -16.374 -19.556 1.00 12.78 ? 377 PHE C O 1 ATOM 3965 C CB . PHE C 3 230 ? 38.325 -17.295 -21.343 1.00 12.22 ? 377 PHE C CB 1 ATOM 3966 C CG . PHE C 3 230 ? 39.554 -17.140 -20.471 1.00 11.04 ? 377 PHE C CG 1 ATOM 3967 C CD1 . PHE C 3 230 ? 40.410 -18.178 -20.235 1.00 11.47 ? 377 PHE C CD1 1 ATOM 3968 C CD2 . PHE C 3 230 ? 39.856 -15.887 -19.904 1.00 11.01 ? 377 PHE C CD2 1 ATOM 3969 C CE1 . PHE C 3 230 ? 41.546 -17.984 -19.397 1.00 12.87 ? 377 PHE C CE1 1 ATOM 3970 C CE2 . PHE C 3 230 ? 40.983 -15.686 -19.094 1.00 10.89 ? 377 PHE C CE2 1 ATOM 3971 C CZ . PHE C 3 230 ? 41.830 -16.710 -18.870 1.00 11.09 ? 377 PHE C CZ 1 ATOM 3972 N N . ASP C 3 231 ? 36.360 -18.359 -18.488 1.00 11.24 ? 378 ASP C N 1 ATOM 3973 C CA . ASP C 3 231 ? 35.744 -17.885 -17.235 1.00 10.85 ? 378 ASP C CA 1 ATOM 3974 C C . ASP C 3 231 ? 36.771 -17.661 -16.081 1.00 11.33 ? 378 ASP C C 1 ATOM 3975 O O . ASP C 3 231 ? 36.462 -17.815 -14.912 1.00 12.48 ? 378 ASP C O 1 ATOM 3976 C CB . ASP C 3 231 ? 34.607 -18.791 -16.809 1.00 10.92 ? 378 ASP C CB 1 ATOM 3977 C CG . ASP C 3 231 ? 35.044 -20.200 -16.437 1.00 11.65 ? 378 ASP C CG 1 ATOM 3978 O OD1 . ASP C 3 231 ? 36.233 -20.612 -16.668 1.00 10.72 ? 378 ASP C OD1 1 ATOM 3979 O OD2 . ASP C 3 231 ? 34.136 -20.934 -15.912 1.00 12.07 ? 378 ASP C OD2 1 ATOM 3980 N N . LYS C 3 232 ? 37.984 -17.329 -16.433 1.00 10.95 ? 379 LYS C N 1 ATOM 3981 C CA . LYS C 3 232 ? 39.070 -17.280 -15.435 1.00 12.91 ? 379 LYS C CA 1 ATOM 3982 C C . LYS C 3 232 ? 39.573 -15.823 -15.193 1.00 13.89 ? 379 LYS C C 1 ATOM 3983 O O . LYS C 3 232 ? 40.608 -15.620 -14.475 1.00 14.38 ? 379 LYS C O 1 ATOM 3984 C CB . LYS C 3 232 ? 40.219 -18.149 -15.905 1.00 12.14 ? 379 LYS C CB 1 ATOM 3985 C CG . LYS C 3 232 ? 39.836 -19.664 -15.920 1.00 12.90 ? 379 LYS C CG 1 ATOM 3986 C CD . LYS C 3 232 ? 41.001 -20.554 -16.192 1.00 13.72 ? 379 LYS C CD 1 ATOM 3987 C CE . LYS C 3 232 ? 40.582 -22.012 -16.443 1.00 14.75 ? 379 LYS C CE 1 ATOM 3988 N NZ . LYS C 3 232 ? 40.276 -22.543 -15.159 1.00 14.76 ? 379 LYS C NZ 1 ATOM 3989 N N . SER C 3 233 ? 38.898 -14.844 -15.789 1.00 14.97 ? 380 SER C N 1 ATOM 3990 C CA . SER C 3 233 ? 39.431 -13.468 -15.764 1.00 19.18 ? 380 SER C CA 1 ATOM 3991 C C . SER C 3 233 ? 39.291 -12.928 -14.353 1.00 18.23 ? 380 SER C C 1 ATOM 3992 O O . SER C 3 233 ? 40.239 -12.387 -13.773 1.00 17.95 ? 380 SER C O 1 ATOM 3993 C CB . SER C 3 233 ? 38.785 -12.551 -16.825 1.00 19.27 ? 380 SER C CB 1 ATOM 3994 O OG . SER C 3 233 ? 37.382 -12.443 -16.703 1.00 21.54 ? 380 SER C OG 1 ATOM 3995 N N . CYS C 3 234 ? 38.091 -13.097 -13.811 1.00 19.54 ? 381 CYS C N 1 ATOM 3996 C CA . CYS C 3 234 ? 37.812 -12.875 -12.358 1.00 18.09 ? 381 CYS C CA 1 ATOM 3997 C C . CYS C 3 234 ? 38.277 -11.493 -11.842 1.00 19.67 ? 381 CYS C C 1 ATOM 3998 O O . CYS C 3 234 ? 38.785 -11.373 -10.735 1.00 16.27 ? 381 CYS C O 1 ATOM 3999 C CB . CYS C 3 234 ? 38.515 -13.899 -11.510 1.00 19.00 ? 381 CYS C CB 1 ATOM 4000 S SG . CYS C 3 234 ? 38.169 -15.657 -11.793 1.00 17.12 ? 381 CYS C SG 1 ATOM 4001 N N . ALA C 3 235 ? 38.166 -10.499 -12.687 1.00 19.89 ? 382 ALA C N 1 ATOM 4002 C CA . ALA C 3 235 ? 38.494 -9.130 -12.346 1.00 22.81 ? 382 ALA C CA 1 ATOM 4003 C C . ALA C 3 235 ? 39.977 -8.960 -12.155 1.00 22.19 ? 382 ALA C C 1 ATOM 4004 O O . ALA C 3 235 ? 40.357 -7.969 -11.656 1.00 23.96 ? 382 ALA C O 1 ATOM 4005 C CB . ALA C 3 235 ? 37.732 -8.635 -11.126 1.00 24.68 ? 382 ALA C CB 1 ATOM 4006 N N . VAL C 3 236 ? 40.793 -9.908 -12.605 1.00 21.26 ? 383 VAL C N 1 ATOM 4007 C CA . VAL C 3 236 ? 42.215 -9.740 -12.627 1.00 17.40 ? 383 VAL C CA 1 ATOM 4008 C C . VAL C 3 236 ? 42.654 -9.470 -14.076 1.00 19.48 ? 383 VAL C C 1 ATOM 4009 O O . VAL C 3 236 ? 43.279 -8.419 -14.357 1.00 18.43 ? 383 VAL C O 1 ATOM 4010 C CB . VAL C 3 236 ? 42.928 -10.940 -11.979 1.00 17.55 ? 383 VAL C CB 1 ATOM 4011 C CG1 . VAL C 3 236 ? 44.435 -10.881 -12.189 1.00 16.96 ? 383 VAL C CG1 1 ATOM 4012 C CG2 . VAL C 3 236 ? 42.610 -10.974 -10.505 1.00 16.52 ? 383 VAL C CG2 1 ATOM 4013 N N . ALA C 3 237 ? 42.401 -10.414 -14.987 1.00 18.15 ? 384 ALA C N 1 ATOM 4014 C CA . ALA C 3 237 ? 42.481 -10.132 -16.396 1.00 16.03 ? 384 ALA C CA 1 ATOM 4015 C C . ALA C 3 237 ? 41.237 -9.320 -16.794 1.00 16.76 ? 384 ALA C C 1 ATOM 4016 O O . ALA C 3 237 ? 40.241 -9.256 -16.103 1.00 15.95 ? 384 ALA C O 1 ATOM 4017 C CB . ALA C 3 237 ? 42.618 -11.404 -17.210 1.00 15.50 ? 384 ALA C CB 1 ATOM 4018 N N . GLU C 3 238 ? 41.281 -8.692 -17.939 1.00 18.48 ? 385 GLU C N 1 ATOM 4019 C CA . GLU C 3 238 ? 40.276 -7.694 -18.244 1.00 18.91 ? 385 GLU C CA 1 ATOM 4020 C C . GLU C 3 238 ? 39.093 -8.229 -19.027 1.00 17.74 ? 385 GLU C C 1 ATOM 4021 O O . GLU C 3 238 ? 38.020 -7.627 -18.952 1.00 18.54 ? 385 GLU C O 1 ATOM 4022 C CB . GLU C 3 238 ? 40.887 -6.540 -19.018 1.00 24.77 ? 385 GLU C CB 1 ATOM 4023 C CG . GLU C 3 238 ? 39.809 -5.546 -19.504 1.00 30.71 ? 385 GLU C CG 1 ATOM 4024 C CD . GLU C 3 238 ? 40.359 -4.290 -20.189 1.00 35.97 ? 385 GLU C CD 1 ATOM 4025 O OE1 . GLU C 3 238 ? 41.594 -4.154 -20.307 1.00 46.59 ? 385 GLU C OE1 1 ATOM 4026 O OE2 . GLU C 3 238 ? 39.531 -3.438 -20.599 1.00 37.69 ? 385 GLU C OE2 1 ATOM 4027 N N . TYR C 3 239 ? 39.234 -9.367 -19.716 1.00 15.23 ? 386 TYR C N 1 ATOM 4028 C CA . TYR C 3 239 ? 38.150 -9.837 -20.587 1.00 15.04 ? 386 TYR C CA 1 ATOM 4029 C C . TYR C 3 239 ? 37.786 -11.318 -20.480 1.00 14.11 ? 386 TYR C C 1 ATOM 4030 O O . TYR C 3 239 ? 38.663 -12.235 -20.487 1.00 10.62 ? 386 TYR C O 1 ATOM 4031 C CB . TYR C 3 239 ? 38.499 -9.609 -22.055 1.00 15.74 ? 386 TYR C CB 1 ATOM 4032 C CG . TYR C 3 239 ? 39.009 -8.237 -22.436 1.00 16.97 ? 386 TYR C CG 1 ATOM 4033 C CD1 . TYR C 3 239 ? 38.136 -7.170 -22.678 1.00 17.72 ? 386 TYR C CD1 1 ATOM 4034 C CD2 . TYR C 3 239 ? 40.382 -8.022 -22.538 1.00 17.71 ? 386 TYR C CD2 1 ATOM 4035 C CE1 . TYR C 3 239 ? 38.657 -5.901 -23.030 1.00 19.05 ? 386 TYR C CE1 1 ATOM 4036 C CE2 . TYR C 3 239 ? 40.897 -6.789 -22.908 1.00 18.83 ? 386 TYR C CE2 1 ATOM 4037 C CZ . TYR C 3 239 ? 40.022 -5.732 -23.175 1.00 20.97 ? 386 TYR C CZ 1 ATOM 4038 O OH . TYR C 3 239 ? 40.554 -4.467 -23.494 1.00 22.76 ? 386 TYR C OH 1 ATOM 4039 N N . GLY C 3 240 ? 36.471 -11.525 -20.492 1.00 13.78 ? 387 GLY C N 1 ATOM 4040 C CA . GLY C 3 240 ? 35.903 -12.843 -20.834 1.00 13.86 ? 387 GLY C CA 1 ATOM 4041 C C . GLY C 3 240 ? 35.995 -13.121 -22.314 1.00 12.75 ? 387 GLY C C 1 ATOM 4042 O O . GLY C 3 240 ? 35.967 -12.178 -23.156 1.00 10.97 ? 387 GLY C O 1 ATOM 4043 N N . VAL C 3 241 ? 36.120 -14.410 -22.652 1.00 12.19 ? 388 VAL C N 1 ATOM 4044 C CA . VAL C 3 241 ? 36.228 -14.809 -24.055 1.00 12.10 ? 388 VAL C CA 1 ATOM 4045 C C . VAL C 3 241 ? 35.108 -15.787 -24.337 1.00 12.68 ? 388 VAL C C 1 ATOM 4046 O O . VAL C 3 241 ? 34.946 -16.737 -23.576 1.00 12.63 ? 388 VAL C O 1 ATOM 4047 C CB . VAL C 3 241 ? 37.591 -15.406 -24.404 1.00 11.01 ? 388 VAL C CB 1 ATOM 4048 C CG1 . VAL C 3 241 ? 37.642 -15.841 -25.866 1.00 10.54 ? 388 VAL C CG1 1 ATOM 4049 C CG2 . VAL C 3 241 ? 38.717 -14.474 -24.008 1.00 10.58 ? 388 VAL C CG2 1 ATOM 4050 N N . TYR C 3 242 ? 34.383 -15.530 -25.412 1.00 12.32 ? 389 TYR C N 1 ATOM 4051 C CA . TYR C 3 242 ? 33.094 -16.174 -25.760 1.00 12.60 ? 389 TYR C CA 1 ATOM 4052 C C . TYR C 3 242 ? 33.197 -16.779 -27.138 1.00 13.16 ? 389 TYR C C 1 ATOM 4053 O O . TYR C 3 242 ? 33.771 -16.151 -28.057 1.00 13.72 ? 389 TYR C O 1 ATOM 4054 C CB . TYR C 3 242 ? 32.006 -15.113 -25.810 1.00 11.08 ? 389 TYR C CB 1 ATOM 4055 C CG . TYR C 3 242 ? 31.695 -14.414 -24.476 1.00 11.39 ? 389 TYR C CG 1 ATOM 4056 C CD1 . TYR C 3 242 ? 32.532 -13.448 -23.960 1.00 10.76 ? 389 TYR C CD1 1 ATOM 4057 C CD2 . TYR C 3 242 ? 30.661 -14.869 -23.677 1.00 11.27 ? 389 TYR C CD2 1 ATOM 4058 C CE1 . TYR C 3 242 ? 32.322 -12.869 -22.715 1.00 11.78 ? 389 TYR C CE1 1 ATOM 4059 C CE2 . TYR C 3 242 ? 30.403 -14.283 -22.459 1.00 11.69 ? 389 TYR C CE2 1 ATOM 4060 C CZ . TYR C 3 242 ? 31.215 -13.267 -21.966 1.00 12.20 ? 389 TYR C CZ 1 ATOM 4061 O OH . TYR C 3 242 ? 30.912 -12.730 -20.702 1.00 12.09 ? 389 TYR C OH 1 ATOM 4062 N N . VAL C 3 243 ? 32.667 -17.976 -27.290 1.00 13.58 ? 390 VAL C N 1 ATOM 4063 C CA . VAL C 3 243 ? 32.473 -18.590 -28.615 1.00 13.53 ? 390 VAL C CA 1 ATOM 4064 C C . VAL C 3 243 ? 31.314 -17.928 -29.324 1.00 13.11 ? 390 VAL C C 1 ATOM 4065 O O . VAL C 3 243 ? 30.239 -17.760 -28.751 1.00 12.94 ? 390 VAL C O 1 ATOM 4066 C CB . VAL C 3 243 ? 32.209 -20.099 -28.556 1.00 13.49 ? 390 VAL C CB 1 ATOM 4067 C CG1 . VAL C 3 243 ? 32.120 -20.656 -29.986 1.00 13.72 ? 390 VAL C CG1 1 ATOM 4068 C CG2 . VAL C 3 243 ? 33.310 -20.829 -27.809 1.00 15.05 ? 390 VAL C CG2 1 ATOM 4069 N N . LYS C 3 244 ? 31.555 -17.499 -30.563 1.00 15.36 ? 391 LYS C N 1 ATOM 4070 C CA . LYS C 3 244 ? 30.542 -16.863 -31.374 1.00 16.50 ? 391 LYS C CA 1 ATOM 4071 C C . LYS C 3 244 ? 29.538 -17.881 -31.832 1.00 15.17 ? 391 LYS C C 1 ATOM 4072 O O . LYS C 3 244 ? 29.882 -18.737 -32.607 1.00 16.26 ? 391 LYS C O 1 ATOM 4073 C CB . LYS C 3 244 ? 31.157 -16.234 -32.648 1.00 19.72 ? 391 LYS C CB 1 ATOM 4074 C CG . LYS C 3 244 ? 31.933 -15.016 -32.359 1.00 23.58 ? 391 LYS C CG 1 ATOM 4075 C CD . LYS C 3 244 ? 32.048 -14.072 -33.528 1.00 31.04 ? 391 LYS C CD 1 ATOM 4076 C CE . LYS C 3 244 ? 33.130 -14.447 -34.402 1.00 32.27 ? 391 LYS C CE 1 ATOM 4077 N NZ . LYS C 3 244 ? 33.915 -13.203 -34.649 1.00 33.73 ? 391 LYS C NZ 1 ATOM 4078 N N . VAL C 3 245 ? 28.309 -17.740 -31.401 1.00 15.62 ? 392 VAL C N 1 ATOM 4079 C CA . VAL C 3 245 ? 27.242 -18.667 -31.816 1.00 17.09 ? 392 VAL C CA 1 ATOM 4080 C C . VAL C 3 245 ? 27.030 -18.724 -33.338 1.00 19.63 ? 392 VAL C C 1 ATOM 4081 O O . VAL C 3 245 ? 26.875 -19.830 -33.907 1.00 15.63 ? 392 VAL C O 1 ATOM 4082 C CB . VAL C 3 245 ? 25.952 -18.350 -31.095 1.00 16.40 ? 392 VAL C CB 1 ATOM 4083 C CG1 . VAL C 3 245 ? 24.823 -19.282 -31.542 1.00 17.52 ? 392 VAL C CG1 1 ATOM 4084 C CG2 . VAL C 3 245 ? 26.215 -18.560 -29.621 1.00 15.92 ? 392 VAL C CG2 1 ATOM 4085 N N . THR C 3 246 ? 27.139 -17.572 -34.005 1.00 19.35 ? 393 THR C N 1 ATOM 4086 C CA . THR C 3 246 ? 27.015 -17.615 -35.482 1.00 20.80 ? 393 THR C CA 1 ATOM 4087 C C . THR C 3 246 ? 28.097 -18.467 -36.096 1.00 19.51 ? 393 THR C C 1 ATOM 4088 O O . THR C 3 246 ? 27.924 -19.048 -37.141 1.00 18.53 ? 393 THR C O 1 ATOM 4089 C CB . THR C 3 246 ? 27.072 -16.226 -36.136 1.00 21.72 ? 393 THR C CB 1 ATOM 4090 O OG1 . THR C 3 246 ? 28.269 -15.535 -35.722 1.00 22.90 ? 393 THR C OG1 1 ATOM 4091 C CG2 . THR C 3 246 ? 25.893 -15.485 -35.798 1.00 21.33 ? 393 THR C CG2 1 ATOM 4092 N N . SER C 3 247 ? 29.215 -18.646 -35.436 1.00 19.26 ? 394 SER C N 1 ATOM 4093 C CA . SER C 3 247 ? 30.258 -19.418 -36.102 1.00 18.85 ? 394 SER C CA 1 ATOM 4094 C C . SER C 3 247 ? 30.050 -20.938 -35.919 1.00 19.23 ? 394 SER C C 1 ATOM 4095 O O . SER C 3 247 ? 30.743 -21.727 -36.540 1.00 17.54 ? 394 SER C O 1 ATOM 4096 C CB . SER C 3 247 ? 31.649 -19.003 -35.653 1.00 19.83 ? 394 SER C CB 1 ATOM 4097 O OG . SER C 3 247 ? 31.865 -19.615 -34.377 1.00 31.29 ? 394 SER C OG 1 ATOM 4098 N N . ILE C 3 248 ? 29.088 -21.367 -35.102 1.00 19.31 ? 395 ILE C N 1 ATOM 4099 C CA . ILE C 3 248 ? 28.849 -22.818 -34.939 1.00 20.31 ? 395 ILE C CA 1 ATOM 4100 C C . ILE C 3 248 ? 27.419 -23.243 -35.322 1.00 21.89 ? 395 ILE C C 1 ATOM 4101 O O . ILE C 3 248 ? 27.058 -24.420 -35.142 1.00 21.98 ? 395 ILE C O 1 ATOM 4102 C CB . ILE C 3 248 ? 29.122 -23.316 -33.507 1.00 20.25 ? 395 ILE C CB 1 ATOM 4103 C CG1 . ILE C 3 248 ? 28.245 -22.546 -32.531 1.00 19.64 ? 395 ILE C CG1 1 ATOM 4104 C CG2 . ILE C 3 248 ? 30.588 -23.266 -33.230 1.00 21.11 ? 395 ILE C CG2 1 ATOM 4105 C CD1 . ILE C 3 248 ? 28.271 -23.025 -31.102 1.00 23.15 ? 395 ILE C CD1 1 ATOM 4106 N N . GLN C 3 249 ? 26.646 -22.298 -35.855 1.00 23.32 ? 396 GLN C N 1 ATOM 4107 C CA . GLN C 3 249 ? 25.205 -22.441 -36.113 1.00 27.75 ? 396 GLN C CA 1 ATOM 4108 C C . GLN C 3 249 ? 24.869 -23.645 -36.969 1.00 24.62 ? 396 GLN C C 1 ATOM 4109 O O . GLN C 3 249 ? 23.908 -24.401 -36.636 1.00 20.57 ? 396 GLN C O 1 ATOM 4110 C CB . GLN C 3 249 ? 24.655 -21.171 -36.794 1.00 35.10 ? 396 GLN C CB 1 ATOM 4111 C CG . GLN C 3 249 ? 23.157 -21.159 -37.150 1.00 44.11 ? 396 GLN C CG 1 ATOM 4112 C CD . GLN C 3 249 ? 22.268 -20.524 -36.061 1.00 54.12 ? 396 GLN C CD 1 ATOM 4113 O OE1 . GLN C 3 249 ? 21.089 -20.917 -35.868 1.00 51.77 ? 396 GLN C OE1 1 ATOM 4114 N NE2 . GLN C 3 249 ? 22.823 -19.523 -35.356 1.00 52.34 ? 396 GLN C NE2 1 ATOM 4115 N N . ASP C 3 250 ? 25.629 -23.803 -38.058 1.00 23.23 ? 397 ASP C N 1 ATOM 4116 C CA . ASP C 3 250 ? 25.407 -24.886 -39.002 1.00 22.98 ? 397 ASP C CA 1 ATOM 4117 C C . ASP C 3 250 ? 25.713 -26.226 -38.329 1.00 22.09 ? 397 ASP C C 1 ATOM 4118 O O . ASP C 3 250 ? 25.001 -27.188 -38.567 1.00 17.55 ? 397 ASP C O 1 ATOM 4119 C CB . ASP C 3 250 ? 26.329 -24.864 -40.240 1.00 28.41 ? 397 ASP C CB 1 ATOM 4120 C CG . ASP C 3 250 ? 26.146 -23.632 -41.138 1.00 36.45 ? 397 ASP C CG 1 ATOM 4121 O OD1 . ASP C 3 250 ? 25.239 -22.810 -40.937 1.00 40.06 ? 397 ASP C OD1 1 ATOM 4122 O OD2 . ASP C 3 250 ? 26.978 -23.467 -42.053 1.00 41.32 ? 397 ASP C OD2 1 ATOM 4123 N N . TRP C 3 251 ? 26.844 -26.316 -37.618 1.00 19.57 ? 398 TRP C N 1 ATOM 4124 C CA . TRP C 3 251 ? 27.163 -27.507 -36.896 1.00 17.95 ? 398 TRP C CA 1 ATOM 4125 C C . TRP C 3 251 ? 26.097 -27.793 -35.870 1.00 18.08 ? 398 TRP C C 1 ATOM 4126 O O . TRP C 3 251 ? 25.702 -28.968 -35.728 1.00 16.64 ? 398 TRP C O 1 ATOM 4127 C CB . TRP C 3 251 ? 28.531 -27.427 -36.243 1.00 19.92 ? 398 TRP C CB 1 ATOM 4128 C CG . TRP C 3 251 ? 28.832 -28.625 -35.407 1.00 17.56 ? 398 TRP C CG 1 ATOM 4129 C CD1 . TRP C 3 251 ? 29.187 -29.870 -35.865 1.00 18.28 ? 398 TRP C CD1 1 ATOM 4130 C CD2 . TRP C 3 251 ? 28.643 -28.769 -33.986 1.00 17.45 ? 398 TRP C CD2 1 ATOM 4131 N NE1 . TRP C 3 251 ? 29.280 -30.744 -34.823 1.00 16.44 ? 398 TRP C NE1 1 ATOM 4132 C CE2 . TRP C 3 251 ? 28.982 -30.099 -33.656 1.00 17.30 ? 398 TRP C CE2 1 ATOM 4133 C CE3 . TRP C 3 251 ? 28.303 -27.903 -32.963 1.00 17.33 ? 398 TRP C CE3 1 ATOM 4134 C CZ2 . TRP C 3 251 ? 28.990 -30.551 -32.350 1.00 16.63 ? 398 TRP C CZ2 1 ATOM 4135 C CZ3 . TRP C 3 251 ? 28.309 -28.368 -31.654 1.00 17.41 ? 398 TRP C CZ3 1 ATOM 4136 C CH2 . TRP C 3 251 ? 28.638 -29.672 -31.375 1.00 17.79 ? 398 TRP C CH2 1 ATOM 4137 N N . VAL C 3 252 ? 25.567 -26.769 -35.188 1.00 18.69 ? 399 VAL C N 1 ATOM 4138 C CA . VAL C 3 252 ? 24.514 -27.055 -34.177 1.00 19.16 ? 399 VAL C CA 1 ATOM 4139 C C . VAL C 3 252 ? 23.242 -27.644 -34.825 1.00 22.37 ? 399 VAL C C 1 ATOM 4140 O O . VAL C 3 252 ? 22.662 -28.627 -34.345 1.00 19.38 ? 399 VAL C O 1 ATOM 4141 C CB . VAL C 3 252 ? 24.080 -25.843 -33.372 1.00 18.05 ? 399 VAL C CB 1 ATOM 4142 C CG1 . VAL C 3 252 ? 22.867 -26.194 -32.541 1.00 19.79 ? 399 VAL C CG1 1 ATOM 4143 C CG2 . VAL C 3 252 ? 25.202 -25.398 -32.438 1.00 18.57 ? 399 VAL C CG2 1 ATOM 4144 N N . GLN C 3 253 ? 22.843 -27.052 -35.932 1.00 25.42 ? 400 GLN C N 1 ATOM 4145 C CA . GLN C 3 253 ? 21.596 -27.470 -36.637 1.00 30.08 ? 400 GLN C CA 1 ATOM 4146 C C . GLN C 3 253 ? 21.685 -28.859 -37.225 1.00 26.79 ? 400 GLN C C 1 ATOM 4147 O O . GLN C 3 253 ? 20.760 -29.639 -37.116 1.00 26.14 ? 400 GLN C O 1 ATOM 4148 C CB . GLN C 3 253 ? 21.199 -26.456 -37.690 1.00 32.42 ? 400 GLN C CB 1 ATOM 4149 C CG . GLN C 3 253 ? 20.072 -25.631 -37.139 1.00 44.96 ? 400 GLN C CG 1 ATOM 4150 C CD . GLN C 3 253 ? 20.161 -24.189 -37.504 1.00 56.82 ? 400 GLN C CD 1 ATOM 4151 O OE1 . GLN C 3 253 ? 20.137 -23.311 -36.614 1.00 69.34 ? 400 GLN C OE1 1 ATOM 4152 N NE2 . GLN C 3 253 ? 20.249 -23.911 -38.809 1.00 51.04 ? 400 GLN C NE2 1 ATOM 4153 N N . LYS C 3 254 ? 22.829 -29.180 -37.789 1.00 22.63 ? 401 LYS C N 1 ATOM 4154 C CA . LYS C 3 254 ? 23.062 -30.517 -38.288 1.00 24.99 ? 401 LYS C CA 1 ATOM 4155 C C . LYS C 3 254 ? 23.054 -31.513 -37.171 1.00 24.09 ? 401 LYS C C 1 ATOM 4156 O O . LYS C 3 254 ? 22.553 -32.665 -37.324 1.00 21.40 ? 401 LYS C O 1 ATOM 4157 C CB . LYS C 3 254 ? 24.435 -30.600 -38.991 1.00 27.55 ? 401 LYS C CB 1 ATOM 4158 C CG . LYS C 3 254 ? 24.884 -32.019 -39.299 1.00 35.45 ? 401 LYS C CG 1 ATOM 4159 C CD . LYS C 3 254 ? 26.235 -32.125 -40.023 1.00 40.68 ? 401 LYS C CD 1 ATOM 4160 C CE . LYS C 3 254 ? 27.361 -32.397 -39.018 1.00 46.93 ? 401 LYS C CE 1 ATOM 4161 N NZ . LYS C 3 254 ? 28.670 -32.041 -39.628 1.00 50.10 ? 401 LYS C NZ 1 ATOM 4162 N N . THR C 3 255 ? 23.725 -31.161 -36.076 1.00 21.20 ? 402 THR C N 1 ATOM 4163 C CA . THR C 3 255 ? 23.809 -32.118 -35.000 1.00 21.45 ? 402 THR C CA 1 ATOM 4164 C C . THR C 3 255 ? 22.415 -32.467 -34.446 1.00 22.18 ? 402 THR C C 1 ATOM 4165 O O . THR C 3 255 ? 22.054 -33.669 -34.262 1.00 20.39 ? 402 THR C O 1 ATOM 4166 C CB . THR C 3 255 ? 24.737 -31.629 -33.917 1.00 21.95 ? 402 THR C CB 1 ATOM 4167 O OG1 . THR C 3 255 ? 26.058 -31.507 -34.470 1.00 21.37 ? 402 THR C OG1 1 ATOM 4168 C CG2 . THR C 3 255 ? 24.741 -32.616 -32.747 1.00 22.41 ? 402 THR C CG2 1 ATOM 4169 N N . ILE C 3 256 ? 21.637 -31.439 -34.205 1.00 20.14 ? 403 ILE C N 1 ATOM 4170 C CA . ILE C 3 256 ? 20.288 -31.627 -33.671 1.00 24.00 ? 403 ILE C CA 1 ATOM 4171 C C . ILE C 3 256 ? 19.382 -32.428 -34.672 1.00 27.05 ? 403 ILE C C 1 ATOM 4172 O O . ILE C 3 256 ? 18.663 -33.380 -34.265 1.00 23.95 ? 403 ILE C O 1 ATOM 4173 C CB . ILE C 3 256 ? 19.653 -30.285 -33.399 1.00 22.65 ? 403 ILE C CB 1 ATOM 4174 C CG1 . ILE C 3 256 ? 20.322 -29.608 -32.191 1.00 22.69 ? 403 ILE C CG1 1 ATOM 4175 C CG2 . ILE C 3 256 ? 18.125 -30.402 -33.287 1.00 22.57 ? 403 ILE C CG2 1 ATOM 4176 C CD1 . ILE C 3 256 ? 19.871 -28.154 -32.072 1.00 22.18 ? 403 ILE C CD1 1 ATOM 4177 N N . ALA C 3 257 ? 19.470 -32.066 -35.961 1.00 25.77 ? 404 ALA C N 1 ATOM 4178 C CA . ALA C 3 257 ? 18.772 -32.815 -37.014 1.00 30.62 ? 404 ALA C CA 1 ATOM 4179 C C . ALA C 3 257 ? 19.199 -34.287 -37.080 1.00 29.30 ? 404 ALA C C 1 ATOM 4180 O O . ALA C 3 257 ? 18.383 -35.134 -37.340 1.00 28.03 ? 404 ALA C O 1 ATOM 4181 C CB . ALA C 3 257 ? 18.969 -32.140 -38.379 1.00 30.41 ? 404 ALA C CB 1 ATOM 4182 N N . GLU C 3 258 ? 20.472 -34.578 -36.873 1.00 28.18 ? 405 GLU C N 1 ATOM 4183 C CA . GLU C 3 258 ? 20.914 -35.945 -36.803 1.00 31.84 ? 405 GLU C CA 1 ATOM 4184 C C . GLU C 3 258 ? 20.661 -36.755 -35.532 1.00 32.03 ? 405 GLU C C 1 ATOM 4185 O O . GLU C 3 258 ? 20.860 -37.941 -35.604 1.00 32.95 ? 405 GLU C O 1 ATOM 4186 C CB . GLU C 3 258 ? 22.392 -36.042 -37.085 1.00 33.72 ? 405 GLU C CB 1 ATOM 4187 C CG . GLU C 3 258 ? 22.645 -36.025 -38.562 1.00 40.47 ? 405 GLU C CG 1 ATOM 4188 C CD . GLU C 3 258 ? 24.081 -35.681 -38.897 1.00 45.31 ? 405 GLU C CD 1 ATOM 4189 O OE1 . GLU C 3 258 ? 25.014 -35.992 -38.111 1.00 53.90 ? 405 GLU C OE1 1 ATOM 4190 O OE2 . GLU C 3 258 ? 24.272 -35.086 -39.961 1.00 48.82 ? 405 GLU C OE2 1 ATOM 4191 N N . ASN C 3 259 ? 20.193 -36.236 -34.406 1.00 33.92 ? 406 ASN C N 1 ATOM 4192 C CA . ASN C 3 259 ? 20.243 -37.093 -33.169 1.00 38.34 ? 406 ASN C CA 1 ATOM 4193 C C . ASN C 3 259 ? 19.032 -37.203 -32.303 1.00 36.62 ? 406 ASN C C 1 ATOM 4194 O O . ASN C 3 259 ? 18.108 -36.441 -32.488 1.00 48.47 ? 406 ASN C O 1 ATOM 4195 C CB . ASN C 3 259 ? 21.357 -36.623 -32.293 1.00 40.69 ? 406 ASN C CB 1 ATOM 4196 C CG . ASN C 3 259 ? 22.723 -36.881 -32.901 1.00 44.96 ? 406 ASN C CG 1 ATOM 4197 O OD1 . ASN C 3 259 ? 23.322 -36.014 -33.517 1.00 41.26 ? 406 ASN C OD1 1 ATOM 4198 N ND2 . ASN C 3 259 ? 23.210 -38.073 -32.728 1.00 48.91 ? 406 ASN C ND2 1 HETATM 4199 C CHA . HEM D 4 . ? 52.589 -25.088 0.618 1.00 14.53 ? 201 HEM A CHA 1 HETATM 4200 C CHB . HEM D 4 . ? 52.325 -20.398 -0.370 1.00 14.70 ? 201 HEM A CHB 1 HETATM 4201 C CHC . HEM D 4 . ? 47.559 -20.497 0.289 1.00 12.47 ? 201 HEM A CHC 1 HETATM 4202 C CHD . HEM D 4 . ? 47.943 -25.077 1.511 1.00 15.94 ? 201 HEM A CHD 1 HETATM 4203 C C1A . HEM D 4 . ? 52.911 -23.797 0.316 1.00 15.61 ? 201 HEM A C1A 1 HETATM 4204 C C2A . HEM D 4 . ? 54.225 -23.346 0.168 1.00 17.76 ? 201 HEM A C2A 1 HETATM 4205 C C3A . HEM D 4 . ? 54.147 -22.026 -0.072 1.00 16.68 ? 201 HEM A C3A 1 HETATM 4206 C C4A . HEM D 4 . ? 52.790 -21.683 -0.128 1.00 15.34 ? 201 HEM A C4A 1 HETATM 4207 C CMA . HEM D 4 . ? 55.341 -21.092 -0.324 1.00 15.90 ? 201 HEM A CMA 1 HETATM 4208 C CAA . HEM D 4 . ? 55.543 -24.118 0.368 1.00 20.80 ? 201 HEM A CAA 1 HETATM 4209 C CBA . HEM D 4 . ? 56.032 -24.699 -0.929 1.00 27.69 ? 201 HEM A CBA 1 HETATM 4210 C CGA . HEM D 4 . ? 57.377 -25.363 -0.699 1.00 35.81 ? 201 HEM A CGA 1 HETATM 4211 O O1A . HEM D 4 . ? 57.869 -25.610 0.452 1.00 43.76 ? 201 HEM A O1A 1 HETATM 4212 O O2A . HEM D 4 . ? 57.982 -25.662 -1.740 1.00 43.30 ? 201 HEM A O2A 1 HETATM 4213 C C1B . HEM D 4 . ? 50.988 -20.017 -0.279 1.00 14.38 ? 201 HEM A C1B 1 HETATM 4214 C C2B . HEM D 4 . ? 50.477 -18.671 -0.535 1.00 14.11 ? 201 HEM A C2B 1 HETATM 4215 C C3B . HEM D 4 . ? 49.102 -18.689 -0.346 1.00 12.21 ? 201 HEM A C3B 1 HETATM 4216 C C4B . HEM D 4 . ? 48.829 -20.073 0.043 1.00 12.45 ? 201 HEM A C4B 1 HETATM 4217 C CMB . HEM D 4 . ? 51.364 -17.545 -0.949 1.00 15.76 ? 201 HEM A CMB 1 HETATM 4218 C CAB . HEM D 4 . ? 48.041 -17.655 -0.413 1.00 13.05 ? 201 HEM A CAB 1 HETATM 4219 C CBB . HEM D 4 . ? 48.318 -16.330 -0.382 1.00 13.41 ? 201 HEM A CBB 1 HETATM 4220 C C1C . HEM D 4 . ? 47.254 -21.750 0.703 1.00 13.65 ? 201 HEM A C1C 1 HETATM 4221 C C2C . HEM D 4 . ? 45.999 -22.127 1.188 1.00 14.31 ? 201 HEM A C2C 1 HETATM 4222 C C3C . HEM D 4 . ? 46.072 -23.458 1.532 1.00 15.03 ? 201 HEM A C3C 1 HETATM 4223 C C4C . HEM D 4 . ? 47.431 -23.831 1.296 1.00 14.49 ? 201 HEM A C4C 1 HETATM 4224 C CMC . HEM D 4 . ? 44.793 -21.249 1.266 1.00 14.75 ? 201 HEM A CMC 1 HETATM 4225 C CAC . HEM D 4 . ? 45.042 -24.339 2.170 1.00 15.04 ? 201 HEM A CAC 1 HETATM 4226 C CBC . HEM D 4 . ? 43.999 -23.950 2.854 1.00 15.80 ? 201 HEM A CBC 1 HETATM 4227 C C1D . HEM D 4 . ? 49.257 -25.452 1.310 1.00 14.33 ? 201 HEM A C1D 1 HETATM 4228 C C2D . HEM D 4 . ? 49.727 -26.816 1.664 1.00 15.41 ? 201 HEM A C2D 1 HETATM 4229 C C3D . HEM D 4 . ? 51.015 -26.839 1.400 1.00 14.62 ? 201 HEM A C3D 1 HETATM 4230 C C4D . HEM D 4 . ? 51.310 -25.455 0.941 1.00 14.07 ? 201 HEM A C4D 1 HETATM 4231 C CMD . HEM D 4 . ? 48.870 -27.983 2.196 1.00 16.22 ? 201 HEM A CMD 1 HETATM 4232 C CAD . HEM D 4 . ? 52.012 -28.021 1.544 1.00 16.41 ? 201 HEM A CAD 1 HETATM 4233 C CBD . HEM D 4 . ? 52.607 -28.066 2.922 1.00 18.59 ? 201 HEM A CBD 1 HETATM 4234 C CGD . HEM D 4 . ? 53.779 -29.020 2.999 1.00 24.31 ? 201 HEM A CGD 1 HETATM 4235 O O1D . HEM D 4 . ? 54.807 -28.921 2.314 1.00 32.99 ? 201 HEM A O1D 1 HETATM 4236 O O2D . HEM D 4 . ? 53.739 -30.013 3.689 1.00 28.05 ? 201 HEM A O2D 1 HETATM 4237 N NA . HEM D 4 . ? 52.041 -22.769 0.158 1.00 14.24 ? 201 HEM A NA 1 HETATM 4238 N NB . HEM D 4 . ? 49.946 -20.779 -0.009 1.00 13.11 ? 201 HEM A NB 1 HETATM 4239 N NC . HEM D 4 . ? 48.095 -22.797 0.758 1.00 13.53 ? 201 HEM A NC 1 HETATM 4240 N ND . HEM D 4 . ? 50.234 -24.682 0.891 1.00 15.64 ? 201 HEM A ND 1 HETATM 4241 FE FE . HEM D 4 . ? 50.092 -22.800 0.428 1.00 15.55 ? 201 HEM A FE 1 HETATM 4242 O O1 . OXY E 5 . ? 50.447 -22.341 2.372 1.00 31.48 ? 202 OXY A O1 1 HETATM 4243 O O2 . OXY E 5 . ? 49.392 -21.947 2.840 1.00 48.16 ? 202 OXY A O2 1 HETATM 4244 C CHA . HEM F 4 . ? 19.521 -0.243 4.609 1.00 24.06 ? 201 HEM B CHA 1 HETATM 4245 C CHB . HEM F 4 . ? 21.529 -3.421 7.565 1.00 26.03 ? 201 HEM B CHB 1 HETATM 4246 C CHC . HEM F 4 . ? 24.438 -5.026 4.055 1.00 20.35 ? 201 HEM B CHC 1 HETATM 4247 C CHD . HEM F 4 . ? 22.682 -1.592 1.179 1.00 22.81 ? 201 HEM B CHD 1 HETATM 4248 C C1A . HEM F 4 . ? 19.831 -0.989 5.707 1.00 24.34 ? 201 HEM B C1A 1 HETATM 4249 C C2A . HEM F 4 . ? 19.323 -0.722 7.017 1.00 28.24 ? 201 HEM B C2A 1 HETATM 4250 C C3A . HEM F 4 . ? 19.878 -1.612 7.847 1.00 27.67 ? 201 HEM B C3A 1 HETATM 4251 C C4A . HEM F 4 . ? 20.746 -2.421 7.051 1.00 26.58 ? 201 HEM B C4A 1 HETATM 4252 C CMA . HEM F 4 . ? 19.589 -1.781 9.341 1.00 30.78 ? 201 HEM B CMA 1 HETATM 4253 C CAA . HEM F 4 . ? 18.273 0.311 7.381 1.00 29.21 ? 201 HEM B CAA 1 HETATM 4254 C CBA . HEM F 4 . ? 16.925 -0.382 7.023 1.00 32.44 ? 201 HEM B CBA 1 HETATM 4255 C CGA . HEM F 4 . ? 15.636 0.385 7.398 1.00 39.51 ? 201 HEM B CGA 1 HETATM 4256 O O1A . HEM F 4 . ? 15.618 1.622 7.636 1.00 41.31 ? 201 HEM B O1A 1 HETATM 4257 O O2A . HEM F 4 . ? 14.535 -0.233 7.460 1.00 45.92 ? 201 HEM B O2A 1 HETATM 4258 C C1B . HEM F 4 . ? 22.501 -4.132 6.856 1.00 26.03 ? 201 HEM B C1B 1 HETATM 4259 C C2B . HEM F 4 . ? 23.265 -5.148 7.473 1.00 26.80 ? 201 HEM B C2B 1 HETATM 4260 C C3B . HEM F 4 . ? 24.134 -5.616 6.503 1.00 27.12 ? 201 HEM B C3B 1 HETATM 4261 C C4B . HEM F 4 . ? 23.788 -4.876 5.264 1.00 24.78 ? 201 HEM B C4B 1 HETATM 4262 C CMB . HEM F 4 . ? 23.115 -5.514 8.937 1.00 26.40 ? 201 HEM B CMB 1 HETATM 4263 C CAB . HEM F 4 . ? 25.137 -6.709 6.445 1.00 26.82 ? 201 HEM B CAB 1 HETATM 4264 C CBB . HEM F 4 . ? 25.293 -7.612 7.357 1.00 28.25 ? 201 HEM B CBB 1 HETATM 4265 C C1C . HEM F 4 . ? 24.259 -4.176 2.929 1.00 19.83 ? 201 HEM B C1C 1 HETATM 4266 C C2C . HEM F 4 . ? 25.066 -4.141 1.760 1.00 19.68 ? 201 HEM B C2C 1 HETATM 4267 C C3C . HEM F 4 . ? 24.551 -3.207 0.928 1.00 20.31 ? 201 HEM B C3C 1 HETATM 4268 C C4C . HEM F 4 . ? 23.441 -2.628 1.648 1.00 20.90 ? 201 HEM B C4C 1 HETATM 4269 C CMC . HEM F 4 . ? 26.263 -5.040 1.523 1.00 19.80 ? 201 HEM B CMC 1 HETATM 4270 C CAC . HEM F 4 . ? 25.015 -2.704 -0.379 1.00 22.21 ? 201 HEM B CAC 1 HETATM 4271 C CBC . HEM F 4 . ? 26.112 -3.074 -1.074 1.00 23.39 ? 201 HEM B CBC 1 HETATM 4272 C C1D . HEM F 4 . ? 21.673 -0.954 1.898 1.00 24.72 ? 201 HEM B C1D 1 HETATM 4273 C C2D . HEM F 4 . ? 20.911 0.175 1.328 1.00 26.40 ? 201 HEM B C2D 1 HETATM 4274 C C3D . HEM F 4 . ? 20.014 0.535 2.288 1.00 28.43 ? 201 HEM B C3D 1 HETATM 4275 C C4D . HEM F 4 . ? 20.264 -0.374 3.430 1.00 25.81 ? 201 HEM B C4D 1 HETATM 4276 C CMD . HEM F 4 . ? 21.053 0.850 -0.038 1.00 28.72 ? 201 HEM B CMD 1 HETATM 4277 C CAD . HEM F 4 . ? 19.021 1.668 2.181 1.00 28.73 ? 201 HEM B CAD 1 HETATM 4278 C CBD . HEM F 4 . ? 19.658 2.852 2.939 1.00 38.70 ? 201 HEM B CBD 1 HETATM 4279 C CGD . HEM F 4 . ? 18.915 4.158 2.700 1.00 41.78 ? 201 HEM B CGD 1 HETATM 4280 O O1D . HEM F 4 . ? 19.338 5.250 3.123 1.00 45.33 ? 201 HEM B O1D 1 HETATM 4281 O O2D . HEM F 4 . ? 17.855 4.177 2.056 1.00 47.45 ? 201 HEM B O2D 1 HETATM 4282 N NA . HEM F 4 . ? 20.730 -2.006 5.759 1.00 23.90 ? 201 HEM B NA 1 HETATM 4283 N NB . HEM F 4 . ? 22.791 -4.057 5.571 1.00 24.03 ? 201 HEM B NB 1 HETATM 4284 N NC . HEM F 4 . ? 23.329 -3.237 2.823 1.00 19.91 ? 201 HEM B NC 1 HETATM 4285 N ND . HEM F 4 . ? 21.255 -1.275 3.153 1.00 21.01 ? 201 HEM B ND 1 HETATM 4286 FE FE . HEM F 4 . ? 21.969 -2.636 4.291 1.00 22.15 ? 201 HEM B FE 1 HETATM 4287 O O1 . OXY G 5 . ? 22.735 -1.443 4.957 1.00 23.42 ? 202 OXY B O1 1 HETATM 4288 O O2 . OXY G 5 . ? 23.932 -1.280 4.903 1.00 29.52 ? 202 OXY B O2 1 HETATM 4289 C C1 . GOL H 6 . ? 19.843 1.600 -6.360 1.00 37.24 ? 203 GOL B C1 1 HETATM 4290 O O1 . GOL H 6 . ? 21.239 1.781 -6.196 1.00 44.60 ? 203 GOL B O1 1 HETATM 4291 C C2 . GOL H 6 . ? 19.672 0.107 -6.401 1.00 35.71 ? 203 GOL B C2 1 HETATM 4292 O O2 . GOL H 6 . ? 19.203 -0.358 -5.111 1.00 35.98 ? 203 GOL B O2 1 HETATM 4293 C C3 . GOL H 6 . ? 18.678 -0.188 -7.499 1.00 35.12 ? 203 GOL B C3 1 HETATM 4294 O O3 . GOL H 6 . ? 18.356 -1.558 -7.506 1.00 32.36 ? 203 GOL B O3 1 HETATM 4295 C C1 . NAG I 7 . ? 36.689 -28.759 -38.281 1.00 24.05 ? 501 NAG C C1 1 HETATM 4296 C C2 . NAG I 7 . ? 35.591 -28.075 -39.099 1.00 26.63 ? 501 NAG C C2 1 HETATM 4297 C C3 . NAG I 7 . ? 35.733 -28.605 -40.543 1.00 27.96 ? 501 NAG C C3 1 HETATM 4298 C C4 . NAG I 7 . ? 37.116 -28.314 -41.115 1.00 30.95 ? 501 NAG C C4 1 HETATM 4299 C C5 . NAG I 7 . ? 38.109 -29.002 -40.168 1.00 27.51 ? 501 NAG C C5 1 HETATM 4300 C C6 . NAG I 7 . ? 39.538 -28.765 -40.656 1.00 27.91 ? 501 NAG C C6 1 HETATM 4301 C C7 . NAG I 7 . ? 33.332 -27.759 -38.131 1.00 25.18 ? 501 NAG C C7 1 HETATM 4302 C C8 . NAG I 7 . ? 32.082 -28.505 -37.729 1.00 27.39 ? 501 NAG C C8 1 HETATM 4303 N N2 . NAG I 7 . ? 34.286 -28.510 -38.616 1.00 25.29 ? 501 NAG C N2 1 HETATM 4304 O O3 . NAG I 7 . ? 34.801 -27.893 -41.310 1.00 27.42 ? 501 NAG C O3 1 HETATM 4305 O O4 . NAG I 7 . ? 37.289 -28.734 -42.486 1.00 33.11 ? 501 NAG C O4 1 HETATM 4306 O O5 . NAG I 7 . ? 37.927 -28.437 -38.873 1.00 25.96 ? 501 NAG C O5 1 HETATM 4307 O O6 . NAG I 7 . ? 39.808 -27.367 -40.616 1.00 26.78 ? 501 NAG C O6 1 HETATM 4308 O O7 . NAG I 7 . ? 33.396 -26.556 -37.944 1.00 23.28 ? 501 NAG C O7 1 HETATM 4309 C C1 . FUC J 8 . ? 40.138 -26.934 -41.950 1.00 29.75 ? 502 FUC C C1 1 HETATM 4310 C C2 . FUC J 8 . ? 40.321 -25.421 -41.854 1.00 31.38 ? 502 FUC C C2 1 HETATM 4311 C C3 . FUC J 8 . ? 41.572 -25.138 -41.044 1.00 28.33 ? 502 FUC C C3 1 HETATM 4312 C C4 . FUC J 8 . ? 42.776 -25.854 -41.626 1.00 27.99 ? 502 FUC C C4 1 HETATM 4313 C C5 . FUC J 8 . ? 42.523 -27.360 -41.753 1.00 31.03 ? 502 FUC C C5 1 HETATM 4314 C C6 . FUC J 8 . ? 43.753 -28.061 -42.360 1.00 32.12 ? 502 FUC C C6 1 HETATM 4315 O O2 . FUC J 8 . ? 39.262 -24.888 -41.127 1.00 32.48 ? 502 FUC C O2 1 HETATM 4316 O O3 . FUC J 8 . ? 41.815 -23.758 -40.864 1.00 32.68 ? 502 FUC C O3 1 HETATM 4317 O O4 . FUC J 8 . ? 43.071 -25.350 -42.887 1.00 26.68 ? 502 FUC C O4 1 HETATM 4318 O O5 . FUC J 8 . ? 41.327 -27.584 -42.466 1.00 30.89 ? 502 FUC C O5 1 HETATM 4319 S S . SO4 K 9 . ? 19.881 -3.166 -10.263 1.00 21.08 ? 503 SO4 C S 1 HETATM 4320 O O1 . SO4 K 9 . ? 20.352 -2.187 -11.234 1.00 21.29 ? 503 SO4 C O1 1 HETATM 4321 O O2 . SO4 K 9 . ? 20.471 -4.469 -10.636 1.00 21.04 ? 503 SO4 C O2 1 HETATM 4322 O O3 . SO4 K 9 . ? 18.412 -3.373 -10.527 1.00 15.63 ? 503 SO4 C O3 1 HETATM 4323 O O4 . SO4 K 9 . ? 20.251 -2.971 -8.872 1.00 20.42 ? 503 SO4 C O4 1 HETATM 4324 C C1 . GOL L 6 . ? 40.459 -33.319 -31.394 1.00 28.69 ? 504 GOL C C1 1 HETATM 4325 O O1 . GOL L 6 . ? 40.544 -34.114 -30.301 1.00 32.77 ? 504 GOL C O1 1 HETATM 4326 C C2 . GOL L 6 . ? 40.342 -31.934 -30.741 1.00 25.80 ? 504 GOL C C2 1 HETATM 4327 O O2 . GOL L 6 . ? 41.618 -31.492 -30.199 1.00 24.28 ? 504 GOL C O2 1 HETATM 4328 C C3 . GOL L 6 . ? 39.949 -31.150 -31.955 1.00 23.34 ? 504 GOL C C3 1 HETATM 4329 O O3 . GOL L 6 . ? 40.208 -29.755 -31.795 1.00 23.69 ? 504 GOL C O3 1 HETATM 4330 AS AS . CAC M 10 . ? 37.955 -0.823 -22.403 0.50 141.74 ? 505 CAC C AS 1 HETATM 4331 O O1 . CAC M 10 . ? 39.350 0.220 -22.214 0.50 47.18 ? 505 CAC C O1 1 HETATM 4332 O O2 . CAC M 10 . ? 38.246 -2.327 -21.592 1.00 178.55 ? 505 CAC C O2 1 HETATM 4333 C C1 . CAC M 10 . ? 36.353 0.011 -21.471 1.00 198.26 ? 505 CAC C C1 1 HETATM 4334 C C2 . CAC M 10 . ? 37.942 -1.537 -24.260 1.00 137.38 ? 505 CAC C C2 1 HETATM 4335 O O . HOH N 11 . ? 47.234 -31.338 1.558 1.00 22.16 ? 301 HOH A O 1 HETATM 4336 O O . HOH N 11 . ? 45.473 -31.747 -0.485 1.00 23.49 ? 302 HOH A O 1 HETATM 4337 O O . HOH N 11 . ? 47.042 -31.989 11.980 1.00 30.11 ? 303 HOH A O 1 HETATM 4338 O O . HOH N 11 . ? 60.405 -2.903 9.049 1.00 23.34 ? 304 HOH A O 1 HETATM 4339 O O . HOH N 11 . ? 50.504 0.713 13.894 1.00 25.69 ? 305 HOH A O 1 HETATM 4340 O O . HOH N 11 . ? 52.255 5.545 -7.313 1.00 38.53 ? 306 HOH A O 1 HETATM 4341 O O . HOH N 11 . ? 52.884 1.090 12.863 1.00 18.05 ? 307 HOH A O 1 HETATM 4342 O O . HOH N 11 . ? 56.048 -28.067 15.338 1.00 21.94 ? 308 HOH A O 1 HETATM 4343 O O . HOH N 11 . ? 35.481 -24.169 8.056 1.00 18.58 ? 309 HOH A O 1 HETATM 4344 O O . HOH N 11 . ? 56.307 -26.315 18.627 1.00 26.92 ? 310 HOH A O 1 HETATM 4345 O O . HOH N 11 . ? 44.536 -32.951 2.162 1.00 44.37 ? 311 HOH A O 1 HETATM 4346 O O . HOH N 11 . ? 61.908 -4.975 9.595 1.00 30.03 ? 312 HOH A O 1 HETATM 4347 O O . HOH N 11 . ? 42.696 -34.474 6.149 1.00 34.39 ? 313 HOH A O 1 HETATM 4348 O O . HOH N 11 . ? 47.623 -30.861 15.577 1.00 27.77 ? 314 HOH A O 1 HETATM 4349 O O . HOH N 11 . ? 46.714 -22.155 -10.432 1.00 16.49 ? 315 HOH A O 1 HETATM 4350 O O . HOH N 11 . ? 42.921 6.004 3.089 1.00 16.87 ? 316 HOH A O 1 HETATM 4351 O O . HOH N 11 . ? 34.449 -20.051 13.405 1.00 25.72 ? 317 HOH A O 1 HETATM 4352 O O . HOH N 11 . ? 44.713 -31.702 -11.735 1.00 29.92 ? 318 HOH A O 1 HETATM 4353 O O . HOH N 11 . ? 56.675 -25.443 5.731 1.00 37.15 ? 319 HOH A O 1 HETATM 4354 O O . HOH N 11 . ? 40.311 -22.786 -12.057 1.00 17.29 ? 320 HOH A O 1 HETATM 4355 O O . HOH N 11 . ? 48.394 -19.489 -12.690 1.00 20.24 ? 321 HOH A O 1 HETATM 4356 O O . HOH N 11 . ? 51.284 -19.333 -12.758 1.00 24.44 ? 322 HOH A O 1 HETATM 4357 O O . HOH N 11 . ? 58.413 -19.493 0.091 1.00 28.95 ? 323 HOH A O 1 HETATM 4358 O O . HOH N 11 . ? 58.485 -7.998 4.215 1.00 36.69 ? 324 HOH A O 1 HETATM 4359 O O . HOH N 11 . ? 60.354 -21.799 6.843 1.00 31.91 ? 325 HOH A O 1 HETATM 4360 O O . HOH N 11 . ? 47.239 -23.337 14.273 1.00 30.37 ? 326 HOH A O 1 HETATM 4361 O O . HOH N 11 . ? 52.298 2.139 3.710 1.00 32.18 ? 327 HOH A O 1 HETATM 4362 O O . HOH N 11 . ? 40.200 -25.389 14.490 1.00 37.15 ? 328 HOH A O 1 HETATM 4363 O O . HOH N 11 . ? 44.740 -31.724 10.101 1.00 27.35 ? 329 HOH A O 1 HETATM 4364 O O . HOH N 11 . ? 46.900 -32.615 -12.014 1.00 36.13 ? 330 HOH A O 1 HETATM 4365 O O . HOH N 11 . ? 38.447 -6.673 3.514 1.00 23.29 ? 331 HOH A O 1 HETATM 4366 O O . HOH N 11 . ? 56.370 -20.308 -7.839 1.00 24.49 ? 332 HOH A O 1 HETATM 4367 O O . HOH N 11 . ? 57.207 -17.519 11.262 1.00 38.31 ? 333 HOH A O 1 HETATM 4368 O O . HOH N 11 . ? 43.058 -29.576 -10.130 1.00 28.15 ? 334 HOH A O 1 HETATM 4369 O O . HOH N 11 . ? 44.126 -24.043 -6.464 1.00 21.56 ? 335 HOH A O 1 HETATM 4370 O O . HOH N 11 . ? 43.833 1.820 -2.714 1.00 30.68 ? 336 HOH A O 1 HETATM 4371 O O . HOH N 11 . ? 58.805 -12.663 11.295 1.00 23.63 ? 337 HOH A O 1 HETATM 4372 O O . HOH N 11 . ? 60.130 -12.528 8.092 1.00 27.27 ? 338 HOH A O 1 HETATM 4373 O O . HOH N 11 . ? 51.475 -9.763 -12.607 1.00 40.20 ? 339 HOH A O 1 HETATM 4374 O O . HOH N 11 . ? 50.777 2.207 5.155 1.00 39.04 ? 340 HOH A O 1 HETATM 4375 O O . HOH N 11 . ? 52.411 -21.252 15.556 1.00 35.06 ? 341 HOH A O 1 HETATM 4376 O O . HOH N 11 . ? 39.642 -10.594 2.024 1.00 39.71 ? 342 HOH A O 1 HETATM 4377 O O . HOH N 11 . ? 41.625 -10.505 -0.905 1.00 36.40 ? 343 HOH A O 1 HETATM 4378 O O . HOH N 11 . ? 51.311 -17.669 15.528 1.00 37.50 ? 344 HOH A O 1 HETATM 4379 O O . HOH N 11 . ? 36.874 -30.860 -6.513 1.00 33.72 ? 345 HOH A O 1 HETATM 4380 O O . HOH N 11 . ? 42.921 0.059 -4.541 1.00 39.25 ? 346 HOH A O 1 HETATM 4381 O O . HOH N 11 . ? 35.919 -28.697 -4.805 1.00 35.98 ? 347 HOH A O 1 HETATM 4382 O O . HOH N 11 . ? 59.210 -7.401 -2.229 1.00 29.96 ? 348 HOH A O 1 HETATM 4383 O O . HOH N 11 . ? 38.671 -10.029 -1.209 1.00 41.67 ? 349 HOH A O 1 HETATM 4384 O O . HOH N 11 . ? 56.941 -7.207 -12.210 1.00 36.79 ? 350 HOH A O 1 HETATM 4385 O O . HOH N 11 . ? 37.644 -27.373 0.703 1.00 22.45 ? 351 HOH A O 1 HETATM 4386 O O . HOH N 11 . ? 50.308 -20.402 16.093 1.00 36.12 ? 352 HOH A O 1 HETATM 4387 O O . HOH N 11 . ? 49.139 -22.372 15.360 1.00 36.99 ? 353 HOH A O 1 HETATM 4388 O O . HOH N 11 . ? 42.838 -32.197 1.472 1.00 42.95 ? 354 HOH A O 1 HETATM 4389 O O . HOH N 11 . ? 47.941 -7.544 -11.060 1.00 37.79 ? 355 HOH A O 1 HETATM 4390 O O . HOH O 11 . ? 24.870 10.599 -4.861 1.00 24.08 ? 301 HOH B O 1 HETATM 4391 O O . HOH O 11 . ? 15.826 -1.551 -7.022 1.00 32.44 ? 302 HOH B O 1 HETATM 4392 O O . HOH O 11 . ? 19.820 5.806 -6.375 1.00 21.63 ? 303 HOH B O 1 HETATM 4393 O O . HOH O 11 . ? 20.984 5.693 -2.458 1.00 40.89 ? 304 HOH B O 1 HETATM 4394 O O . HOH O 11 . ? 20.767 5.545 -10.297 1.00 20.14 ? 305 HOH B O 1 HETATM 4395 O O . HOH O 11 . ? 47.565 -4.679 20.465 1.00 28.05 ? 306 HOH B O 1 HETATM 4396 O O . HOH O 11 . ? 21.590 4.650 -5.042 1.00 22.42 ? 307 HOH B O 1 HETATM 4397 O O . HOH O 11 . ? 48.218 -7.945 17.669 1.00 27.51 ? 308 HOH B O 1 HETATM 4398 O O . HOH O 11 . ? 21.652 -5.739 -8.493 1.00 14.25 ? 309 HOH B O 1 HETATM 4399 O O . HOH O 11 . ? 19.960 1.312 -3.170 1.00 21.95 ? 310 HOH B O 1 HETATM 4400 O O . HOH O 11 . ? 41.292 -15.536 23.420 1.00 30.79 ? 311 HOH B O 1 HETATM 4401 O O . HOH O 11 . ? 17.267 -5.834 13.233 1.00 47.72 ? 312 HOH B O 1 HETATM 4402 O O . HOH O 11 . ? 39.797 3.673 9.734 1.00 39.12 ? 313 HOH B O 1 HETATM 4403 O O . HOH O 11 . ? 30.145 -12.211 -8.121 1.00 37.43 ? 314 HOH B O 1 HETATM 4404 O O . HOH O 11 . ? 15.642 -14.415 6.960 1.00 39.01 ? 315 HOH B O 1 HETATM 4405 O O . HOH O 11 . ? 20.231 -18.055 3.578 1.00 41.68 ? 316 HOH B O 1 HETATM 4406 O O . HOH O 11 . ? 45.308 -2.685 16.138 1.00 31.79 ? 317 HOH B O 1 HETATM 4407 O O . HOH O 11 . ? 29.051 5.058 12.719 1.00 26.09 ? 318 HOH B O 1 HETATM 4408 O O . HOH O 11 . ? 28.573 2.798 14.196 1.00 24.73 ? 319 HOH B O 1 HETATM 4409 O O . HOH O 11 . ? 35.421 1.086 19.191 1.00 32.87 ? 320 HOH B O 1 HETATM 4410 O O . HOH O 11 . ? 14.431 -7.753 9.721 1.00 33.86 ? 321 HOH B O 1 HETATM 4411 O O . HOH O 11 . ? 45.671 -11.581 19.170 1.00 26.82 ? 322 HOH B O 1 HETATM 4412 O O . HOH O 11 . ? 32.572 -16.086 8.744 1.00 28.86 ? 323 HOH B O 1 HETATM 4413 O O . HOH O 11 . ? 22.029 7.064 12.333 1.00 33.41 ? 324 HOH B O 1 HETATM 4414 O O . HOH O 11 . ? 27.569 -10.443 7.888 1.00 27.27 ? 325 HOH B O 1 HETATM 4415 O O . HOH O 11 . ? 36.562 -19.244 19.521 1.00 33.32 ? 326 HOH B O 1 HETATM 4416 O O . HOH O 11 . ? 35.687 6.433 -3.857 1.00 37.30 ? 327 HOH B O 1 HETATM 4417 O O . HOH O 11 . ? 35.604 3.077 13.867 1.00 40.04 ? 328 HOH B O 1 HETATM 4418 O O . HOH P 11 . ? 41.045 -20.008 -35.823 1.00 27.97 ? 601 HOH C O 1 HETATM 4419 O O . HOH P 11 . ? 19.346 -4.694 -26.807 1.00 29.10 ? 602 HOH C O 1 HETATM 4420 O O . HOH P 11 . ? 55.282 -16.428 -30.221 1.00 28.70 ? 603 HOH C O 1 HETATM 4421 O O . HOH P 11 . ? 28.749 -34.698 -7.946 1.00 37.31 ? 604 HOH C O 1 HETATM 4422 O O . HOH P 11 . ? 24.568 -32.242 -8.122 1.00 29.53 ? 605 HOH C O 1 HETATM 4423 O O . HOH P 11 . ? 40.169 -22.351 -39.461 1.00 29.28 ? 606 HOH C O 1 HETATM 4424 O O . HOH P 11 . ? 38.902 -25.669 -38.646 1.00 23.17 ? 607 HOH C O 1 HETATM 4425 O O . HOH P 11 . ? 22.986 0.000 -22.128 0.50 51.86 ? 608 HOH C O 1 HETATM 4426 O O . HOH P 11 . ? 49.731 -6.670 -32.565 1.00 41.47 ? 609 HOH C O 1 HETATM 4427 O O . HOH P 11 . ? 21.445 -35.081 -14.836 1.00 20.90 ? 610 HOH C O 1 HETATM 4428 O O . HOH P 11 . ? 48.673 -8.239 -37.120 1.00 22.85 ? 611 HOH C O 1 HETATM 4429 O O . HOH P 11 . ? 24.565 -38.140 -16.503 1.00 18.60 ? 612 HOH C O 1 HETATM 4430 O O . HOH P 11 . ? 19.715 3.241 -15.012 1.00 29.15 ? 613 HOH C O 1 HETATM 4431 O O . HOH P 11 . ? 28.941 -1.981 -10.704 1.00 28.66 ? 614 HOH C O 1 HETATM 4432 O O . HOH P 11 . ? 37.428 2.579 -17.604 1.00 22.66 ? 615 HOH C O 1 HETATM 4433 O O . HOH P 11 . ? 17.188 -31.358 -7.151 1.00 34.67 ? 616 HOH C O 1 HETATM 4434 O O . HOH P 11 . ? 43.306 -24.980 -27.744 1.00 35.78 ? 617 HOH C O 1 HETATM 4435 O O . HOH P 11 . ? 16.497 -43.784 -19.351 1.00 32.05 ? 618 HOH C O 1 HETATM 4436 O O . HOH P 11 . ? 40.419 -31.059 -35.270 1.00 27.30 ? 619 HOH C O 1 HETATM 4437 O O . HOH P 11 . ? 47.151 -4.310 -33.466 1.00 35.29 ? 620 HOH C O 1 HETATM 4438 O O . HOH P 11 . ? 29.620 -10.201 -39.168 1.00 30.16 ? 621 HOH C O 1 HETATM 4439 O O . HOH P 11 . ? 27.979 -35.200 -11.639 1.00 23.72 ? 622 HOH C O 1 HETATM 4440 O O . HOH P 11 . ? 17.931 -5.160 -33.962 1.00 29.26 ? 623 HOH C O 1 HETATM 4441 O O . HOH P 11 . ? 22.237 -4.654 -27.226 1.00 33.17 ? 624 HOH C O 1 HETATM 4442 O O . HOH P 11 . ? 42.840 -20.864 -31.456 1.00 28.43 ? 625 HOH C O 1 HETATM 4443 O O . HOH P 11 . ? 22.032 -37.242 -16.554 1.00 19.33 ? 626 HOH C O 1 HETATM 4444 O O . HOH P 11 . ? 48.068 -5.117 -33.585 1.00 30.18 ? 627 HOH C O 1 HETATM 4445 O O . HOH P 11 . ? 32.494 -3.856 -34.761 1.00 34.82 ? 628 HOH C O 1 HETATM 4446 O O . HOH P 11 . ? 22.553 -40.759 -18.281 1.00 32.43 ? 629 HOH C O 1 HETATM 4447 O O . HOH P 11 . ? 14.469 -35.925 -17.245 1.00 11.39 ? 630 HOH C O 1 HETATM 4448 O O . HOH P 11 . ? 49.675 -6.026 -31.748 1.00 34.17 ? 631 HOH C O 1 HETATM 4449 O O . HOH P 11 . ? 34.374 -2.202 -29.514 1.00 36.98 ? 632 HOH C O 1 HETATM 4450 O O . HOH P 11 . ? 19.492 -4.477 -23.887 1.00 26.07 ? 633 HOH C O 1 HETATM 4451 O O . HOH P 11 . ? 29.034 -15.566 -0.306 1.00 16.01 ? 634 HOH C O 1 HETATM 4452 O O . HOH P 11 . ? 34.048 -24.645 -11.503 1.00 16.95 ? 635 HOH C O 1 HETATM 4453 O O . HOH P 11 . ? 36.726 -21.408 -28.720 1.00 14.93 ? 636 HOH C O 1 HETATM 4454 O O . HOH P 11 . ? 35.984 -24.506 -13.908 1.00 20.49 ? 637 HOH C O 1 HETATM 4455 O O . HOH P 11 . ? 37.397 -19.670 -26.592 1.00 12.78 ? 638 HOH C O 1 HETATM 4456 O O . HOH P 11 . ? 31.533 -25.120 -36.578 1.00 16.71 ? 639 HOH C O 1 HETATM 4457 O O . HOH P 11 . ? 16.556 -16.663 -14.208 1.00 19.23 ? 640 HOH C O 1 HETATM 4458 O O . HOH P 11 . ? 33.065 -11.847 -19.290 1.00 19.37 ? 641 HOH C O 1 HETATM 4459 O O . HOH P 11 . ? 47.374 -21.637 -20.622 1.00 16.00 ? 642 HOH C O 1 HETATM 4460 O O . HOH P 11 . ? 35.258 -23.347 -21.046 1.00 15.41 ? 643 HOH C O 1 HETATM 4461 O O . HOH P 11 . ? 16.037 -11.439 -19.895 1.00 17.91 ? 644 HOH C O 1 HETATM 4462 O O . HOH P 11 . ? 38.048 -26.736 -25.655 1.00 16.91 ? 645 HOH C O 1 HETATM 4463 O O . HOH P 11 . ? 36.267 -9.175 -29.533 1.00 16.50 ? 646 HOH C O 1 HETATM 4464 O O . HOH P 11 . ? 31.727 -31.080 -15.703 1.00 22.78 ? 647 HOH C O 1 HETATM 4465 O O . HOH P 11 . ? 21.173 -6.673 -25.362 1.00 20.23 ? 648 HOH C O 1 HETATM 4466 O O . HOH P 11 . ? 35.792 -23.864 -9.539 1.00 13.93 ? 649 HOH C O 1 HETATM 4467 O O . HOH P 11 . ? 15.517 -35.443 -19.819 1.00 21.04 ? 650 HOH C O 1 HETATM 4468 O O . HOH P 11 . ? 49.351 -17.759 -19.183 1.00 21.55 ? 651 HOH C O 1 HETATM 4469 O O . HOH P 11 . ? 19.773 -22.529 -13.911 1.00 21.14 ? 652 HOH C O 1 HETATM 4470 O O . HOH P 11 . ? 39.193 -20.027 -23.485 1.00 16.16 ? 653 HOH C O 1 HETATM 4471 O O . HOH P 11 . ? 16.473 -22.969 -16.385 1.00 21.78 ? 654 HOH C O 1 HETATM 4472 O O . HOH P 11 . ? 32.092 -35.334 -14.491 1.00 25.95 ? 655 HOH C O 1 HETATM 4473 O O . HOH P 11 . ? 27.361 -20.666 -14.978 1.00 17.14 ? 656 HOH C O 1 HETATM 4474 O O . HOH P 11 . ? 27.243 -39.299 -25.034 1.00 21.80 ? 657 HOH C O 1 HETATM 4475 O O . HOH P 11 . ? 50.925 -15.361 -17.784 1.00 23.79 ? 658 HOH C O 1 HETATM 4476 O O . HOH P 11 . ? 37.311 -22.162 -14.492 1.00 19.60 ? 659 HOH C O 1 HETATM 4477 O O . HOH P 11 . ? 38.244 -21.549 -18.974 1.00 29.30 ? 660 HOH C O 1 HETATM 4478 O O . HOH P 11 . ? 32.877 -33.329 -16.466 1.00 14.83 ? 661 HOH C O 1 HETATM 4479 O O . HOH P 11 . ? 36.014 -25.470 -36.551 1.00 19.37 ? 662 HOH C O 1 HETATM 4480 O O . HOH P 11 . ? 35.314 -23.858 -38.613 1.00 36.46 ? 663 HOH C O 1 HETATM 4481 O O . HOH P 11 . ? 14.120 -33.107 -19.770 1.00 24.40 ? 664 HOH C O 1 HETATM 4482 O O . HOH P 11 . ? 31.586 -36.157 -29.441 1.00 15.96 ? 665 HOH C O 1 HETATM 4483 O O . HOH P 11 . ? 16.246 -10.187 -13.367 1.00 21.60 ? 666 HOH C O 1 HETATM 4484 O O . HOH P 11 . ? 26.504 -24.500 -7.373 1.00 25.23 ? 667 HOH C O 1 HETATM 4485 O O . HOH P 11 . ? 48.881 -10.655 -12.576 1.00 23.28 ? 668 HOH C O 1 HETATM 4486 O O . HOH P 11 . ? 23.130 -19.144 -20.120 1.00 16.83 ? 669 HOH C O 1 HETATM 4487 O O . HOH P 11 . ? 29.561 -27.487 -6.993 1.00 24.90 ? 670 HOH C O 1 HETATM 4488 O O . HOH P 11 . ? 45.728 -16.885 -25.280 1.00 18.46 ? 671 HOH C O 1 HETATM 4489 O O . HOH P 11 . ? 46.504 -12.642 -33.628 1.00 25.73 ? 672 HOH C O 1 HETATM 4490 O O . HOH P 11 . ? 35.983 -14.637 -17.475 1.00 16.81 ? 673 HOH C O 1 HETATM 4491 O O . HOH P 11 . ? 17.205 -16.233 -10.083 1.00 25.78 ? 674 HOH C O 1 HETATM 4492 O O . HOH P 11 . ? 29.151 -24.577 -38.015 1.00 21.58 ? 675 HOH C O 1 HETATM 4493 O O . HOH P 11 . ? 51.795 -19.740 -15.687 1.00 40.69 ? 676 HOH C O 1 HETATM 4494 O O . HOH P 11 . ? 19.054 -14.262 -7.897 1.00 28.33 ? 677 HOH C O 1 HETATM 4495 O O . HOH P 11 . ? 22.396 -15.423 -20.287 1.00 14.77 ? 678 HOH C O 1 HETATM 4496 O O . HOH P 11 . ? 37.935 -13.124 -29.125 1.00 24.29 ? 679 HOH C O 1 HETATM 4497 O O . HOH P 11 . ? 33.451 -38.278 -28.382 1.00 27.03 ? 680 HOH C O 1 HETATM 4498 O O . HOH P 11 . ? 11.382 -24.995 -11.921 1.00 28.71 ? 681 HOH C O 1 HETATM 4499 O O . HOH P 11 . ? 18.904 -6.658 -10.509 1.00 22.90 ? 682 HOH C O 1 HETATM 4500 O O . HOH P 11 . ? 39.900 -12.497 -8.742 1.00 24.11 ? 683 HOH C O 1 HETATM 4501 O O . HOH P 11 . ? 14.877 -19.924 -13.977 1.00 29.52 ? 684 HOH C O 1 HETATM 4502 O O . HOH P 11 . ? 17.064 -7.474 -14.076 1.00 31.07 ? 685 HOH C O 1 HETATM 4503 O O . HOH P 11 . ? 38.596 -29.220 -18.573 1.00 20.30 ? 686 HOH C O 1 HETATM 4504 O O . HOH P 11 . ? 24.829 -12.989 -32.851 1.00 17.48 ? 687 HOH C O 1 HETATM 4505 O O . HOH P 11 . ? 6.846 -27.240 -23.116 1.00 36.73 ? 688 HOH C O 1 HETATM 4506 O O . HOH P 11 . ? 27.064 -14.819 -32.610 1.00 19.98 ? 689 HOH C O 1 HETATM 4507 O O . HOH P 11 . ? 28.540 -37.963 -29.297 1.00 31.02 ? 690 HOH C O 1 HETATM 4508 O O . HOH P 11 . ? 19.025 -13.086 -35.520 1.00 26.52 ? 691 HOH C O 1 HETATM 4509 O O . HOH P 11 . ? 27.275 -10.512 -11.096 1.00 29.51 ? 692 HOH C O 1 HETATM 4510 O O . HOH P 11 . ? 12.317 -3.249 -10.399 1.00 46.83 ? 693 HOH C O 1 HETATM 4511 O O . HOH P 11 . ? 34.615 -9.868 -18.422 1.00 33.84 ? 694 HOH C O 1 HETATM 4512 O O . HOH P 11 . ? 11.887 -9.399 -23.790 1.00 23.17 ? 695 HOH C O 1 HETATM 4513 O O . HOH P 11 . ? 8.523 -34.168 -21.865 1.00 33.30 ? 696 HOH C O 1 HETATM 4514 O O . HOH P 11 . ? 30.028 -33.407 -34.889 1.00 27.56 ? 697 HOH C O 1 HETATM 4515 O O . HOH P 11 . ? 16.928 -33.875 -31.618 1.00 34.98 ? 698 HOH C O 1 HETATM 4516 O O . HOH P 11 . ? 35.212 -17.386 1.163 1.00 29.48 ? 699 HOH C O 1 HETATM 4517 O O . HOH P 11 . ? 31.713 -34.665 -32.375 1.00 41.63 ? 700 HOH C O 1 HETATM 4518 O O . HOH P 11 . ? 30.221 -28.864 -14.407 1.00 23.48 ? 701 HOH C O 1 HETATM 4519 O O . HOH P 11 . ? 17.561 -1.327 -17.832 1.00 36.60 ? 702 HOH C O 1 HETATM 4520 O O . HOH P 11 . ? 34.364 -23.854 -16.053 1.00 37.08 ? 703 HOH C O 1 HETATM 4521 O O . HOH P 11 . ? 27.862 -21.574 -38.719 1.00 28.17 ? 704 HOH C O 1 HETATM 4522 O O . HOH P 11 . ? 26.505 -21.859 -8.005 1.00 19.42 ? 705 HOH C O 1 HETATM 4523 O O . HOH P 11 . ? 10.141 -35.832 -25.117 1.00 28.27 ? 706 HOH C O 1 HETATM 4524 O O . HOH P 11 . ? 17.663 -13.636 -5.525 1.00 41.60 ? 707 HOH C O 1 HETATM 4525 O O . HOH P 11 . ? 26.772 -2.845 -11.987 1.00 21.48 ? 708 HOH C O 1 HETATM 4526 O O . HOH P 11 . ? 26.797 -14.407 -4.794 1.00 21.55 ? 709 HOH C O 1 HETATM 4527 O O . HOH P 11 . ? 12.172 -6.529 -8.044 1.00 37.65 ? 710 HOH C O 1 HETATM 4528 O O . HOH P 11 . ? 40.823 -33.180 -19.048 1.00 33.04 ? 711 HOH C O 1 HETATM 4529 O O . HOH P 11 . ? 31.032 -35.418 -3.392 1.00 43.17 ? 712 HOH C O 1 HETATM 4530 O O . HOH P 11 . ? 35.755 -6.568 -17.804 1.00 40.69 ? 713 HOH C O 1 HETATM 4531 O O . HOH P 11 . ? 34.167 -38.240 -13.482 1.00 39.17 ? 714 HOH C O 1 HETATM 4532 O O . HOH P 11 . ? 31.477 -22.903 -3.257 1.00 38.24 ? 715 HOH C O 1 HETATM 4533 O O . HOH P 11 . ? 16.676 -20.289 -32.264 1.00 37.55 ? 716 HOH C O 1 HETATM 4534 O O . HOH P 11 . ? 48.477 -8.303 -20.156 1.00 36.48 ? 717 HOH C O 1 HETATM 4535 O O . HOH P 11 . ? 44.151 -18.984 -28.707 1.00 37.73 ? 718 HOH C O 1 HETATM 4536 O O . HOH P 11 . ? 11.812 -14.594 -17.153 1.00 38.25 ? 719 HOH C O 1 HETATM 4537 O O . HOH P 11 . ? 17.196 -5.063 -22.866 1.00 38.68 ? 720 HOH C O 1 HETATM 4538 O O . HOH P 11 . ? 38.284 -40.389 -17.988 1.00 37.93 ? 721 HOH C O 1 HETATM 4539 O O . HOH P 11 . ? 32.735 -9.473 -33.269 1.00 33.12 ? 722 HOH C O 1 HETATM 4540 O O . HOH P 11 . ? 35.150 -9.816 -32.194 1.00 31.62 ? 723 HOH C O 1 HETATM 4541 O O . HOH P 11 . ? 34.462 -8.174 -32.941 1.00 42.66 ? 724 HOH C O 1 HETATM 4542 O O . HOH P 11 . ? 33.087 -35.941 -4.381 1.00 46.36 ? 725 HOH C O 1 HETATM 4543 O O . HOH P 11 . ? 10.958 -30.233 -17.038 1.00 34.89 ? 726 HOH C O 1 HETATM 4544 O O . HOH P 11 . ? 19.688 -24.833 -9.718 1.00 31.15 ? 727 HOH C O 1 HETATM 4545 O O . HOH P 11 . ? 18.989 -24.727 -12.012 1.00 26.74 ? 728 HOH C O 1 HETATM 4546 O O . HOH P 11 . ? 29.020 -13.662 -33.931 1.00 27.29 ? 729 HOH C O 1 HETATM 4547 O O . HOH P 11 . ? 18.508 -17.819 -8.153 1.00 27.63 ? 730 HOH C O 1 HETATM 4548 O O . HOH P 11 . ? 14.284 -38.434 -29.451 1.00 34.99 ? 731 HOH C O 1 HETATM 4549 O O . HOH P 11 . ? 40.866 -22.091 -19.920 1.00 34.56 ? 732 HOH C O 1 HETATM 4550 O O . HOH P 11 . ? 37.109 -5.913 -33.007 1.00 26.74 ? 733 HOH C O 1 HETATM 4551 O O . HOH P 11 . ? 53.411 -5.893 -31.654 1.00 37.99 ? 734 HOH C O 1 # loop_ _pdbx_poly_seq_scheme.asym_id _pdbx_poly_seq_scheme.entity_id _pdbx_poly_seq_scheme.seq_id _pdbx_poly_seq_scheme.mon_id _pdbx_poly_seq_scheme.ndb_seq_num _pdbx_poly_seq_scheme.pdb_seq_num _pdbx_poly_seq_scheme.auth_seq_num _pdbx_poly_seq_scheme.pdb_mon_id _pdbx_poly_seq_scheme.auth_mon_id _pdbx_poly_seq_scheme.pdb_strand_id _pdbx_poly_seq_scheme.pdb_ins_code _pdbx_poly_seq_scheme.hetero A 1 1 VAL 1 2 2 VAL VAL A . n A 1 2 LEU 2 3 3 LEU LEU A . n A 1 3 SER 3 4 4 SER SER A . n A 1 4 PRO 4 5 5 PRO PRO A . n A 1 5 ALA 5 6 6 ALA ALA A . n A 1 6 ASP 6 7 7 ASP ASP A . n A 1 7 LYS 7 8 8 LYS LYS A . n A 1 8 THR 8 9 9 THR THR A . n A 1 9 ASN 9 10 10 ASN ASN A . n A 1 10 VAL 10 11 11 VAL VAL A . n A 1 11 LYS 11 12 12 LYS LYS A . n A 1 12 ALA 12 13 13 ALA ALA A . n A 1 13 ALA 13 14 14 ALA ALA A . n A 1 14 TRP 14 15 15 TRP TRP A . n A 1 15 GLY 15 16 16 GLY GLY A . n A 1 16 LYS 16 17 17 LYS LYS A . n A 1 17 VAL 17 18 18 VAL VAL A . n A 1 18 GLY 18 19 19 GLY GLY A . n A 1 19 ALA 19 20 20 ALA ALA A . n A 1 20 HIS 20 21 21 HIS HIS A . n A 1 21 ALA 21 22 22 ALA ALA A . n A 1 22 GLY 22 23 23 GLY GLY A . n A 1 23 GLU 23 24 24 GLU GLU A . n A 1 24 TYR 24 25 25 TYR TYR A . n A 1 25 GLY 25 26 26 GLY GLY A . n A 1 26 ALA 26 27 27 ALA ALA A . n A 1 27 GLU 27 28 28 GLU GLU A . n A 1 28 ALA 28 29 29 ALA ALA A . n A 1 29 LEU 29 30 30 LEU LEU A . n A 1 30 GLU 30 31 31 GLU GLU A . n A 1 31 ARG 31 32 32 ARG ARG A . n A 1 32 MET 32 33 33 MET MET A . n A 1 33 PHE 33 34 34 PHE PHE A . n A 1 34 LEU 34 35 35 LEU LEU A . n A 1 35 SER 35 36 36 SER SER A . n A 1 36 PHE 36 37 37 PHE PHE A . n A 1 37 PRO 37 38 38 PRO PRO A . n A 1 38 THR 38 39 39 THR THR A . n A 1 39 THR 39 40 40 THR THR A . n A 1 40 LYS 40 41 41 LYS LYS A . n A 1 41 THR 41 42 42 THR THR A . n A 1 42 TYR 42 43 43 TYR TYR A . n A 1 43 PHE 43 44 44 PHE PHE A . n A 1 44 PRO 44 45 45 PRO PRO A . n A 1 45 HIS 45 46 46 HIS HIS A . n A 1 46 PHE 46 47 47 PHE PHE A . n A 1 47 ASP 47 48 48 ASP ASP A . n A 1 48 LEU 48 49 49 LEU LEU A . n A 1 49 SER 49 50 50 SER SER A . n A 1 50 HIS 50 51 51 HIS HIS A . n A 1 51 GLY 51 52 52 GLY GLY A . n A 1 52 SER 52 53 53 SER SER A . n A 1 53 ALA 53 54 54 ALA ALA A . n A 1 54 GLN 54 55 55 GLN GLN A . n A 1 55 VAL 55 56 56 VAL VAL A . n A 1 56 LYS 56 57 57 LYS LYS A . n A 1 57 GLY 57 58 58 GLY GLY A . n A 1 58 HIS 58 59 59 HIS HIS A . n A 1 59 GLY 59 60 60 GLY GLY A . n A 1 60 LYS 60 61 61 LYS LYS A . n A 1 61 LYS 61 62 62 LYS LYS A . n A 1 62 VAL 62 63 63 VAL VAL A . n A 1 63 ALA 63 64 64 ALA ALA A . n A 1 64 ASP 64 65 65 ASP ASP A . n A 1 65 ALA 65 66 66 ALA ALA A . n A 1 66 LEU 66 67 67 LEU LEU A . n A 1 67 THR 67 68 68 THR THR A . n A 1 68 ASN 68 69 69 ASN ASN A . n A 1 69 ALA 69 70 70 ALA ALA A . n A 1 70 VAL 70 71 71 VAL VAL A . n A 1 71 ALA 71 72 72 ALA ALA A . n A 1 72 HIS 72 73 73 HIS HIS A . n A 1 73 VAL 73 74 74 VAL VAL A . n A 1 74 ASP 74 75 75 ASP ASP A . n A 1 75 ASP 75 76 76 ASP ASP A . n A 1 76 MET 76 77 77 MET MET A . n A 1 77 PRO 77 78 78 PRO PRO A . n A 1 78 ASN 78 79 79 ASN ASN A . n A 1 79 ALA 79 80 80 ALA ALA A . n A 1 80 LEU 80 81 81 LEU LEU A . n A 1 81 SER 81 82 82 SER SER A . n A 1 82 ALA 82 83 83 ALA ALA A . n A 1 83 LEU 83 84 84 LEU LEU A . n A 1 84 SER 84 85 85 SER SER A . n A 1 85 ASP 85 86 86 ASP ASP A . n A 1 86 LEU 86 87 87 LEU LEU A . n A 1 87 HIS 87 88 88 HIS HIS A . n A 1 88 ALA 88 89 89 ALA ALA A . n A 1 89 HIS 89 90 90 HIS HIS A . n A 1 90 LYS 90 91 91 LYS LYS A . n A 1 91 LEU 91 92 92 LEU LEU A . n A 1 92 ARG 92 93 93 ARG ARG A . n A 1 93 VAL 93 94 94 VAL VAL A . n A 1 94 ASP 94 95 95 ASP ASP A . n A 1 95 PRO 95 96 96 PRO PRO A . n A 1 96 VAL 96 97 97 VAL VAL A . n A 1 97 ASN 97 98 98 ASN ASN A . n A 1 98 PHE 98 99 99 PHE PHE A . n A 1 99 LYS 99 100 100 LYS LYS A . n A 1 100 LEU 100 101 101 LEU LEU A . n A 1 101 LEU 101 102 102 LEU LEU A . n A 1 102 SER 102 103 103 SER SER A . n A 1 103 HIS 103 104 104 HIS HIS A . n A 1 104 CYS 104 105 105 CYS CYS A . n A 1 105 LEU 105 106 106 LEU LEU A . n A 1 106 LEU 106 107 107 LEU LEU A . n A 1 107 VAL 107 108 108 VAL VAL A . n A 1 108 THR 108 109 109 THR THR A . n A 1 109 LEU 109 110 110 LEU LEU A . n A 1 110 ALA 110 111 111 ALA ALA A . n A 1 111 ALA 111 112 112 ALA ALA A . n A 1 112 HIS 112 113 113 HIS HIS A . n A 1 113 LEU 113 114 114 LEU LEU A . n A 1 114 PRO 114 115 115 PRO PRO A . n A 1 115 ALA 115 116 116 ALA ALA A . n A 1 116 GLU 116 117 117 GLU GLU A . n A 1 117 PHE 117 118 118 PHE PHE A . n A 1 118 THR 118 119 119 THR THR A . n A 1 119 PRO 119 120 120 PRO PRO A . n A 1 120 ALA 120 121 121 ALA ALA A . n A 1 121 VAL 121 122 122 VAL VAL A . n A 1 122 HIS 122 123 123 HIS HIS A . n A 1 123 ALA 123 124 124 ALA ALA A . n A 1 124 SER 124 125 125 SER SER A . n A 1 125 LEU 125 126 126 LEU LEU A . n A 1 126 ASP 126 127 127 ASP ASP A . n A 1 127 LYS 127 128 128 LYS LYS A . n A 1 128 PHE 128 129 129 PHE PHE A . n A 1 129 LEU 129 130 130 LEU LEU A . n A 1 130 ALA 130 131 131 ALA ALA A . n A 1 131 SER 131 132 132 SER SER A . n A 1 132 VAL 132 133 133 VAL VAL A . n A 1 133 SER 133 134 134 SER SER A . n A 1 134 THR 134 135 135 THR THR A . n A 1 135 VAL 135 136 136 VAL VAL A . n A 1 136 LEU 136 137 137 LEU LEU A . n A 1 137 THR 137 138 138 THR THR A . n A 1 138 SER 138 139 139 SER SER A . n A 1 139 LYS 139 140 140 LYS LYS A . n A 1 140 TYR 140 141 141 TYR TYR A . n A 1 141 ARG 141 142 142 ARG ARG A . n B 2 1 VAL 1 2 ? ? ? B . n B 2 2 HIS 2 3 3 HIS HIS B . n B 2 3 LEU 3 4 4 LEU LEU B . n B 2 4 THR 4 5 5 THR THR B . n B 2 5 PRO 5 6 6 PRO PRO B . n B 2 6 GLU 6 7 7 GLU GLU B . n B 2 7 GLU 7 8 8 GLU GLU B . n B 2 8 LYS 8 9 9 LYS LYS B . n B 2 9 SER 9 10 10 SER SER B . n B 2 10 ALA 10 11 11 ALA ALA B . n B 2 11 VAL 11 12 12 VAL VAL B . n B 2 12 THR 12 13 13 THR THR B . n B 2 13 ALA 13 14 14 ALA ALA B . n B 2 14 LEU 14 15 15 LEU LEU B . n B 2 15 TRP 15 16 16 TRP TRP B . n B 2 16 GLY 16 17 17 GLY GLY B . n B 2 17 LYS 17 18 18 LYS LYS B . n B 2 18 VAL 18 19 19 VAL VAL B . n B 2 19 ASN 19 20 20 ASN ASN B . n B 2 20 VAL 20 21 21 VAL VAL B . n B 2 21 ASP 21 22 22 ASP ASP B . n B 2 22 GLU 22 23 23 GLU GLU B . n B 2 23 VAL 23 24 24 VAL VAL B . n B 2 24 GLY 24 25 25 GLY GLY B . n B 2 25 GLY 25 26 26 GLY GLY B . n B 2 26 GLU 26 27 27 GLU GLU B . n B 2 27 ALA 27 28 28 ALA ALA B . n B 2 28 LEU 28 29 29 LEU LEU B . n B 2 29 GLY 29 30 30 GLY GLY B . n B 2 30 ARG 30 31 31 ARG ARG B . n B 2 31 LEU 31 32 32 LEU LEU B . n B 2 32 LEU 32 33 33 LEU LEU B . n B 2 33 VAL 33 34 34 VAL VAL B . n B 2 34 VAL 34 35 35 VAL VAL B . n B 2 35 TYR 35 36 36 TYR TYR B . n B 2 36 PRO 36 37 37 PRO PRO B . n B 2 37 TRP 37 38 38 TRP TRP B . n B 2 38 THR 38 39 39 THR THR B . n B 2 39 GLN 39 40 40 GLN GLN B . n B 2 40 ARG 40 41 41 ARG ARG B . n B 2 41 PHE 41 42 42 PHE PHE B . n B 2 42 PHE 42 43 43 PHE PHE B . n B 2 43 GLU 43 44 44 GLU GLU B . n B 2 44 SER 44 45 45 SER SER B . n B 2 45 PHE 45 46 46 PHE PHE B . n B 2 46 GLY 46 47 47 GLY GLY B . n B 2 47 ASP 47 48 48 ASP ASP B . n B 2 48 LEU 48 49 49 LEU LEU B . n B 2 49 SER 49 50 50 SER SER B . n B 2 50 THR 50 51 51 THR THR B . n B 2 51 PRO 51 52 52 PRO PRO B . n B 2 52 ASP 52 53 53 ASP ASP B . n B 2 53 ALA 53 54 54 ALA ALA B . n B 2 54 VAL 54 55 55 VAL VAL B . n B 2 55 MET 55 56 56 MET MET B . n B 2 56 GLY 56 57 57 GLY GLY B . n B 2 57 ASN 57 58 58 ASN ASN B . n B 2 58 PRO 58 59 59 PRO PRO B . n B 2 59 LYS 59 60 60 LYS LYS B . n B 2 60 VAL 60 61 61 VAL VAL B . n B 2 61 LYS 61 62 62 LYS LYS B . n B 2 62 ALA 62 63 63 ALA ALA B . n B 2 63 HIS 63 64 64 HIS HIS B . n B 2 64 GLY 64 65 65 GLY GLY B . n B 2 65 LYS 65 66 66 LYS LYS B . n B 2 66 LYS 66 67 67 LYS LYS B . n B 2 67 VAL 67 68 68 VAL VAL B . n B 2 68 LEU 68 69 69 LEU LEU B . n B 2 69 GLY 69 70 70 GLY GLY B . n B 2 70 ALA 70 71 71 ALA ALA B . n B 2 71 PHE 71 72 72 PHE PHE B . n B 2 72 SER 72 73 73 SER SER B . n B 2 73 ASP 73 74 74 ASP ASP B . n B 2 74 GLY 74 75 75 GLY GLY B . n B 2 75 LEU 75 76 76 LEU LEU B . n B 2 76 ALA 76 77 77 ALA ALA B . n B 2 77 HIS 77 78 78 HIS HIS B . n B 2 78 LEU 78 79 79 LEU LEU B . n B 2 79 ASP 79 80 80 ASP ASP B . n B 2 80 ASN 80 81 81 ASN ASN B . n B 2 81 LEU 81 82 82 LEU LEU B . n B 2 82 LYS 82 83 83 LYS LYS B . n B 2 83 GLY 83 84 84 GLY GLY B . n B 2 84 THR 84 85 85 THR THR B . n B 2 85 PHE 85 86 86 PHE PHE B . n B 2 86 ALA 86 87 87 ALA ALA B . n B 2 87 THR 87 88 88 THR THR B . n B 2 88 LEU 88 89 89 LEU LEU B . n B 2 89 SER 89 90 90 SER SER B . n B 2 90 GLU 90 91 91 GLU GLU B . n B 2 91 LEU 91 92 92 LEU LEU B . n B 2 92 HIS 92 93 93 HIS HIS B . n B 2 93 CYS 93 94 94 CYS CYS B . n B 2 94 ASP 94 95 95 ASP ASP B . n B 2 95 LYS 95 96 96 LYS LYS B . n B 2 96 LEU 96 97 97 LEU LEU B . n B 2 97 HIS 97 98 98 HIS HIS B . n B 2 98 VAL 98 99 99 VAL VAL B . n B 2 99 ASP 99 100 100 ASP ASP B . n B 2 100 PRO 100 101 101 PRO PRO B . n B 2 101 GLU 101 102 102 GLU GLU B . n B 2 102 ASN 102 103 103 ASN ASN B . n B 2 103 PHE 103 104 104 PHE PHE B . n B 2 104 ARG 104 105 105 ARG ARG B . n B 2 105 LEU 105 106 106 LEU LEU B . n B 2 106 LEU 106 107 107 LEU LEU B . n B 2 107 GLY 107 108 108 GLY GLY B . n B 2 108 ASN 108 109 109 ASN ASN B . n B 2 109 VAL 109 110 110 VAL VAL B . n B 2 110 LEU 110 111 111 LEU LEU B . n B 2 111 VAL 111 112 112 VAL VAL B . n B 2 112 CYS 112 113 113 CYS CYS B . n B 2 113 VAL 113 114 114 VAL VAL B . n B 2 114 LEU 114 115 115 LEU LEU B . n B 2 115 ALA 115 116 116 ALA ALA B . n B 2 116 HIS 116 117 117 HIS HIS B . n B 2 117 HIS 117 118 118 HIS HIS B . n B 2 118 PHE 118 119 119 PHE PHE B . n B 2 119 GLY 119 120 120 GLY GLY B . n B 2 120 LYS 120 121 121 LYS LYS B . n B 2 121 GLU 121 122 122 GLU GLU B . n B 2 122 PHE 122 123 123 PHE PHE B . n B 2 123 THR 123 124 124 THR THR B . n B 2 124 PRO 124 125 125 PRO PRO B . n B 2 125 PRO 125 126 126 PRO PRO B . n B 2 126 VAL 126 127 127 VAL VAL B . n B 2 127 GLN 127 128 128 GLN GLN B . n B 2 128 ALA 128 129 129 ALA ALA B . n B 2 129 ALA 129 130 130 ALA ALA B . n B 2 130 TYR 130 131 131 TYR TYR B . n B 2 131 GLN 131 132 132 GLN GLN B . n B 2 132 LYS 132 133 133 LYS LYS B . n B 2 133 VAL 133 134 134 VAL VAL B . n B 2 134 VAL 134 135 135 VAL VAL B . n B 2 135 ALA 135 136 136 ALA ALA B . n B 2 136 GLY 136 137 137 GLY GLY B . n B 2 137 VAL 137 138 138 VAL VAL B . n B 2 138 ALA 138 139 139 ALA ALA B . n B 2 139 ASN 139 140 140 ASN ASN B . n B 2 140 ALA 140 141 141 ALA ALA B . n B 2 141 LEU 141 142 142 LEU LEU B . n B 2 142 ALA 142 143 143 ALA ALA B . n B 2 143 HIS 143 144 144 HIS HIS B . n B 2 144 LYS 144 145 145 LYS LYS B . n B 2 145 TYR 145 146 146 TYR TYR B . n B 2 146 HIS 146 147 ? ? ? B . n C 3 1 VAL 1 148 148 VAL VAL C . n C 3 2 CYS 2 149 149 CYS CYS C . n C 3 3 GLY 3 150 150 GLY GLY C . n C 3 4 LYS 4 151 151 LYS LYS C . n C 3 5 PRO 5 152 152 PRO PRO C . n C 3 6 LYS 6 153 153 LYS LYS C . n C 3 7 ASN 7 154 154 ASN ASN C . n C 3 8 PRO 8 155 155 PRO PRO C . n C 3 9 ALA 9 156 156 ALA ALA C . n C 3 10 ASN 10 157 157 ASN ASN C . n C 3 11 PRO 11 158 158 PRO PRO C . n C 3 12 VAL 12 159 159 VAL VAL C . n C 3 13 GLN 13 160 160 GLN GLN C . n C 3 14 ARG 14 161 161 ARG ARG C . n C 3 15 ILE 15 162 162 ILE ILE C . n C 3 16 LEU 16 163 163 LEU LEU C . n C 3 17 GLY 17 164 164 GLY GLY C . n C 3 18 GLY 18 165 165 GLY GLY C . n C 3 19 HIS 19 166 166 HIS HIS C . n C 3 20 LEU 20 167 167 LEU LEU C . n C 3 21 ASP 21 168 168 ASP ASP C . n C 3 22 ALA 22 169 169 ALA ALA C . n C 3 23 LYS 23 170 170 LYS LYS C . n C 3 24 GLY 24 171 171 GLY GLY C . n C 3 25 SER 25 172 172 SER SER C . n C 3 26 PHE 26 173 173 PHE PHE C . n C 3 27 PRO 27 174 174 PRO PRO C . n C 3 28 TRP 28 175 175 TRP TRP C . n C 3 29 GLN 29 176 176 GLN GLN C . n C 3 30 ALA 30 177 177 ALA ALA C . n C 3 31 LYS 31 178 178 LYS LYS C . n C 3 32 MET 32 179 179 MET MET C . n C 3 33 VAL 33 180 180 VAL VAL C . n C 3 34 SER 34 181 181 SER SER C . n C 3 35 HIS 35 182 182 HIS HIS C . n C 3 36 HIS 36 183 183 HIS HIS C . n C 3 37 ASN 37 184 184 ASN ASN C . n C 3 38 LEU 38 185 185 LEU LEU C . n C 3 39 THR 39 186 186 THR THR C . n C 3 40 THR 40 187 187 THR THR C . n C 3 41 GLY 41 188 188 GLY GLY C . n C 3 42 ALA 42 189 189 ALA ALA C . n C 3 43 THR 43 190 190 THR THR C . n C 3 44 LEU 44 191 191 LEU LEU C . n C 3 45 ILE 45 192 192 ILE ILE C . n C 3 46 ASN 46 193 193 ASN ASN C . n C 3 47 GLU 47 194 194 GLU GLU C . n C 3 48 GLN 48 195 195 GLN GLN C . n C 3 49 TRP 49 196 196 TRP TRP C . n C 3 50 LEU 50 197 197 LEU LEU C . n C 3 51 LEU 51 198 198 LEU LEU C . n C 3 52 THR 52 199 199 THR THR C . n C 3 53 THR 53 200 200 THR THR C . n C 3 54 ALA 54 201 201 ALA ALA C . n C 3 55 LYS 55 202 202 LYS LYS C . n C 3 56 ASN 56 203 203 ASN ASN C . n C 3 57 LEU 57 204 204 LEU LEU C . n C 3 58 PHE 58 205 205 PHE PHE C . n C 3 59 LEU 59 206 206 LEU LEU C . n C 3 60 ASN 60 207 207 ASN ASN C . n C 3 61 HIS 61 208 208 HIS HIS C . n C 3 62 SER 62 209 209 SER SER C . n C 3 63 GLU 63 210 210 GLU GLU C . n C 3 64 ASN 64 211 211 ASN ASN C . n C 3 65 ALA 65 212 212 ALA ALA C . n C 3 66 THR 66 213 213 THR THR C . n C 3 67 ALA 67 214 214 ALA ALA C . n C 3 68 LYS 68 215 215 LYS LYS C . n C 3 69 ASP 69 216 216 ASP ASP C . n C 3 70 ILE 70 217 217 ILE ILE C . n C 3 71 ALA 71 218 218 ALA ALA C . n C 3 72 PRO 72 219 219 PRO PRO C . n C 3 73 THR 73 220 220 THR THR C . n C 3 74 LEU 74 221 221 LEU LEU C . n C 3 75 THR 75 222 222 THR THR C . n C 3 76 LEU 76 223 223 LEU LEU C . n C 3 77 TYR 77 224 224 TYR TYR C . n C 3 78 VAL 78 225 225 VAL VAL C . n C 3 79 GLY 79 226 226 GLY GLY C . n C 3 80 LYS 80 227 227 LYS LYS C . n C 3 81 LYS 81 228 228 LYS LYS C . n C 3 82 GLN 82 229 229 GLN GLN C . n C 3 83 LEU 83 230 230 LEU LEU C . n C 3 84 VAL 84 231 231 VAL VAL C . n C 3 85 GLU 85 232 232 GLU GLU C . n C 3 86 ILE 86 233 233 ILE ILE C . n C 3 87 GLU 87 234 234 GLU GLU C . n C 3 88 LYS 88 235 235 LYS LYS C . n C 3 89 VAL 89 236 236 VAL VAL C . n C 3 90 VAL 90 237 237 VAL VAL C . n C 3 91 LEU 91 238 238 LEU LEU C . n C 3 92 HIS 92 239 239 HIS HIS C . n C 3 93 PRO 93 240 240 PRO PRO C . n C 3 94 ASN 94 241 241 ASN ASN C . n C 3 95 TYR 95 242 242 TYR TYR C . n C 3 96 SER 96 243 243 SER SER C . n C 3 97 GLN 97 244 244 GLN GLN C . n C 3 98 VAL 98 245 245 VAL VAL C . n C 3 99 ASP 99 246 246 ASP ASP C . n C 3 100 ILE 100 247 247 ILE ILE C . n C 3 101 GLY 101 248 248 GLY GLY C . n C 3 102 LEU 102 249 249 LEU LEU C . n C 3 103 ILE 103 250 250 ILE ILE C . n C 3 104 LYS 104 251 251 LYS LYS C . n C 3 105 LEU 105 252 252 LEU LEU C . n C 3 106 LYS 106 253 253 LYS LYS C . n C 3 107 GLN 107 254 254 GLN GLN C . n C 3 108 LYS 108 255 255 LYS LYS C . n C 3 109 VAL 109 256 256 VAL VAL C . n C 3 110 SER 110 257 257 SER SER C . n C 3 111 VAL 111 258 258 VAL VAL C . n C 3 112 ASN 112 259 259 ASN ASN C . n C 3 113 GLU 113 260 260 GLU GLU C . n C 3 114 ARG 114 261 261 ARG ARG C . n C 3 115 VAL 115 262 262 VAL VAL C . n C 3 116 MET 116 263 263 MET MET C . n C 3 117 PRO 117 264 264 PRO PRO C . n C 3 118 ILE 118 265 265 ILE ILE C . n C 3 119 CYS 119 266 266 CYS CYS C . n C 3 120 LEU 120 267 267 LEU LEU C . n C 3 121 PRO 121 268 268 PRO PRO C . n C 3 122 SER 122 269 269 SER SER C . n C 3 123 LYS 123 270 270 LYS LYS C . n C 3 124 ASP 124 271 271 ASP ASP C . n C 3 125 TYR 125 272 272 TYR TYR C . n C 3 126 ALA 126 273 273 ALA ALA C . n C 3 127 GLU 127 274 274 GLU GLU C . n C 3 128 VAL 128 275 275 VAL VAL C . n C 3 129 GLY 129 276 276 GLY GLY C . n C 3 130 ARG 130 277 277 ARG ARG C . n C 3 131 VAL 131 278 278 VAL VAL C . n C 3 132 GLY 132 279 279 GLY GLY C . n C 3 133 TYR 133 280 280 TYR TYR C . n C 3 134 VAL 134 281 281 VAL VAL C . n C 3 135 SER 135 282 282 SER SER C . n C 3 136 GLY 136 283 283 GLY GLY C . n C 3 137 TRP 137 284 284 TRP TRP C . n C 3 138 GLY 138 285 285 GLY GLY C . n C 3 139 ARG 139 286 286 ARG ARG C . n C 3 140 ASN 140 287 287 ASN ASN C . n C 3 141 ALA 141 288 288 ALA ALA C . n C 3 142 ASN 142 289 289 ASN ASN C . n C 3 143 PHE 143 290 290 PHE PHE C . n C 3 144 LYS 144 291 291 LYS LYS C . n C 3 145 PHE 145 292 292 PHE PHE C . n C 3 146 THR 146 293 293 THR THR C . n C 3 147 ASP 147 294 294 ASP ASP C . n C 3 148 HIS 148 295 295 HIS HIS C . n C 3 149 LEU 149 296 296 LEU LEU C . n C 3 150 LYS 150 297 297 LYS LYS C . n C 3 151 TYR 151 298 298 TYR TYR C . n C 3 152 VAL 152 299 299 VAL VAL C . n C 3 153 MET 153 300 300 MET MET C . n C 3 154 LEU 154 301 301 LEU LEU C . n C 3 155 PRO 155 302 302 PRO PRO C . n C 3 156 VAL 156 303 303 VAL VAL C . n C 3 157 ALA 157 304 304 ALA ALA C . n C 3 158 ASP 158 305 305 ASP ASP C . n C 3 159 GLN 159 306 306 GLN GLN C . n C 3 160 ASP 160 307 307 ASP ASP C . n C 3 161 GLN 161 308 308 GLN GLN C . n C 3 162 CYS 162 309 309 CYS CYS C . n C 3 163 ILE 163 310 310 ILE ILE C . n C 3 164 ARG 164 311 311 ARG ARG C . n C 3 165 HIS 165 312 312 HIS HIS C . n C 3 166 TYR 166 313 313 TYR TYR C . n C 3 167 GLU 167 314 314 GLU GLU C . n C 3 168 GLY 168 315 315 GLY GLY C . n C 3 169 SER 169 316 316 SER SER C . n C 3 170 THR 170 317 317 THR THR C . n C 3 171 VAL 171 318 318 VAL VAL C . n C 3 172 PRO 172 319 319 PRO PRO C . n C 3 173 GLU 173 320 320 GLU GLU C . n C 3 174 LYS 174 321 321 LYS LYS C . n C 3 175 LYS 175 322 322 LYS LYS C . n C 3 176 THR 176 323 323 THR THR C . n C 3 177 PRO 177 324 324 PRO PRO C . n C 3 178 LYS 178 325 325 LYS LYS C . n C 3 179 SER 179 326 326 SER SER C . n C 3 180 PRO 180 327 327 PRO PRO C . n C 3 181 VAL 181 328 328 VAL VAL C . n C 3 182 GLY 182 329 329 GLY GLY C . n C 3 183 VAL 183 330 330 VAL VAL C . n C 3 184 GLN 184 331 331 GLN GLN C . n C 3 185 PRO 185 332 332 PRO PRO C . n C 3 186 ILE 186 333 333 ILE ILE C . n C 3 187 LEU 187 334 334 LEU LEU C . n C 3 188 ASN 188 335 335 ASN ASN C . n C 3 189 GLU 189 336 336 GLU GLU C . n C 3 190 HIS 190 337 337 HIS HIS C . n C 3 191 THR 191 338 338 THR THR C . n C 3 192 PHE 192 339 339 PHE PHE C . n C 3 193 CYS 193 340 340 CYS CYS C . n C 3 194 ALA 194 341 341 ALA ALA C . n C 3 195 GLY 195 342 342 GLY GLY C . n C 3 196 MET 196 343 343 MET MET C . n C 3 197 SER 197 344 344 SER SER C . n C 3 198 LYS 198 345 345 LYS LYS C . n C 3 199 TYR 199 346 346 TYR TYR C . n C 3 200 GLN 200 347 347 GLN GLN C . n C 3 201 GLU 201 348 348 GLU GLU C . n C 3 202 ASP 202 349 349 ASP ASP C . n C 3 203 THR 203 350 350 THR THR C . n C 3 204 CYS 204 351 351 CYS CYS C . n C 3 205 TYR 205 352 352 TYR TYR C . n C 3 206 GLY 206 353 353 GLY GLY C . n C 3 207 ASP 207 354 354 ASP ASP C . n C 3 208 ALA 208 355 355 ALA ALA C . n C 3 209 GLY 209 356 356 GLY GLY C . n C 3 210 SER 210 357 357 SER SER C . n C 3 211 ALA 211 358 358 ALA ALA C . n C 3 212 PHE 212 359 359 PHE PHE C . n C 3 213 ALA 213 360 360 ALA ALA C . n C 3 214 VAL 214 361 361 VAL VAL C . n C 3 215 HIS 215 362 362 HIS HIS C . n C 3 216 ASP 216 363 363 ASP ASP C . n C 3 217 LEU 217 364 364 LEU LEU C . n C 3 218 GLU 218 365 365 GLU GLU C . n C 3 219 GLU 219 366 366 GLU GLU C . n C 3 220 ASP 220 367 367 ASP ASP C . n C 3 221 THR 221 368 368 THR THR C . n C 3 222 TRP 222 369 369 TRP TRP C . n C 3 223 TYR 223 370 370 TYR TYR C . n C 3 224 ALA 224 371 371 ALA ALA C . n C 3 225 THR 225 372 372 THR THR C . n C 3 226 GLY 226 373 373 GLY GLY C . n C 3 227 ILE 227 374 374 ILE ILE C . n C 3 228 LEU 228 375 375 LEU LEU C . n C 3 229 SER 229 376 376 SER SER C . n C 3 230 PHE 230 377 377 PHE PHE C . n C 3 231 ASP 231 378 378 ASP ASP C . n C 3 232 LYS 232 379 379 LYS LYS C . n C 3 233 SER 233 380 380 SER SER C . n C 3 234 CYS 234 381 381 CYS CYS C . n C 3 235 ALA 235 382 382 ALA ALA C . n C 3 236 VAL 236 383 383 VAL VAL C . n C 3 237 ALA 237 384 384 ALA ALA C . n C 3 238 GLU 238 385 385 GLU GLU C . n C 3 239 TYR 239 386 386 TYR TYR C . n C 3 240 GLY 240 387 387 GLY GLY C . n C 3 241 VAL 241 388 388 VAL VAL C . n C 3 242 TYR 242 389 389 TYR TYR C . n C 3 243 VAL 243 390 390 VAL VAL C . n C 3 244 LYS 244 391 391 LYS LYS C . n C 3 245 VAL 245 392 392 VAL VAL C . n C 3 246 THR 246 393 393 THR THR C . n C 3 247 SER 247 394 394 SER SER C . n C 3 248 ILE 248 395 395 ILE ILE C . n C 3 249 GLN 249 396 396 GLN GLN C . n C 3 250 ASP 250 397 397 ASP ASP C . n C 3 251 TRP 251 398 398 TRP TRP C . n C 3 252 VAL 252 399 399 VAL VAL C . n C 3 253 GLN 253 400 400 GLN GLN C . n C 3 254 LYS 254 401 401 LYS LYS C . n C 3 255 THR 255 402 402 THR THR C . n C 3 256 ILE 256 403 403 ILE ILE C . n C 3 257 ALA 257 404 404 ALA ALA C . n C 3 258 GLU 258 405 405 GLU GLU C . n C 3 259 ASN 259 406 406 ASN ASN C . 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 D 4 HEM 1 201 143 HEM HEM A . E 5 OXY 1 202 144 OXY OXY A . F 4 HEM 1 201 147 HEM HEM B . G 5 OXY 1 202 148 OXY OXY B . H 6 GOL 1 203 2 GOL GOL B . I 7 NAG 1 501 407 NAG NAG C . J 8 FUC 2 502 408 FUC FUC C . K 9 SO4 1 503 1 SO4 SO4 C . L 6 GOL 1 504 1 GOL GOL C . M 10 CAC 1 505 1 CAC CAC C . N 11 HOH 1 301 45 HOH HOH A . N 11 HOH 2 302 103 HOH HOH A . N 11 HOH 3 303 171 HOH HOH A . N 11 HOH 4 304 36 HOH HOH A . N 11 HOH 5 305 55 HOH HOH A . N 11 HOH 6 306 164 HOH HOH A . N 11 HOH 7 307 31 HOH HOH A . N 11 HOH 8 308 39 HOH HOH A . N 11 HOH 9 309 29 HOH HOH A . N 11 HOH 10 310 165 HOH HOH A . N 11 HOH 11 311 198 HOH HOH A . N 11 HOH 12 312 41 HOH HOH A . N 11 HOH 13 313 178 HOH HOH A . N 11 HOH 14 314 158 HOH HOH A . N 11 HOH 15 315 7 HOH HOH A . N 11 HOH 16 316 19 HOH HOH A . N 11 HOH 17 317 23 HOH HOH A . N 11 HOH 18 318 24 HOH HOH A . N 11 HOH 19 319 26 HOH HOH A . N 11 HOH 20 320 28 HOH HOH A . N 11 HOH 21 321 52 HOH HOH A . N 11 HOH 22 322 53 HOH HOH A . N 11 HOH 23 323 77 HOH HOH A . N 11 HOH 24 324 78 HOH HOH A . N 11 HOH 25 325 79 HOH HOH A . N 11 HOH 26 326 83 HOH HOH A . N 11 HOH 27 327 85 HOH HOH A . N 11 HOH 28 328 95 HOH HOH A . N 11 HOH 29 329 104 HOH HOH A . N 11 HOH 30 330 105 HOH HOH A . N 11 HOH 31 331 107 HOH HOH A . N 11 HOH 32 332 122 HOH HOH A . N 11 HOH 33 333 129 HOH HOH A . N 11 HOH 34 334 130 HOH HOH A . N 11 HOH 35 335 134 HOH HOH A . N 11 HOH 36 336 135 HOH HOH A . N 11 HOH 37 337 140 HOH HOH A . N 11 HOH 38 338 142 HOH HOH A . N 11 HOH 39 339 149 HOH HOH A . N 11 HOH 40 340 154 HOH HOH A . N 11 HOH 41 341 155 HOH HOH A . N 11 HOH 42 342 156 HOH HOH A . N 11 HOH 43 343 159 HOH HOH A . N 11 HOH 44 344 168 HOH HOH A . N 11 HOH 45 345 169 HOH HOH A . N 11 HOH 46 346 172 HOH HOH A . N 11 HOH 47 347 174 HOH HOH A . N 11 HOH 48 348 175 HOH HOH A . N 11 HOH 49 349 177 HOH HOH A . N 11 HOH 50 350 182 HOH HOH A . N 11 HOH 51 351 189 HOH HOH A . N 11 HOH 52 352 191 HOH HOH A . N 11 HOH 53 353 192 HOH HOH A . N 11 HOH 54 354 199 HOH HOH A . N 11 HOH 55 355 208 HOH HOH A . O 11 HOH 1 301 144 HOH HOH B . O 11 HOH 2 302 145 HOH HOH B . O 11 HOH 3 303 97 HOH HOH B . O 11 HOH 4 304 123 HOH HOH B . O 11 HOH 5 305 25 HOH HOH B . O 11 HOH 6 306 93 HOH HOH B . O 11 HOH 7 307 54 HOH HOH B . O 11 HOH 8 308 152 HOH HOH B . O 11 HOH 9 309 10 HOH HOH B . O 11 HOH 10 310 47 HOH HOH B . O 11 HOH 11 311 75 HOH HOH B . O 11 HOH 12 312 84 HOH HOH B . O 11 HOH 13 313 88 HOH HOH B . O 11 HOH 14 314 92 HOH HOH B . O 11 HOH 15 315 109 HOH HOH B . O 11 HOH 16 316 113 HOH HOH B . O 11 HOH 17 317 117 HOH HOH B . O 11 HOH 18 318 121 HOH HOH B . O 11 HOH 19 319 124 HOH HOH B . O 11 HOH 20 320 125 HOH HOH B . O 11 HOH 21 321 131 HOH HOH B . O 11 HOH 22 322 132 HOH HOH B . O 11 HOH 23 323 136 HOH HOH B . O 11 HOH 24 324 146 HOH HOH B . O 11 HOH 25 325 147 HOH HOH B . O 11 HOH 26 326 183 HOH HOH B . O 11 HOH 27 327 186 HOH HOH B . O 11 HOH 28 328 215 HOH HOH B . P 11 HOH 1 601 212 HOH HOH C . P 11 HOH 2 602 126 HOH HOH C . P 11 HOH 3 603 141 HOH HOH C . P 11 HOH 4 604 163 HOH HOH C . P 11 HOH 5 605 111 HOH HOH C . P 11 HOH 6 606 87 HOH HOH C . P 11 HOH 7 607 91 HOH HOH C . P 11 HOH 8 608 211 HOH HOH C . P 11 HOH 9 609 202 HOH HOH C . P 11 HOH 10 610 51 HOH HOH C . P 11 HOH 11 611 68 HOH HOH C . P 11 HOH 12 612 49 HOH HOH C . P 11 HOH 13 613 137 HOH HOH C . P 11 HOH 14 614 81 HOH HOH C . P 11 HOH 15 615 18 HOH HOH C . P 11 HOH 16 616 112 HOH HOH C . P 11 HOH 17 617 170 HOH HOH C . P 11 HOH 18 618 102 HOH HOH C . P 11 HOH 19 619 108 HOH HOH C . P 11 HOH 20 620 203 HOH HOH C . P 11 HOH 21 621 114 HOH HOH C . P 11 HOH 22 622 34 HOH HOH C . P 11 HOH 23 623 162 HOH HOH C . P 11 HOH 24 624 148 HOH HOH C . P 11 HOH 25 625 86 HOH HOH C . P 11 HOH 26 626 73 HOH HOH C . P 11 HOH 27 627 217 HOH HOH C . P 11 HOH 28 628 216 HOH HOH C . P 11 HOH 29 629 157 HOH HOH C . P 11 HOH 30 630 2 HOH HOH C . P 11 HOH 31 631 205 HOH HOH C . P 11 HOH 32 632 206 HOH HOH C . P 11 HOH 33 633 187 HOH HOH C . P 11 HOH 34 634 1 HOH HOH C . P 11 HOH 35 635 3 HOH HOH C . P 11 HOH 36 636 4 HOH HOH C . P 11 HOH 37 637 5 HOH HOH C . P 11 HOH 38 638 6 HOH HOH C . P 11 HOH 39 639 8 HOH HOH C . P 11 HOH 40 640 9 HOH HOH C . P 11 HOH 41 641 11 HOH HOH C . P 11 HOH 42 642 12 HOH HOH C . P 11 HOH 43 643 13 HOH HOH C . P 11 HOH 44 644 14 HOH HOH C . P 11 HOH 45 645 15 HOH HOH C . P 11 HOH 46 646 16 HOH HOH C . P 11 HOH 47 647 17 HOH HOH C . P 11 HOH 48 648 20 HOH HOH C . P 11 HOH 49 649 21 HOH HOH C . P 11 HOH 50 650 22 HOH HOH C . P 11 HOH 51 651 27 HOH HOH C . P 11 HOH 52 652 30 HOH HOH C . P 11 HOH 53 653 32 HOH HOH C . P 11 HOH 54 654 33 HOH HOH C . P 11 HOH 55 655 35 HOH HOH C . P 11 HOH 56 656 37 HOH HOH C . P 11 HOH 57 657 38 HOH HOH C . P 11 HOH 58 658 40 HOH HOH C . P 11 HOH 59 659 42 HOH HOH C . P 11 HOH 60 660 43 HOH HOH C . P 11 HOH 61 661 44 HOH HOH C . P 11 HOH 62 662 46 HOH HOH C . P 11 HOH 63 663 48 HOH HOH C . P 11 HOH 64 664 50 HOH HOH C . P 11 HOH 65 665 56 HOH HOH C . P 11 HOH 66 666 57 HOH HOH C . P 11 HOH 67 667 58 HOH HOH C . P 11 HOH 68 668 59 HOH HOH C . P 11 HOH 69 669 60 HOH HOH C . P 11 HOH 70 670 61 HOH HOH C . P 11 HOH 71 671 62 HOH HOH C . P 11 HOH 72 672 63 HOH HOH C . P 11 HOH 73 673 64 HOH HOH C . P 11 HOH 74 674 65 HOH HOH C . P 11 HOH 75 675 66 HOH HOH C . P 11 HOH 76 676 67 HOH HOH C . P 11 HOH 77 677 69 HOH HOH C . P 11 HOH 78 678 70 HOH HOH C . P 11 HOH 79 679 71 HOH HOH C . P 11 HOH 80 680 72 HOH HOH C . P 11 HOH 81 681 74 HOH HOH C . P 11 HOH 82 682 76 HOH HOH C . P 11 HOH 83 683 80 HOH HOH C . P 11 HOH 84 684 82 HOH HOH C . P 11 HOH 85 685 89 HOH HOH C . P 11 HOH 86 686 90 HOH HOH C . P 11 HOH 87 687 94 HOH HOH C . P 11 HOH 88 688 96 HOH HOH C . P 11 HOH 89 689 98 HOH HOH C . P 11 HOH 90 690 99 HOH HOH C . P 11 HOH 91 691 100 HOH HOH C . P 11 HOH 92 692 101 HOH HOH C . P 11 HOH 93 693 106 HOH HOH C . P 11 HOH 94 694 110 HOH HOH C . P 11 HOH 95 695 115 HOH HOH C . P 11 HOH 96 696 116 HOH HOH C . P 11 HOH 97 697 118 HOH HOH C . P 11 HOH 98 698 119 HOH HOH C . P 11 HOH 99 699 120 HOH HOH C . P 11 HOH 100 700 127 HOH HOH C . P 11 HOH 101 701 128 HOH HOH C . P 11 HOH 102 702 133 HOH HOH C . P 11 HOH 103 703 138 HOH HOH C . P 11 HOH 104 704 139 HOH HOH C . P 11 HOH 105 705 143 HOH HOH C . P 11 HOH 106 706 150 HOH HOH C . P 11 HOH 107 707 151 HOH HOH C . P 11 HOH 108 708 153 HOH HOH C . P 11 HOH 109 709 160 HOH HOH C . P 11 HOH 110 710 161 HOH HOH C . P 11 HOH 111 711 166 HOH HOH C . P 11 HOH 112 712 167 HOH HOH C . P 11 HOH 113 713 173 HOH HOH C . P 11 HOH 114 714 176 HOH HOH C . P 11 HOH 115 715 179 HOH HOH C . P 11 HOH 116 716 180 HOH HOH C . P 11 HOH 117 717 181 HOH HOH C . P 11 HOH 118 718 184 HOH HOH C . P 11 HOH 119 719 185 HOH HOH C . P 11 HOH 120 720 188 HOH HOH C . P 11 HOH 121 721 190 HOH HOH C . P 11 HOH 122 722 193 HOH HOH C . P 11 HOH 123 723 194 HOH HOH C . P 11 HOH 124 724 195 HOH HOH C . P 11 HOH 125 725 196 HOH HOH C . P 11 HOH 126 726 197 HOH HOH C . P 11 HOH 127 727 200 HOH HOH C . P 11 HOH 128 728 201 HOH HOH C . P 11 HOH 129 729 204 HOH HOH C . P 11 HOH 130 730 207 HOH HOH C . P 11 HOH 131 731 209 HOH HOH C . P 11 HOH 132 732 210 HOH HOH C . P 11 HOH 133 733 213 HOH HOH C . P 11 HOH 134 734 214 HOH HOH C . # _pdbx_struct_assembly.id 1 _pdbx_struct_assembly.details software_defined_assembly _pdbx_struct_assembly.method_details PISA _pdbx_struct_assembly.oligomeric_details trimeric _pdbx_struct_assembly.oligomeric_count 3 # _pdbx_struct_assembly_gen.assembly_id 1 _pdbx_struct_assembly_gen.oper_expression 1 _pdbx_struct_assembly_gen.asym_id_list A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P # loop_ _pdbx_struct_assembly_prop.biol_id _pdbx_struct_assembly_prop.type _pdbx_struct_assembly_prop.value _pdbx_struct_assembly_prop.details 1 'ABSA (A^2)' 8680 ? 1 MORE -74 ? 1 'SSA (A^2)' 22480 ? # _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 # _pdbx_struct_special_symmetry.id 1 _pdbx_struct_special_symmetry.PDB_model_num 1 _pdbx_struct_special_symmetry.auth_asym_id C _pdbx_struct_special_symmetry.auth_comp_id HOH _pdbx_struct_special_symmetry.auth_seq_id 608 _pdbx_struct_special_symmetry.PDB_ins_code ? _pdbx_struct_special_symmetry.label_asym_id P _pdbx_struct_special_symmetry.label_comp_id HOH _pdbx_struct_special_symmetry.label_seq_id . # loop_ _pdbx_struct_conn_angle.id _pdbx_struct_conn_angle.ptnr1_label_atom_id _pdbx_struct_conn_angle.ptnr1_label_alt_id _pdbx_struct_conn_angle.ptnr1_label_asym_id _pdbx_struct_conn_angle.ptnr1_label_comp_id _pdbx_struct_conn_angle.ptnr1_label_seq_id _pdbx_struct_conn_angle.ptnr1_auth_atom_id _pdbx_struct_conn_angle.ptnr1_auth_asym_id _pdbx_struct_conn_angle.ptnr1_auth_comp_id _pdbx_struct_conn_angle.ptnr1_auth_seq_id _pdbx_struct_conn_angle.ptnr1_PDB_ins_code _pdbx_struct_conn_angle.ptnr1_symmetry _pdbx_struct_conn_angle.ptnr2_label_atom_id _pdbx_struct_conn_angle.ptnr2_label_alt_id _pdbx_struct_conn_angle.ptnr2_label_asym_id _pdbx_struct_conn_angle.ptnr2_label_comp_id _pdbx_struct_conn_angle.ptnr2_label_seq_id _pdbx_struct_conn_angle.ptnr2_auth_atom_id _pdbx_struct_conn_angle.ptnr2_auth_asym_id _pdbx_struct_conn_angle.ptnr2_auth_comp_id _pdbx_struct_conn_angle.ptnr2_auth_seq_id _pdbx_struct_conn_angle.ptnr2_PDB_ins_code _pdbx_struct_conn_angle.ptnr2_symmetry _pdbx_struct_conn_angle.ptnr3_label_atom_id _pdbx_struct_conn_angle.ptnr3_label_alt_id _pdbx_struct_conn_angle.ptnr3_label_asym_id _pdbx_struct_conn_angle.ptnr3_label_comp_id _pdbx_struct_conn_angle.ptnr3_label_seq_id _pdbx_struct_conn_angle.ptnr3_auth_atom_id _pdbx_struct_conn_angle.ptnr3_auth_asym_id _pdbx_struct_conn_angle.ptnr3_auth_comp_id _pdbx_struct_conn_angle.ptnr3_auth_seq_id _pdbx_struct_conn_angle.ptnr3_PDB_ins_code _pdbx_struct_conn_angle.ptnr3_symmetry _pdbx_struct_conn_angle.value _pdbx_struct_conn_angle.value_esd 1 NE2 ? A HIS 87 ? A HIS 88 ? 1_555 FE ? D HEM . ? A HEM 201 ? 1_555 NA ? D HEM . ? A HEM 201 ? 1_555 89.5 ? 2 NE2 ? A HIS 87 ? A HIS 88 ? 1_555 FE ? D HEM . ? A HEM 201 ? 1_555 NB ? D HEM . ? A HEM 201 ? 1_555 88.1 ? 3 NA ? D HEM . ? A HEM 201 ? 1_555 FE ? D HEM . ? A HEM 201 ? 1_555 NB ? D HEM . ? A HEM 201 ? 1_555 91.5 ? 4 NE2 ? A HIS 87 ? A HIS 88 ? 1_555 FE ? D HEM . ? A HEM 201 ? 1_555 NC ? D HEM . ? A HEM 201 ? 1_555 92.2 ? 5 NA ? D HEM . ? A HEM 201 ? 1_555 FE ? D HEM . ? A HEM 201 ? 1_555 NC ? D HEM . ? A HEM 201 ? 1_555 178.2 ? 6 NB ? D HEM . ? A HEM 201 ? 1_555 FE ? D HEM . ? A HEM 201 ? 1_555 NC ? D HEM . ? A HEM 201 ? 1_555 87.9 ? 7 NE2 ? A HIS 87 ? A HIS 88 ? 1_555 FE ? D HEM . ? A HEM 201 ? 1_555 ND ? D HEM . ? A HEM 201 ? 1_555 93.6 ? 8 NA ? D HEM . ? A HEM 201 ? 1_555 FE ? D HEM . ? A HEM 201 ? 1_555 ND ? D HEM . ? A HEM 201 ? 1_555 88.6 ? 9 NB ? D HEM . ? A HEM 201 ? 1_555 FE ? D HEM . ? A HEM 201 ? 1_555 ND ? D HEM . ? A HEM 201 ? 1_555 178.4 ? 10 NC ? D HEM . ? A HEM 201 ? 1_555 FE ? D HEM . ? A HEM 201 ? 1_555 ND ? D HEM . ? A HEM 201 ? 1_555 92.0 ? 11 NE2 ? A HIS 87 ? A HIS 88 ? 1_555 FE ? D HEM . ? A HEM 201 ? 1_555 O1 ? E OXY . ? A OXY 202 ? 1_555 176.1 ? 12 NA ? D HEM . ? A HEM 201 ? 1_555 FE ? D HEM . ? A HEM 201 ? 1_555 O1 ? E OXY . ? A OXY 202 ? 1_555 87.4 ? 13 NB ? D HEM . ? A HEM 201 ? 1_555 FE ? D HEM . ? A HEM 201 ? 1_555 O1 ? E OXY . ? A OXY 202 ? 1_555 89.6 ? 14 NC ? D HEM . ? A HEM 201 ? 1_555 FE ? D HEM . ? A HEM 201 ? 1_555 O1 ? E OXY . ? A OXY 202 ? 1_555 90.9 ? 15 ND ? D HEM . ? A HEM 201 ? 1_555 FE ? D HEM . ? A HEM 201 ? 1_555 O1 ? E OXY . ? A OXY 202 ? 1_555 88.7 ? 16 NE2 ? A HIS 87 ? A HIS 88 ? 1_555 FE ? D HEM . ? A HEM 201 ? 1_555 O2 ? E OXY . ? A OXY 202 ? 1_555 156.0 ? 17 NA ? D HEM . ? A HEM 201 ? 1_555 FE ? D HEM . ? A HEM 201 ? 1_555 O2 ? E OXY . ? A OXY 202 ? 1_555 112.4 ? 18 NB ? D HEM . ? A HEM 201 ? 1_555 FE ? D HEM . ? A HEM 201 ? 1_555 O2 ? E OXY . ? A OXY 202 ? 1_555 81.9 ? 19 NC ? D HEM . ? A HEM 201 ? 1_555 FE ? D HEM . ? A HEM 201 ? 1_555 O2 ? E OXY . ? A OXY 202 ? 1_555 65.9 ? 20 ND ? D HEM . ? A HEM 201 ? 1_555 FE ? D HEM . ? A HEM 201 ? 1_555 O2 ? E OXY . ? A OXY 202 ? 1_555 96.6 ? 21 O1 ? E OXY . ? A OXY 202 ? 1_555 FE ? D HEM . ? A HEM 201 ? 1_555 O2 ? E OXY . ? A OXY 202 ? 1_555 26.1 ? 22 NE2 ? B HIS 92 ? B HIS 93 ? 1_555 FE ? F HEM . ? B HEM 201 ? 1_555 NA ? F HEM . ? B HEM 201 ? 1_555 89.0 ? 23 NE2 ? B HIS 92 ? B HIS 93 ? 1_555 FE ? F HEM . ? B HEM 201 ? 1_555 NB ? F HEM . ? B HEM 201 ? 1_555 90.8 ? 24 NA ? F HEM . ? B HEM 201 ? 1_555 FE ? F HEM . ? B HEM 201 ? 1_555 NB ? F HEM . ? B HEM 201 ? 1_555 90.5 ? 25 NE2 ? B HIS 92 ? B HIS 93 ? 1_555 FE ? F HEM . ? B HEM 201 ? 1_555 NC ? F HEM . ? B HEM 201 ? 1_555 93.8 ? 26 NA ? F HEM . ? B HEM 201 ? 1_555 FE ? F HEM . ? B HEM 201 ? 1_555 NC ? F HEM . ? B HEM 201 ? 1_555 177.1 ? 27 NB ? F HEM . ? B HEM 201 ? 1_555 FE ? F HEM . ? B HEM 201 ? 1_555 NC ? F HEM . ? B HEM 201 ? 1_555 88.8 ? 28 NE2 ? B HIS 92 ? B HIS 93 ? 1_555 FE ? F HEM . ? B HEM 201 ? 1_555 ND ? F HEM . ? B HEM 201 ? 1_555 91.4 ? 29 NA ? F HEM . ? B HEM 201 ? 1_555 FE ? F HEM . ? B HEM 201 ? 1_555 ND ? F HEM . ? B HEM 201 ? 1_555 88.9 ? 30 NB ? F HEM . ? B HEM 201 ? 1_555 FE ? F HEM . ? B HEM 201 ? 1_555 ND ? F HEM . ? B HEM 201 ? 1_555 177.6 ? 31 NC ? F HEM . ? B HEM 201 ? 1_555 FE ? F HEM . ? B HEM 201 ? 1_555 ND ? F HEM . ? B HEM 201 ? 1_555 91.7 ? 32 NE2 ? B HIS 92 ? B HIS 93 ? 1_555 FE ? F HEM . ? B HEM 201 ? 1_555 O2 ? G OXY . ? B OXY 202 ? 1_555 171.9 ? 33 NA ? F HEM . ? B HEM 201 ? 1_555 FE ? F HEM . ? B HEM 201 ? 1_555 O2 ? G OXY . ? B OXY 202 ? 1_555 97.8 ? 34 NB ? F HEM . ? B HEM 201 ? 1_555 FE ? F HEM . ? B HEM 201 ? 1_555 O2 ? G OXY . ? B OXY 202 ? 1_555 84.7 ? 35 NC ? F HEM . ? B HEM 201 ? 1_555 FE ? F HEM . ? B HEM 201 ? 1_555 O2 ? G OXY . ? B OXY 202 ? 1_555 79.3 ? 36 ND ? F HEM . ? B HEM 201 ? 1_555 FE ? F HEM . ? B HEM 201 ? 1_555 O2 ? G OXY . ? B OXY 202 ? 1_555 93.1 ? # 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 2014-12-24 2 'Structure model' 1 1 2015-01-21 3 'Structure model' 1 2 2015-03-04 # _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' 'Database references' 2 3 'Structure model' 'Database references' # 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 ? ? ? 5.7.0032 1 ? 'data reduction' ? ? ? ? ? ? ? ? ? ? ? MOSFLM ? ? ? . 2 ? 'data scaling' ? ? ? ? ? ? ? ? ? ? ? SCALA ? ? ? . 3 ? phasing ? ? ? ? ? ? ? ? ? ? ? PHASER ? ? ? . 4 # loop_ _pdbx_validate_close_contact.id _pdbx_validate_close_contact.PDB_model_num _pdbx_validate_close_contact.auth_atom_id_1 _pdbx_validate_close_contact.auth_asym_id_1 _pdbx_validate_close_contact.auth_comp_id_1 _pdbx_validate_close_contact.auth_seq_id_1 _pdbx_validate_close_contact.PDB_ins_code_1 _pdbx_validate_close_contact.label_alt_id_1 _pdbx_validate_close_contact.auth_atom_id_2 _pdbx_validate_close_contact.auth_asym_id_2 _pdbx_validate_close_contact.auth_comp_id_2 _pdbx_validate_close_contact.auth_seq_id_2 _pdbx_validate_close_contact.PDB_ins_code_2 _pdbx_validate_close_contact.label_alt_id_2 _pdbx_validate_close_contact.dist 1 1 O C HOH 609 ? ? O C HOH 631 ? ? 1.04 2 1 O C HOH 620 ? ? O C HOH 627 ? ? 1.23 3 1 FE B HEM 201 ? ? O1 B OXY 202 ? ? 1.57 4 1 OE2 C GLU 336 ? ? O C HOH 601 ? ? 1.60 5 1 O C HOH 723 ? ? O C HOH 724 ? ? 1.93 6 1 OE2 C GLU 385 ? ? O2 C CAC 505 ? ? 1.97 7 1 O A HOH 311 ? ? O A HOH 354 ? ? 1.98 8 1 NZ A LYS 8 ? ? OD1 A ASP 75 ? ? 2.10 9 1 O A HOH 327 ? ? O A HOH 340 ? ? 2.10 10 1 CB C VAL 275 ? ? O C HOH 632 ? ? 2.12 11 1 O C HOH 722 ? ? O C HOH 724 ? ? 2.19 12 1 NZ C LYS 170 ? ? O C HOH 710 ? ? 2.19 # loop_ _pdbx_validate_symm_contact.id _pdbx_validate_symm_contact.PDB_model_num _pdbx_validate_symm_contact.auth_atom_id_1 _pdbx_validate_symm_contact.auth_asym_id_1 _pdbx_validate_symm_contact.auth_comp_id_1 _pdbx_validate_symm_contact.auth_seq_id_1 _pdbx_validate_symm_contact.PDB_ins_code_1 _pdbx_validate_symm_contact.label_alt_id_1 _pdbx_validate_symm_contact.site_symmetry_1 _pdbx_validate_symm_contact.auth_atom_id_2 _pdbx_validate_symm_contact.auth_asym_id_2 _pdbx_validate_symm_contact.auth_comp_id_2 _pdbx_validate_symm_contact.auth_seq_id_2 _pdbx_validate_symm_contact.PDB_ins_code_2 _pdbx_validate_symm_contact.label_alt_id_2 _pdbx_validate_symm_contact.site_symmetry_2 _pdbx_validate_symm_contact.dist 1 1 C1 C CAC 505 ? ? 1_555 C1 C CAC 505 ? ? 5_554 1.32 2 1 AS C CAC 505 ? ? 1_555 C1 C CAC 505 ? ? 5_554 1.84 # _pdbx_validate_rmsd_bond.id 1 _pdbx_validate_rmsd_bond.PDB_model_num 1 _pdbx_validate_rmsd_bond.auth_atom_id_1 CD _pdbx_validate_rmsd_bond.auth_asym_id_1 C _pdbx_validate_rmsd_bond.auth_comp_id_1 GLU _pdbx_validate_rmsd_bond.auth_seq_id_1 348 _pdbx_validate_rmsd_bond.PDB_ins_code_1 ? _pdbx_validate_rmsd_bond.label_alt_id_1 ? _pdbx_validate_rmsd_bond.auth_atom_id_2 OE2 _pdbx_validate_rmsd_bond.auth_asym_id_2 C _pdbx_validate_rmsd_bond.auth_comp_id_2 GLU _pdbx_validate_rmsd_bond.auth_seq_id_2 348 _pdbx_validate_rmsd_bond.PDB_ins_code_2 ? _pdbx_validate_rmsd_bond.label_alt_id_2 ? _pdbx_validate_rmsd_bond.bond_value 1.329 _pdbx_validate_rmsd_bond.bond_target_value 1.252 _pdbx_validate_rmsd_bond.bond_deviation 0.077 _pdbx_validate_rmsd_bond.bond_standard_deviation 0.011 _pdbx_validate_rmsd_bond.linker_flag N # loop_ _pdbx_validate_rmsd_angle.id _pdbx_validate_rmsd_angle.PDB_model_num _pdbx_validate_rmsd_angle.auth_atom_id_1 _pdbx_validate_rmsd_angle.auth_asym_id_1 _pdbx_validate_rmsd_angle.auth_comp_id_1 _pdbx_validate_rmsd_angle.auth_seq_id_1 _pdbx_validate_rmsd_angle.PDB_ins_code_1 _pdbx_validate_rmsd_angle.label_alt_id_1 _pdbx_validate_rmsd_angle.auth_atom_id_2 _pdbx_validate_rmsd_angle.auth_asym_id_2 _pdbx_validate_rmsd_angle.auth_comp_id_2 _pdbx_validate_rmsd_angle.auth_seq_id_2 _pdbx_validate_rmsd_angle.PDB_ins_code_2 _pdbx_validate_rmsd_angle.label_alt_id_2 _pdbx_validate_rmsd_angle.auth_atom_id_3 _pdbx_validate_rmsd_angle.auth_asym_id_3 _pdbx_validate_rmsd_angle.auth_comp_id_3 _pdbx_validate_rmsd_angle.auth_seq_id_3 _pdbx_validate_rmsd_angle.PDB_ins_code_3 _pdbx_validate_rmsd_angle.label_alt_id_3 _pdbx_validate_rmsd_angle.angle_value _pdbx_validate_rmsd_angle.angle_target_value _pdbx_validate_rmsd_angle.angle_deviation _pdbx_validate_rmsd_angle.angle_standard_deviation _pdbx_validate_rmsd_angle.linker_flag 1 1 NE A ARG 32 ? ? CZ A ARG 32 ? ? NH1 A ARG 32 ? ? 125.51 120.30 5.21 0.50 N 2 1 NE A ARG 32 ? ? CZ A ARG 32 ? ? NH2 A ARG 32 ? ? 117.12 120.30 -3.18 0.50 N 3 1 CB A ASP 48 ? ? CG A ASP 48 ? ? OD1 A ASP 48 ? ? 125.21 118.30 6.91 0.90 N 4 1 CB C ASP 305 ? ? CG C ASP 305 ? ? OD1 C ASP 305 ? ? 124.36 118.30 6.06 0.90 N 5 1 NE C ARG 311 ? ? CZ C ARG 311 ? ? NH1 C ARG 311 ? ? 125.94 120.30 5.64 0.50 N 6 1 CG C MET 343 ? ? SD C MET 343 ? ? CE C MET 343 ? ? 110.23 100.20 10.03 1.60 N # loop_ _pdbx_validate_torsion.id _pdbx_validate_torsion.PDB_model_num _pdbx_validate_torsion.auth_comp_id _pdbx_validate_torsion.auth_asym_id _pdbx_validate_torsion.auth_seq_id _pdbx_validate_torsion.PDB_ins_code _pdbx_validate_torsion.label_alt_id _pdbx_validate_torsion.phi _pdbx_validate_torsion.psi 1 1 THR B 5 ? ? -48.11 166.85 2 1 VAL B 21 ? ? -39.96 -28.91 3 1 GLU B 23 ? ? -130.55 -41.00 4 1 HIS B 78 ? ? -143.33 37.32 5 1 ASN B 81 ? ? -142.78 58.30 6 1 ASN C 157 ? ? -151.28 72.95 7 1 ASN C 241 ? ? -113.32 53.16 8 1 ASN C 259 ? ? -162.34 -164.71 9 1 ALA C 273 ? ? -89.27 46.80 10 1 ASN C 335 ? ? -164.93 -168.92 11 1 VAL C 383 ? ? -104.40 -60.90 # 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 B VAL 2 ? B VAL 1 2 1 Y 1 B HIS 147 ? B HIS 146 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 4 'PROTOPORPHYRIN IX CONTAINING FE' HEM 5 'OXYGEN MOLECULE' OXY 6 GLYCEROL GOL 7 N-ACETYL-D-GLUCOSAMINE NAG 8 ALPHA-L-FUCOSE FUC 9 'SULFATE ION' SO4 10 'CACODYLATE ION' CAC 11 water HOH #