# By using this file you agree to the legally binding terms of use found at # https://github.com/google-deepmind/alphafold3/blob/main/OUTPUT_TERMS_OF_USE.md. # To request access to the AlphaFold 3 model parameters, follow the process set # out at https://github.com/google-deepmind/alphafold3. You may only use these if # received directly from Google. Use is subject to terms of use available at # https://github.com/google-deepmind/alphafold3/blob/main/WEIGHTS_TERMS_OF_USE.md. data_7f4p # _entry.id 7f4p # loop_ _atom_type.symbol C N O S # loop_ _audit_author.name _audit_author.pdbx_ordinal "Google DeepMind" 1 "Isomorphic Labs" 2 # _audit_conform.dict_location https://raw.githubusercontent.com/ihmwg/ModelCIF/master/dist/mmcif_ma.dic _audit_conform.dict_name mmcif_ma.dic _audit_conform.dict_version 1.4.5 # loop_ _chem_comp.formula _chem_comp.formula_weight _chem_comp.id _chem_comp.mon_nstd_flag _chem_comp.name _chem_comp.pdbx_smiles _chem_comp.pdbx_synonyms _chem_comp.type "C3 H7 N O2" 89.093 ALA y ALANINE C[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C6 H15 N4 O2" 175.209 ARG y ARGININE C(C[C@@H](C(=O)O)N)CNC(=[NH2+])N ? "L-PEPTIDE LINKING" "C4 H8 N2 O3" 132.118 ASN y ASPARAGINE C([C@@H](C(=O)O)N)C(=O)N ? "L-PEPTIDE LINKING" "C4 H7 N O4" 133.103 ASP y "ASPARTIC ACID" C([C@@H](C(=O)O)N)C(=O)O ? "L-PEPTIDE LINKING" "C3 H7 N O2 S" 121.158 CYS y CYSTEINE C([C@@H](C(=O)O)N)S ? "L-PEPTIDE LINKING" "C5 H10 N2 O3" 146.144 GLN y GLUTAMINE C(CC(=O)N)[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C5 H9 N O4" 147.129 GLU y "GLUTAMIC ACID" C(CC(=O)O)[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C2 H5 N O2" 75.067 GLY y GLYCINE C(C(=O)O)N ? "PEPTIDE LINKING" "C6 H10 N3 O2" 156.162 HIS y HISTIDINE c1c([nH+]c[nH]1)C[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C6 H13 N O2" 131.173 ILE y ISOLEUCINE CC[C@H](C)[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C6 H13 N O2" 131.173 LEU y LEUCINE CC(C)C[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C6 H15 N2 O2" 147.195 LYS y LYSINE C(CC[NH3+])C[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C5 H11 N O2 S" 149.211 MET y METHIONINE CSCC[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C9 H11 N O2" 165.189 PHE y PHENYLALANINE c1ccc(cc1)C[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C5 H9 N O2" 115.130 PRO y PROLINE C1C[C@H](NC1)C(=O)O ? "L-PEPTIDE LINKING" "C15 H22 N6 O5 S" 398.437 SAM . S-ADENOSYLMETHIONINE C[S@@+](CC[C@@H](C(=O)[O-])N)C[C@@H]1[C@H]([C@H]([C@@H](O1)n2cnc3c2ncnc3N)O)O ? NON-POLYMER "C3 H7 N O3" 105.093 SER y SERINE C([C@@H](C(=O)O)N)O ? "L-PEPTIDE LINKING" "C4 H9 N O3" 119.119 THR y THREONINE C[C@H]([C@@H](C(=O)O)N)O ? "L-PEPTIDE LINKING" "C11 H12 N2 O2" 204.225 TRP y TRYPTOPHAN c1ccc2c(c1)c(c[nH]2)C[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" "C9 H11 N O3" 181.189 TYR y TYROSINE c1cc(ccc1C[C@@H](C(=O)O)N)O ? "L-PEPTIDE LINKING" "C5 H11 N O2" 117.146 VAL y VALINE CC(C)[C@@H](C(=O)O)N ? "L-PEPTIDE LINKING" # _citation.book_publisher ? _citation.country UK _citation.id primary _citation.journal_full Nature _citation.journal_id_ASTM NATUAS _citation.journal_id_CSD 0006 _citation.journal_id_ISSN 0028-0836 _citation.journal_volume 630 _citation.page_first 493 _citation.page_last 500 _citation.pdbx_database_id_DOI 10.1038/s41586-024-07487-w _citation.pdbx_database_id_PubMed 38718835 _citation.title "Accurate structure prediction of biomolecular interactions with AlphaFold 3" _citation.year 2024 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary "Google DeepMind" 1 primary "Isomorphic Labs" 2 # loop_ _entity.id _entity.pdbx_description _entity.type 1 . polymer 2 . polymer 3 . non-polymer # loop_ _entity_poly.entity_id _entity_poly.pdbx_strand_id _entity_poly.type 1 A polypeptide(L) 2 B polypeptide(L) # loop_ _entity_poly_seq.entity_id _entity_poly_seq.hetero _entity_poly_seq.mon_id _entity_poly_seq.num 1 n MET 1 1 n LYS 2 1 n LYS 3 1 n ASN 4 1 n GLY 5 1 n LYS 6 1 n SER 7 1 n GLN 8 1 n ASN 9 1 n GLN 10 1 n PRO 11 1 n LEU 12 1 n ASP 13 1 n PHE 14 1 n THR 15 1 n GLN 16 1 n TYR 17 1 n ALA 18 1 n LYS 19 1 n ASN 20 1 n MET 21 1 n ARG 22 1 n LYS 23 1 n ASP 24 1 n LEU 25 1 n SER 26 1 n ASN 27 1 n GLN 28 1 n ASP 29 1 n ILE 30 1 n CYS 31 1 n LEU 32 1 n GLU 33 1 n ASP 34 1 n GLY 35 1 n ALA 36 1 n LEU 37 1 n ASN 38 1 n HIS 39 1 n SER 40 1 n TYR 41 1 n PHE 42 1 n LEU 43 1 n THR 44 1 n LYS 45 1 n LYS 46 1 n GLY 47 1 n GLN 48 1 n TYR 49 1 n TRP 50 1 n THR 51 1 n PRO 52 1 n LEU 53 1 n ASN 54 1 n GLN 55 1 n LYS 56 1 n ALA 57 1 n LEU 58 1 n GLN 59 1 n ARG 60 1 n GLY 61 1 n ILE 62 1 n GLU 63 1 n LEU 64 1 n PHE 65 1 n GLY 66 1 n VAL 67 1 n GLY 68 1 n ASN 69 1 n TRP 70 1 n LYS 71 1 n GLU 72 1 n ILE 73 1 n ASN 74 1 n TYR 75 1 n ASP 76 1 n GLU 77 1 n PHE 78 1 n SER 79 1 n GLY 80 1 n LYS 81 1 n ALA 82 1 n ASN 83 1 n ILE 84 1 n VAL 85 1 n GLU 86 1 n LEU 87 1 n GLU 88 1 n LEU 89 1 n ARG 90 1 n THR 91 1 n CYS 92 1 n MET 93 1 n ILE 94 1 n LEU 95 1 n GLY 96 1 n ILE 97 1 n ASN 98 1 n ASP 99 1 n ILE 100 1 n THR 101 1 n GLU 102 1 n TYR 103 1 n TYR 104 1 n GLY 105 1 n LYS 106 1 n LYS 107 1 n ILE 108 1 n SER 109 1 n GLU 110 1 n GLU 111 1 n GLU 112 1 n GLN 113 1 n GLU 114 1 n GLU 115 1 n ILE 116 1 n LYS 117 1 n LYS 118 1 n SER 119 1 n ASN 120 1 n ILE 121 1 n ALA 122 1 n LYS 123 1 n GLY 124 1 n LYS 125 1 n LYS 126 1 n GLU 127 1 n ASN 128 1 n LYS 129 1 n LEU 130 1 n LYS 131 1 n ASP 132 1 n ASN 133 1 n ILE 134 1 n TYR 135 1 n GLN 136 1 n LYS 137 1 n LEU 138 1 n GLN 139 1 n GLN 140 1 n MET 141 1 n GLN 142 2 n ASP 1 2 n ASP 2 2 n TYR 3 2 n LEU 4 2 n ASP 5 2 n ARG 6 2 n LEU 7 2 n PRO 8 2 n LYS 9 2 n SER 10 2 n LYS 11 2 n LYS 12 2 n GLY 13 2 n LEU 14 2 n GLN 15 2 n GLY 16 2 n LEU 17 2 n LEU 18 2 n GLN 19 2 n ASP 20 2 n ILE 21 2 n GLU 22 2 n LYS 23 2 n ARG 24 2 n ILE 25 2 n LEU 26 2 n HIS 27 2 n TYR 28 2 n LYS 29 2 n GLN 30 2 n LEU 31 2 n PHE 32 2 n PHE 33 2 n LYS 34 2 n GLU 35 2 n GLN 36 2 n ASN 37 2 n GLU 38 2 n ILE 39 2 n ALA 40 2 n ASN 41 2 n GLY 42 2 n LYS 43 2 n ARG 44 2 n SER 45 2 n MET 46 2 n VAL 47 2 n PRO 48 2 n ASP 49 2 n ASN 50 2 n SER 51 2 n ILE 52 2 n PRO 53 2 n ILE 54 2 n CYS 55 2 n SER 56 2 n ASP 57 2 n VAL 58 2 n THR 59 2 n LYS 60 2 n LEU 61 2 n ASN 62 2 n PHE 63 2 n GLN 64 2 n ALA 65 2 n LEU 66 2 n ILE 67 2 n ASP 68 2 n ALA 69 2 n GLN 70 2 n MET 71 2 n ARG 72 2 n HIS 73 2 n ALA 74 2 n GLY 75 2 n LYS 76 2 n MET 77 2 n PHE 78 2 n ASP 79 2 n VAL 80 2 n ILE 81 2 n MET 82 2 n MET 83 2 n ASP 84 2 n PRO 85 2 n PRO 86 2 n TRP 87 2 n GLN 88 2 n LEU 89 2 n SER 90 2 n SER 91 2 n SER 92 2 n GLN 93 2 n PRO 94 2 n SER 95 2 n ARG 96 2 n GLY 97 2 n VAL 98 2 n ALA 99 2 n ILE 100 2 n ALA 101 2 n TYR 102 2 n ASP 103 2 n SER 104 2 n LEU 105 2 n SER 106 2 n ASP 107 2 n GLU 108 2 n LYS 109 2 n ILE 110 2 n GLN 111 2 n ASN 112 2 n MET 113 2 n PRO 114 2 n ILE 115 2 n GLN 116 2 n SER 117 2 n LEU 118 2 n GLN 119 2 n GLN 120 2 n ASP 121 2 n GLY 122 2 n PHE 123 2 n ILE 124 2 n PHE 125 2 n VAL 126 2 n TRP 127 2 n ALA 128 2 n ILE 129 2 n ASN 130 2 n ALA 131 2 n LYS 132 2 n TYR 133 2 n ARG 134 2 n VAL 135 2 n THR 136 2 n ILE 137 2 n LYS 138 2 n MET 139 2 n ILE 140 2 n GLU 141 2 n ASN 142 2 n TRP 143 2 n GLY 144 2 n TYR 145 2 n LYS 146 2 n LEU 147 2 n VAL 148 2 n ASP 149 2 n GLU 150 2 n ILE 151 2 n THR 152 2 n TRP 153 2 n VAL 154 2 n LYS 155 2 n LYS 156 2 n THR 157 2 n VAL 158 2 n ASN 159 2 n GLY 160 2 n LYS 161 2 n ILE 162 2 n ALA 163 2 n LYS 164 2 n GLY 165 2 n HIS 166 2 n GLY 167 2 n PHE 168 2 n TYR 169 2 n LEU 170 2 n GLN 171 2 n HIS 172 2 n ALA 173 2 n LYS 174 2 n GLU 175 2 n SER 176 2 n CYS 177 2 n LEU 178 2 n ILE 179 2 n GLY 180 2 n VAL 181 2 n LYS 182 2 n GLY 183 2 n ASP 184 2 n VAL 185 2 n ASP 186 2 n ASN 187 2 n GLY 188 2 n ARG 189 2 n PHE 190 2 n LYS 191 2 n LYS 192 2 n ASN 193 2 n ILE 194 2 n ALA 195 2 n SER 196 2 n ASP 197 2 n VAL 198 2 n ILE 199 2 n PHE 200 2 n SER 201 2 n GLU 202 2 n ARG 203 2 n ARG 204 2 n GLY 205 2 n GLN 206 2 n SER 207 2 n GLN 208 2 n LYS 209 2 n PRO 210 2 n GLU 211 2 n GLU 212 2 n ILE 213 2 n TYR 214 2 n GLN 215 2 n TYR 216 2 n ILE 217 2 n ASN 218 2 n GLN 219 2 n LEU 220 2 n CYS 221 2 n PRO 222 2 n ASN 223 2 n GLY 224 2 n ASN 225 2 n TYR 226 2 n LEU 227 2 n GLU 228 2 n ILE 229 2 n PHE 230 2 n ALA 231 2 n ARG 232 2 n ARG 233 2 n ASN 234 2 n ASN 235 2 n LEU 236 2 n HIS 237 2 n ASP 238 2 n ASN 239 2 n TRP 240 2 n VAL 241 2 n SER 242 2 n ILE 243 2 n GLY 244 2 n ASN 245 2 n GLU 246 2 n LEU 247 # _ma_data.content_type "model coordinates" _ma_data.id 1 _ma_data.name Model # _ma_model_list.data_id 1 _ma_model_list.model_group_id 1 _ma_model_list.model_group_name "AlphaFold-beta-20231127 (3.0.1 @ 2025-09-26 03:25:19)" _ma_model_list.model_id 1 _ma_model_list.model_name "Top ranked model" _ma_model_list.model_type "Ab initio model" _ma_model_list.ordinal_id 1 # loop_ _ma_protocol_step.method_type _ma_protocol_step.ordinal_id _ma_protocol_step.protocol_id _ma_protocol_step.step_id "coevolution MSA" 1 1 1 "template search" 2 1 2 modeling 3 1 3 # loop_ _ma_qa_metric.id _ma_qa_metric.mode _ma_qa_metric.name _ma_qa_metric.software_group_id _ma_qa_metric.type 1 global pLDDT 1 pLDDT 2 local pLDDT 1 pLDDT # _ma_qa_metric_global.metric_id 1 _ma_qa_metric_global.metric_value 89.25 _ma_qa_metric_global.model_id 1 _ma_qa_metric_global.ordinal_id 1 # loop_ _ma_qa_metric_local.label_asym_id _ma_qa_metric_local.label_comp_id _ma_qa_metric_local.label_seq_id _ma_qa_metric_local.metric_id _ma_qa_metric_local.metric_value _ma_qa_metric_local.model_id _ma_qa_metric_local.ordinal_id A MET 1 2 37.42 1 1 A LYS 2 2 34.80 1 2 A LYS 3 2 33.47 1 3 A ASN 4 2 34.73 1 4 A GLY 5 2 39.45 1 5 A LYS 6 2 35.33 1 6 A SER 7 2 46.46 1 7 A GLN 8 2 40.77 1 8 A ASN 9 2 54.40 1 9 A GLN 10 2 58.67 1 10 A PRO 11 2 80.39 1 11 A LEU 12 2 91.23 1 12 A ASP 13 2 94.27 1 13 A PHE 14 2 93.59 1 14 A THR 15 2 94.97 1 15 A GLN 16 2 92.30 1 16 A TYR 17 2 98.09 1 17 A ALA 18 2 98.29 1 18 A LYS 19 2 94.01 1 19 A ASN 20 2 96.54 1 20 A MET 21 2 97.68 1 21 A ARG 22 2 95.89 1 22 A LYS 23 2 92.26 1 23 A ASP 24 2 96.27 1 24 A LEU 25 2 96.99 1 25 A SER 26 2 93.73 1 26 A ASN 27 2 82.74 1 27 A GLN 28 2 77.54 1 28 A ASP 29 2 91.76 1 29 A ILE 30 2 95.73 1 30 A CYS 31 2 95.20 1 31 A LEU 32 2 92.31 1 32 A GLU 33 2 82.92 1 33 A ASP 34 2 92.23 1 34 A GLY 35 2 96.54 1 35 A ALA 36 2 96.11 1 36 A LEU 37 2 94.79 1 37 A ASN 38 2 95.11 1 38 A HIS 39 2 94.22 1 39 A SER 40 2 92.71 1 40 A TYR 41 2 95.96 1 41 A PHE 42 2 95.97 1 42 A LEU 43 2 93.34 1 43 A THR 44 2 88.21 1 44 A LYS 45 2 78.93 1 45 A LYS 46 2 77.70 1 46 A GLY 47 2 85.09 1 47 A GLN 48 2 81.62 1 48 A TYR 49 2 92.99 1 49 A TRP 50 2 95.78 1 50 A THR 51 2 93.81 1 51 A PRO 52 2 93.10 1 52 A LEU 53 2 91.07 1 53 A ASN 54 2 95.08 1 54 A GLN 55 2 95.79 1 55 A LYS 56 2 88.19 1 56 A ALA 57 2 98.52 1 57 A LEU 58 2 98.51 1 58 A GLN 59 2 96.46 1 59 A ARG 60 2 88.65 1 60 A GLY 61 2 98.67 1 61 A ILE 62 2 98.17 1 62 A GLU 63 2 95.87 1 63 A LEU 64 2 96.34 1 64 A PHE 65 2 97.74 1 65 A GLY 66 2 98.25 1 66 A VAL 67 2 97.84 1 67 A GLY 68 2 97.19 1 68 A ASN 69 2 95.45 1 69 A TRP 70 2 96.76 1 70 A LYS 71 2 87.60 1 71 A GLU 72 2 91.28 1 72 A ILE 73 2 98.29 1 73 A ASN 74 2 97.19 1 74 A TYR 75 2 85.27 1 75 A ASP 76 2 93.55 1 76 A GLU 77 2 94.99 1 77 A PHE 78 2 97.36 1 78 A SER 79 2 95.49 1 79 A GLY 80 2 96.36 1 80 A LYS 81 2 86.85 1 81 A ALA 82 2 94.66 1 82 A ASN 83 2 90.73 1 83 A ILE 84 2 89.33 1 84 A VAL 85 2 91.95 1 85 A GLU 86 2 93.42 1 86 A LEU 87 2 97.07 1 87 A GLU 88 2 89.28 1 88 A LEU 89 2 94.32 1 89 A ARG 90 2 94.07 1 90 A THR 91 2 97.83 1 91 A CYS 92 2 97.27 1 92 A MET 93 2 93.30 1 93 A ILE 94 2 98.07 1 94 A LEU 95 2 98.05 1 95 A GLY 96 2 97.58 1 96 A ILE 97 2 95.39 1 97 A ASN 98 2 91.65 1 98 A ASP 99 2 91.27 1 99 A ILE 100 2 94.64 1 100 A THR 101 2 90.80 1 101 A GLU 102 2 88.47 1 102 A TYR 103 2 97.40 1 103 A TYR 104 2 89.58 1 104 A GLY 105 2 97.24 1 105 A LYS 106 2 92.02 1 106 A LYS 107 2 96.83 1 107 A ILE 108 2 98.06 1 108 A SER 109 2 98.08 1 109 A GLU 110 2 90.58 1 110 A GLU 111 2 87.99 1 111 A GLU 112 2 87.38 1 112 A GLN 113 2 97.60 1 113 A GLU 114 2 85.37 1 114 A GLU 115 2 88.25 1 115 A ILE 116 2 97.97 1 116 A LYS 117 2 95.38 1 117 A LYS 118 2 91.17 1 118 A SER 119 2 95.67 1 119 A ASN 120 2 97.07 1 120 A ILE 121 2 96.03 1 121 A ALA 122 2 97.92 1 122 A LYS 123 2 88.73 1 123 A GLY 124 2 97.03 1 124 A LYS 125 2 89.48 1 125 A LYS 126 2 88.00 1 126 A GLU 127 2 92.77 1 127 A ASN 128 2 90.28 1 128 A LYS 129 2 90.19 1 129 A LEU 130 2 93.61 1 130 A LYS 131 2 86.46 1 131 A ASP 132 2 93.79 1 132 A ASN 133 2 89.38 1 133 A ILE 134 2 93.79 1 134 A TYR 135 2 95.11 1 135 A GLN 136 2 87.61 1 136 A LYS 137 2 77.80 1 137 A LEU 138 2 66.45 1 138 A GLN 139 2 55.23 1 139 A GLN 140 2 43.78 1 140 A MET 141 2 41.31 1 141 A GLN 142 2 30.01 1 142 B ASP 1 2 53.23 1 143 B ASP 2 2 61.73 1 144 B TYR 3 2 65.04 1 145 B LEU 4 2 77.15 1 146 B ASP 5 2 74.12 1 147 B ARG 6 2 68.62 1 148 B LEU 7 2 82.42 1 149 B PRO 8 2 82.35 1 150 B LYS 9 2 74.27 1 151 B SER 10 2 84.45 1 152 B LYS 11 2 80.63 1 153 B LYS 12 2 79.77 1 154 B GLY 13 2 91.25 1 155 B LEU 14 2 88.20 1 156 B GLN 15 2 84.47 1 157 B GLY 16 2 90.93 1 158 B LEU 17 2 89.87 1 159 B LEU 18 2 86.82 1 160 B GLN 19 2 85.23 1 161 B ASP 20 2 87.16 1 162 B ILE 21 2 89.06 1 163 B GLU 22 2 84.34 1 164 B LYS 23 2 83.57 1 165 B ARG 24 2 78.04 1 166 B ILE 25 2 85.96 1 167 B LEU 26 2 83.65 1 168 B HIS 27 2 86.21 1 169 B TYR 28 2 80.17 1 170 B LYS 29 2 88.53 1 171 B GLN 30 2 85.33 1 172 B LEU 31 2 90.69 1 173 B PHE 32 2 94.23 1 174 B PHE 33 2 95.16 1 175 B LYS 34 2 90.44 1 176 B GLU 35 2 85.90 1 177 B GLN 36 2 92.04 1 178 B ASN 37 2 91.93 1 179 B GLU 38 2 92.20 1 180 B ILE 39 2 91.44 1 181 B ALA 40 2 92.11 1 182 B ASN 41 2 89.54 1 183 B GLY 42 2 92.75 1 184 B LYS 43 2 90.83 1 185 B ARG 44 2 82.79 1 186 B SER 45 2 95.24 1 187 B MET 46 2 87.92 1 188 B VAL 47 2 96.65 1 189 B PRO 48 2 97.56 1 190 B ASP 49 2 94.04 1 191 B ASN 50 2 95.32 1 192 B SER 51 2 97.57 1 193 B ILE 52 2 98.04 1 194 B PRO 53 2 97.98 1 195 B ILE 54 2 97.69 1 196 B CYS 55 2 96.14 1 197 B SER 56 2 95.86 1 198 B ASP 57 2 96.17 1 199 B VAL 58 2 96.71 1 200 B THR 59 2 94.85 1 201 B LYS 60 2 90.15 1 202 B LEU 61 2 96.42 1 203 B ASN 62 2 95.28 1 204 B PHE 63 2 97.62 1 205 B GLN 64 2 94.24 1 206 B ALA 65 2 98.01 1 207 B LEU 66 2 97.89 1 208 B ILE 67 2 97.30 1 209 B ASP 68 2 96.88 1 210 B ALA 69 2 98.20 1 211 B GLN 70 2 96.95 1 212 B MET 71 2 94.33 1 213 B ARG 72 2 87.54 1 214 B HIS 73 2 94.98 1 215 B ALA 74 2 96.35 1 216 B GLY 75 2 95.62 1 217 B LYS 76 2 90.88 1 218 B MET 77 2 93.77 1 219 B PHE 78 2 98.20 1 220 B ASP 79 2 96.97 1 221 B VAL 80 2 98.22 1 222 B ILE 81 2 98.52 1 223 B MET 82 2 97.04 1 224 B MET 83 2 94.24 1 225 B ASP 84 2 97.07 1 226 B PRO 85 2 97.65 1 227 B PRO 86 2 96.58 1 228 B TRP 87 2 95.97 1 229 B GLN 88 2 87.13 1 230 B LEU 89 2 79.14 1 231 B SER 90 2 70.90 1 232 B SER 91 2 60.19 1 233 B SER 92 2 52.97 1 234 B GLN 93 2 48.52 1 235 B PRO 94 2 51.53 1 236 B SER 95 2 52.31 1 237 B ARG 96 2 43.03 1 238 B GLY 97 2 55.75 1 239 B VAL 98 2 58.71 1 240 B ALA 99 2 65.38 1 241 B ILE 100 2 69.32 1 242 B ALA 101 2 77.25 1 243 B TYR 102 2 81.15 1 244 B ASP 103 2 85.96 1 245 B SER 104 2 92.81 1 246 B LEU 105 2 95.78 1 247 B SER 106 2 95.97 1 248 B ASP 107 2 95.97 1 249 B GLU 108 2 87.04 1 250 B LYS 109 2 92.35 1 251 B ILE 110 2 97.36 1 252 B GLN 111 2 90.98 1 253 B ASN 112 2 92.49 1 254 B MET 113 2 96.67 1 255 B PRO 114 2 97.60 1 256 B ILE 115 2 97.44 1 257 B GLN 116 2 90.12 1 258 B SER 117 2 95.89 1 259 B LEU 118 2 97.18 1 260 B GLN 119 2 96.62 1 261 B GLN 120 2 86.89 1 262 B ASP 121 2 95.74 1 263 B GLY 122 2 98.03 1 264 B PHE 123 2 97.79 1 265 B ILE 124 2 97.98 1 266 B PHE 125 2 98.11 1 267 B VAL 126 2 98.45 1 268 B TRP 127 2 98.20 1 269 B ALA 128 2 96.26 1 270 B ILE 129 2 90.75 1 271 B ASN 130 2 87.80 1 272 B ALA 131 2 92.65 1 273 B LYS 132 2 94.04 1 274 B TYR 133 2 95.10 1 275 B ARG 134 2 82.12 1 276 B VAL 135 2 94.09 1 277 B THR 136 2 97.14 1 278 B ILE 137 2 97.00 1 279 B LYS 138 2 86.22 1 280 B MET 139 2 95.00 1 281 B ILE 140 2 96.28 1 282 B GLU 141 2 95.82 1 283 B ASN 142 2 94.59 1 284 B TRP 143 2 97.80 1 285 B GLY 144 2 97.61 1 286 B TYR 145 2 98.14 1 287 B LYS 146 2 88.77 1 288 B LEU 147 2 94.51 1 289 B VAL 148 2 95.45 1 290 B ASP 149 2 94.96 1 291 B GLU 150 2 94.68 1 292 B ILE 151 2 96.56 1 293 B THR 152 2 96.57 1 294 B TRP 153 2 96.99 1 295 B VAL 154 2 96.34 1 296 B LYS 155 2 90.97 1 297 B LYS 156 2 91.21 1 298 B THR 157 2 91.96 1 299 B VAL 158 2 89.26 1 300 B ASN 159 2 88.86 1 301 B GLY 160 2 92.63 1 302 B LYS 161 2 86.32 1 303 B ILE 162 2 91.25 1 304 B ALA 163 2 90.47 1 305 B LYS 164 2 77.33 1 306 B GLY 165 2 85.99 1 307 B HIS 166 2 75.18 1 308 B GLY 167 2 85.83 1 309 B PHE 168 2 77.84 1 310 B TYR 169 2 88.23 1 311 B LEU 170 2 91.71 1 312 B GLN 171 2 86.31 1 313 B HIS 172 2 86.30 1 314 B ALA 173 2 93.93 1 315 B LYS 174 2 91.11 1 316 B GLU 175 2 92.37 1 317 B SER 176 2 96.33 1 318 B CYS 177 2 98.34 1 319 B LEU 178 2 96.12 1 320 B ILE 179 2 97.23 1 321 B GLY 180 2 98.47 1 322 B VAL 181 2 96.17 1 323 B LYS 182 2 93.19 1 324 B GLY 183 2 96.14 1 325 B ASP 184 2 92.18 1 326 B VAL 185 2 92.73 1 327 B ASP 186 2 90.05 1 328 B ASN 187 2 86.26 1 329 B GLY 188 2 92.08 1 330 B ARG 189 2 82.48 1 331 B PHE 190 2 95.73 1 332 B LYS 191 2 88.46 1 333 B LYS 192 2 86.21 1 334 B ASN 193 2 91.51 1 335 B ILE 194 2 88.51 1 336 B ALA 195 2 93.45 1 337 B SER 196 2 93.73 1 338 B ASP 197 2 95.71 1 339 B VAL 198 2 95.85 1 340 B ILE 199 2 97.33 1 341 B PHE 200 2 93.62 1 342 B SER 201 2 96.33 1 343 B GLU 202 2 91.05 1 344 B ARG 203 2 80.34 1 345 B ARG 204 2 86.29 1 346 B GLY 205 2 92.68 1 347 B GLN 206 2 81.00 1 348 B SER 207 2 90.56 1 349 B GLN 208 2 92.60 1 350 B LYS 209 2 94.55 1 351 B PRO 210 2 97.64 1 352 B GLU 211 2 92.94 1 353 B GLU 212 2 94.44 1 354 B ILE 213 2 97.62 1 355 B TYR 214 2 98.02 1 356 B GLN 215 2 90.68 1 357 B TYR 216 2 93.46 1 358 B ILE 217 2 97.82 1 359 B ASN 218 2 90.73 1 360 B GLN 219 2 92.18 1 361 B LEU 220 2 96.89 1 362 B CYS 221 2 96.81 1 363 B PRO 222 2 95.13 1 364 B ASN 223 2 90.64 1 365 B GLY 224 2 96.61 1 366 B ASN 225 2 95.06 1 367 B TYR 226 2 97.39 1 368 B LEU 227 2 98.41 1 369 B GLU 228 2 97.93 1 370 B ILE 229 2 98.23 1 371 B PHE 230 2 98.01 1 372 B ALA 231 2 97.65 1 373 B ARG 232 2 90.80 1 374 B ARG 233 2 93.51 1 375 B ASN 234 2 94.00 1 376 B ASN 235 2 96.01 1 377 B LEU 236 2 97.71 1 378 B HIS 237 2 95.18 1 379 B ASP 238 2 96.32 1 380 B ASN 239 2 93.67 1 381 B TRP 240 2 98.36 1 382 B VAL 241 2 98.49 1 383 B SER 242 2 98.17 1 384 B ILE 243 2 98.16 1 385 B GLY 244 2 97.17 1 386 B ASN 245 2 93.69 1 387 B GLU 246 2 86.90 1 388 B LEU 247 2 94.88 1 389 C SAM . 2 96.33 1 390 # _ma_software_group.group_id 1 _ma_software_group.ordinal_id 1 _ma_software_group.software_id 1 # loop_ _ma_target_entity.data_id _ma_target_entity.entity_id _ma_target_entity.origin 1 1 . 1 2 . 1 3 . # loop_ _ma_target_entity_instance.asym_id _ma_target_entity_instance.details _ma_target_entity_instance.entity_id A . 1 B . 2 C . 3 # loop_ _pdbx_data_usage.details _pdbx_data_usage.id _pdbx_data_usage.type _pdbx_data_usage.url ;Non-commercial use only, by using this file you agree to the terms of use found at https://github.com/google-deepmind/alphafold3/blob/main/OUTPUT_TERMS_OF_USE.md. To request access to the AlphaFold 3 model parameters, follow the process set out at https://github.com/google-deepmind/alphafold3. You may only use these if received directly from Google. Use is subject to terms of use available at https://github.com/google-deepmind/alphafold3/blob/main/WEIGHTS_TERMS_OF_USE.md. ; 1 license https://github.com/google-deepmind/alphafold3/blob/main/OUTPUT_TERMS_OF_USE.md ;AlphaFold 3 and its output are not intended for, have not been validated for, and are not approved for clinical use. They are provided "as-is" without any warranty of any kind, whether expressed or implied. No warranty is given that use shall not infringe the rights of any third party. ; 2 disclaimer ? # _pdbx_nonpoly_scheme.asym_id C _pdbx_nonpoly_scheme.auth_seq_num 1 _pdbx_nonpoly_scheme.entity_id 3 _pdbx_nonpoly_scheme.mon_id SAM _pdbx_nonpoly_scheme.pdb_ins_code . _pdbx_nonpoly_scheme.pdb_seq_num 1 _pdbx_nonpoly_scheme.pdb_strand_id C # loop_ _pdbx_poly_seq_scheme.asym_id _pdbx_poly_seq_scheme.auth_seq_num _pdbx_poly_seq_scheme.entity_id _pdbx_poly_seq_scheme.hetero _pdbx_poly_seq_scheme.mon_id _pdbx_poly_seq_scheme.pdb_ins_code _pdbx_poly_seq_scheme.pdb_seq_num _pdbx_poly_seq_scheme.pdb_strand_id _pdbx_poly_seq_scheme.seq_id A 1 1 n MET . 1 A 1 A 2 1 n LYS . 2 A 2 A 3 1 n LYS . 3 A 3 A 4 1 n ASN . 4 A 4 A 5 1 n GLY . 5 A 5 A 6 1 n LYS . 6 A 6 A 7 1 n SER . 7 A 7 A 8 1 n GLN . 8 A 8 A 9 1 n ASN . 9 A 9 A 10 1 n GLN . 10 A 10 A 11 1 n PRO . 11 A 11 A 12 1 n LEU . 12 A 12 A 13 1 n ASP . 13 A 13 A 14 1 n PHE . 14 A 14 A 15 1 n THR . 15 A 15 A 16 1 n GLN . 16 A 16 A 17 1 n TYR . 17 A 17 A 18 1 n ALA . 18 A 18 A 19 1 n LYS . 19 A 19 A 20 1 n ASN . 20 A 20 A 21 1 n MET . 21 A 21 A 22 1 n ARG . 22 A 22 A 23 1 n LYS . 23 A 23 A 24 1 n ASP . 24 A 24 A 25 1 n LEU . 25 A 25 A 26 1 n SER . 26 A 26 A 27 1 n ASN . 27 A 27 A 28 1 n GLN . 28 A 28 A 29 1 n ASP . 29 A 29 A 30 1 n ILE . 30 A 30 A 31 1 n CYS . 31 A 31 A 32 1 n LEU . 32 A 32 A 33 1 n GLU . 33 A 33 A 34 1 n ASP . 34 A 34 A 35 1 n GLY . 35 A 35 A 36 1 n ALA . 36 A 36 A 37 1 n LEU . 37 A 37 A 38 1 n ASN . 38 A 38 A 39 1 n HIS . 39 A 39 A 40 1 n SER . 40 A 40 A 41 1 n TYR . 41 A 41 A 42 1 n PHE . 42 A 42 A 43 1 n LEU . 43 A 43 A 44 1 n THR . 44 A 44 A 45 1 n LYS . 45 A 45 A 46 1 n LYS . 46 A 46 A 47 1 n GLY . 47 A 47 A 48 1 n GLN . 48 A 48 A 49 1 n TYR . 49 A 49 A 50 1 n TRP . 50 A 50 A 51 1 n THR . 51 A 51 A 52 1 n PRO . 52 A 52 A 53 1 n LEU . 53 A 53 A 54 1 n ASN . 54 A 54 A 55 1 n GLN . 55 A 55 A 56 1 n LYS . 56 A 56 A 57 1 n ALA . 57 A 57 A 58 1 n LEU . 58 A 58 A 59 1 n GLN . 59 A 59 A 60 1 n ARG . 60 A 60 A 61 1 n GLY . 61 A 61 A 62 1 n ILE . 62 A 62 A 63 1 n GLU . 63 A 63 A 64 1 n LEU . 64 A 64 A 65 1 n PHE . 65 A 65 A 66 1 n GLY . 66 A 66 A 67 1 n VAL . 67 A 67 A 68 1 n GLY . 68 A 68 A 69 1 n ASN . 69 A 69 A 70 1 n TRP . 70 A 70 A 71 1 n LYS . 71 A 71 A 72 1 n GLU . 72 A 72 A 73 1 n ILE . 73 A 73 A 74 1 n ASN . 74 A 74 A 75 1 n TYR . 75 A 75 A 76 1 n ASP . 76 A 76 A 77 1 n GLU . 77 A 77 A 78 1 n PHE . 78 A 78 A 79 1 n SER . 79 A 79 A 80 1 n GLY . 80 A 80 A 81 1 n LYS . 81 A 81 A 82 1 n ALA . 82 A 82 A 83 1 n ASN . 83 A 83 A 84 1 n ILE . 84 A 84 A 85 1 n VAL . 85 A 85 A 86 1 n GLU . 86 A 86 A 87 1 n LEU . 87 A 87 A 88 1 n GLU . 88 A 88 A 89 1 n LEU . 89 A 89 A 90 1 n ARG . 90 A 90 A 91 1 n THR . 91 A 91 A 92 1 n CYS . 92 A 92 A 93 1 n MET . 93 A 93 A 94 1 n ILE . 94 A 94 A 95 1 n LEU . 95 A 95 A 96 1 n GLY . 96 A 96 A 97 1 n ILE . 97 A 97 A 98 1 n ASN . 98 A 98 A 99 1 n ASP . 99 A 99 A 100 1 n ILE . 100 A 100 A 101 1 n THR . 101 A 101 A 102 1 n GLU . 102 A 102 A 103 1 n TYR . 103 A 103 A 104 1 n TYR . 104 A 104 A 105 1 n GLY . 105 A 105 A 106 1 n LYS . 106 A 106 A 107 1 n LYS . 107 A 107 A 108 1 n ILE . 108 A 108 A 109 1 n SER . 109 A 109 A 110 1 n GLU . 110 A 110 A 111 1 n GLU . 111 A 111 A 112 1 n GLU . 112 A 112 A 113 1 n GLN . 113 A 113 A 114 1 n GLU . 114 A 114 A 115 1 n GLU . 115 A 115 A 116 1 n ILE . 116 A 116 A 117 1 n LYS . 117 A 117 A 118 1 n LYS . 118 A 118 A 119 1 n SER . 119 A 119 A 120 1 n ASN . 120 A 120 A 121 1 n ILE . 121 A 121 A 122 1 n ALA . 122 A 122 A 123 1 n LYS . 123 A 123 A 124 1 n GLY . 124 A 124 A 125 1 n LYS . 125 A 125 A 126 1 n LYS . 126 A 126 A 127 1 n GLU . 127 A 127 A 128 1 n ASN . 128 A 128 A 129 1 n LYS . 129 A 129 A 130 1 n LEU . 130 A 130 A 131 1 n LYS . 131 A 131 A 132 1 n ASP . 132 A 132 A 133 1 n ASN . 133 A 133 A 134 1 n ILE . 134 A 134 A 135 1 n TYR . 135 A 135 A 136 1 n GLN . 136 A 136 A 137 1 n LYS . 137 A 137 A 138 1 n LEU . 138 A 138 A 139 1 n GLN . 139 A 139 A 140 1 n GLN . 140 A 140 A 141 1 n MET . 141 A 141 A 142 1 n GLN . 142 A 142 B 1 2 n ASP . 1 B 1 B 2 2 n ASP . 2 B 2 B 3 2 n TYR . 3 B 3 B 4 2 n LEU . 4 B 4 B 5 2 n ASP . 5 B 5 B 6 2 n ARG . 6 B 6 B 7 2 n LEU . 7 B 7 B 8 2 n PRO . 8 B 8 B 9 2 n LYS . 9 B 9 B 10 2 n SER . 10 B 10 B 11 2 n LYS . 11 B 11 B 12 2 n LYS . 12 B 12 B 13 2 n GLY . 13 B 13 B 14 2 n LEU . 14 B 14 B 15 2 n GLN . 15 B 15 B 16 2 n GLY . 16 B 16 B 17 2 n LEU . 17 B 17 B 18 2 n LEU . 18 B 18 B 19 2 n GLN . 19 B 19 B 20 2 n ASP . 20 B 20 B 21 2 n ILE . 21 B 21 B 22 2 n GLU . 22 B 22 B 23 2 n LYS . 23 B 23 B 24 2 n ARG . 24 B 24 B 25 2 n ILE . 25 B 25 B 26 2 n LEU . 26 B 26 B 27 2 n HIS . 27 B 27 B 28 2 n TYR . 28 B 28 B 29 2 n LYS . 29 B 29 B 30 2 n GLN . 30 B 30 B 31 2 n LEU . 31 B 31 B 32 2 n PHE . 32 B 32 B 33 2 n PHE . 33 B 33 B 34 2 n LYS . 34 B 34 B 35 2 n GLU . 35 B 35 B 36 2 n GLN . 36 B 36 B 37 2 n ASN . 37 B 37 B 38 2 n GLU . 38 B 38 B 39 2 n ILE . 39 B 39 B 40 2 n ALA . 40 B 40 B 41 2 n ASN . 41 B 41 B 42 2 n GLY . 42 B 42 B 43 2 n LYS . 43 B 43 B 44 2 n ARG . 44 B 44 B 45 2 n SER . 45 B 45 B 46 2 n MET . 46 B 46 B 47 2 n VAL . 47 B 47 B 48 2 n PRO . 48 B 48 B 49 2 n ASP . 49 B 49 B 50 2 n ASN . 50 B 50 B 51 2 n SER . 51 B 51 B 52 2 n ILE . 52 B 52 B 53 2 n PRO . 53 B 53 B 54 2 n ILE . 54 B 54 B 55 2 n CYS . 55 B 55 B 56 2 n SER . 56 B 56 B 57 2 n ASP . 57 B 57 B 58 2 n VAL . 58 B 58 B 59 2 n THR . 59 B 59 B 60 2 n LYS . 60 B 60 B 61 2 n LEU . 61 B 61 B 62 2 n ASN . 62 B 62 B 63 2 n PHE . 63 B 63 B 64 2 n GLN . 64 B 64 B 65 2 n ALA . 65 B 65 B 66 2 n LEU . 66 B 66 B 67 2 n ILE . 67 B 67 B 68 2 n ASP . 68 B 68 B 69 2 n ALA . 69 B 69 B 70 2 n GLN . 70 B 70 B 71 2 n MET . 71 B 71 B 72 2 n ARG . 72 B 72 B 73 2 n HIS . 73 B 73 B 74 2 n ALA . 74 B 74 B 75 2 n GLY . 75 B 75 B 76 2 n LYS . 76 B 76 B 77 2 n MET . 77 B 77 B 78 2 n PHE . 78 B 78 B 79 2 n ASP . 79 B 79 B 80 2 n VAL . 80 B 80 B 81 2 n ILE . 81 B 81 B 82 2 n MET . 82 B 82 B 83 2 n MET . 83 B 83 B 84 2 n ASP . 84 B 84 B 85 2 n PRO . 85 B 85 B 86 2 n PRO . 86 B 86 B 87 2 n TRP . 87 B 87 B 88 2 n GLN . 88 B 88 B 89 2 n LEU . 89 B 89 B 90 2 n SER . 90 B 90 B 91 2 n SER . 91 B 91 B 92 2 n SER . 92 B 92 B 93 2 n GLN . 93 B 93 B 94 2 n PRO . 94 B 94 B 95 2 n SER . 95 B 95 B 96 2 n ARG . 96 B 96 B 97 2 n GLY . 97 B 97 B 98 2 n VAL . 98 B 98 B 99 2 n ALA . 99 B 99 B 100 2 n ILE . 100 B 100 B 101 2 n ALA . 101 B 101 B 102 2 n TYR . 102 B 102 B 103 2 n ASP . 103 B 103 B 104 2 n SER . 104 B 104 B 105 2 n LEU . 105 B 105 B 106 2 n SER . 106 B 106 B 107 2 n ASP . 107 B 107 B 108 2 n GLU . 108 B 108 B 109 2 n LYS . 109 B 109 B 110 2 n ILE . 110 B 110 B 111 2 n GLN . 111 B 111 B 112 2 n ASN . 112 B 112 B 113 2 n MET . 113 B 113 B 114 2 n PRO . 114 B 114 B 115 2 n ILE . 115 B 115 B 116 2 n GLN . 116 B 116 B 117 2 n SER . 117 B 117 B 118 2 n LEU . 118 B 118 B 119 2 n GLN . 119 B 119 B 120 2 n GLN . 120 B 120 B 121 2 n ASP . 121 B 121 B 122 2 n GLY . 122 B 122 B 123 2 n PHE . 123 B 123 B 124 2 n ILE . 124 B 124 B 125 2 n PHE . 125 B 125 B 126 2 n VAL . 126 B 126 B 127 2 n TRP . 127 B 127 B 128 2 n ALA . 128 B 128 B 129 2 n ILE . 129 B 129 B 130 2 n ASN . 130 B 130 B 131 2 n ALA . 131 B 131 B 132 2 n LYS . 132 B 132 B 133 2 n TYR . 133 B 133 B 134 2 n ARG . 134 B 134 B 135 2 n VAL . 135 B 135 B 136 2 n THR . 136 B 136 B 137 2 n ILE . 137 B 137 B 138 2 n LYS . 138 B 138 B 139 2 n MET . 139 B 139 B 140 2 n ILE . 140 B 140 B 141 2 n GLU . 141 B 141 B 142 2 n ASN . 142 B 142 B 143 2 n TRP . 143 B 143 B 144 2 n GLY . 144 B 144 B 145 2 n TYR . 145 B 145 B 146 2 n LYS . 146 B 146 B 147 2 n LEU . 147 B 147 B 148 2 n VAL . 148 B 148 B 149 2 n ASP . 149 B 149 B 150 2 n GLU . 150 B 150 B 151 2 n ILE . 151 B 151 B 152 2 n THR . 152 B 152 B 153 2 n TRP . 153 B 153 B 154 2 n VAL . 154 B 154 B 155 2 n LYS . 155 B 155 B 156 2 n LYS . 156 B 156 B 157 2 n THR . 157 B 157 B 158 2 n VAL . 158 B 158 B 159 2 n ASN . 159 B 159 B 160 2 n GLY . 160 B 160 B 161 2 n LYS . 161 B 161 B 162 2 n ILE . 162 B 162 B 163 2 n ALA . 163 B 163 B 164 2 n LYS . 164 B 164 B 165 2 n GLY . 165 B 165 B 166 2 n HIS . 166 B 166 B 167 2 n GLY . 167 B 167 B 168 2 n PHE . 168 B 168 B 169 2 n TYR . 169 B 169 B 170 2 n LEU . 170 B 170 B 171 2 n GLN . 171 B 171 B 172 2 n HIS . 172 B 172 B 173 2 n ALA . 173 B 173 B 174 2 n LYS . 174 B 174 B 175 2 n GLU . 175 B 175 B 176 2 n SER . 176 B 176 B 177 2 n CYS . 177 B 177 B 178 2 n LEU . 178 B 178 B 179 2 n ILE . 179 B 179 B 180 2 n GLY . 180 B 180 B 181 2 n VAL . 181 B 181 B 182 2 n LYS . 182 B 182 B 183 2 n GLY . 183 B 183 B 184 2 n ASP . 184 B 184 B 185 2 n VAL . 185 B 185 B 186 2 n ASP . 186 B 186 B 187 2 n ASN . 187 B 187 B 188 2 n GLY . 188 B 188 B 189 2 n ARG . 189 B 189 B 190 2 n PHE . 190 B 190 B 191 2 n LYS . 191 B 191 B 192 2 n LYS . 192 B 192 B 193 2 n ASN . 193 B 193 B 194 2 n ILE . 194 B 194 B 195 2 n ALA . 195 B 195 B 196 2 n SER . 196 B 196 B 197 2 n ASP . 197 B 197 B 198 2 n VAL . 198 B 198 B 199 2 n ILE . 199 B 199 B 200 2 n PHE . 200 B 200 B 201 2 n SER . 201 B 201 B 202 2 n GLU . 202 B 202 B 203 2 n ARG . 203 B 203 B 204 2 n ARG . 204 B 204 B 205 2 n GLY . 205 B 205 B 206 2 n GLN . 206 B 206 B 207 2 n SER . 207 B 207 B 208 2 n GLN . 208 B 208 B 209 2 n LYS . 209 B 209 B 210 2 n PRO . 210 B 210 B 211 2 n GLU . 211 B 211 B 212 2 n GLU . 212 B 212 B 213 2 n ILE . 213 B 213 B 214 2 n TYR . 214 B 214 B 215 2 n GLN . 215 B 215 B 216 2 n TYR . 216 B 216 B 217 2 n ILE . 217 B 217 B 218 2 n ASN . 218 B 218 B 219 2 n GLN . 219 B 219 B 220 2 n LEU . 220 B 220 B 221 2 n CYS . 221 B 221 B 222 2 n PRO . 222 B 222 B 223 2 n ASN . 223 B 223 B 224 2 n GLY . 224 B 224 B 225 2 n ASN . 225 B 225 B 226 2 n TYR . 226 B 226 B 227 2 n LEU . 227 B 227 B 228 2 n GLU . 228 B 228 B 229 2 n ILE . 229 B 229 B 230 2 n PHE . 230 B 230 B 231 2 n ALA . 231 B 231 B 232 2 n ARG . 232 B 232 B 233 2 n ARG . 233 B 233 B 234 2 n ASN . 234 B 234 B 235 2 n ASN . 235 B 235 B 236 2 n LEU . 236 B 236 B 237 2 n HIS . 237 B 237 B 238 2 n ASP . 238 B 238 B 239 2 n ASN . 239 B 239 B 240 2 n TRP . 240 B 240 B 241 2 n VAL . 241 B 241 B 242 2 n SER . 242 B 242 B 243 2 n ILE . 243 B 243 B 244 2 n GLY . 244 B 244 B 245 2 n ASN . 245 B 245 B 246 2 n GLU . 246 B 246 B 247 2 n LEU . 247 B 247 # _software.classification other _software.date ? _software.description "Structure prediction" _software.name AlphaFold _software.pdbx_ordinal 1 _software.type package _software.version "AlphaFold-beta-20231127 (e807fd846049899dfdec5ca44da98c95d67dbcda1ded4e3a9b5f8a9fca437aa0)" # loop_ _struct_asym.entity_id _struct_asym.id 1 A 2 B 3 C # 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.auth_seq_id _atom_site.auth_asym_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . MET A 1 1 ? -42.744 -32.225 -5.960 1.00 30.82 1 A 1 ATOM 2 C CA . MET A 1 1 ? -42.158 -30.930 -6.368 1.00 39.50 1 A 1 ATOM 3 C C . MET A 1 1 ? -40.638 -31.043 -6.297 1.00 45.00 1 A 1 ATOM 4 O O . MET A 1 1 ? -40.088 -31.050 -5.207 1.00 44.01 1 A 1 ATOM 5 C CB . MET A 1 1 ? -42.640 -29.807 -5.443 1.00 38.43 1 A 1 ATOM 6 C CG . MET A 1 1 ? -44.085 -29.394 -5.741 1.00 36.96 1 A 1 ATOM 7 S SD . MET A 1 1 ? -44.772 -28.322 -4.468 1.00 34.84 1 A 1 ATOM 8 C CE . MET A 1 1 ? -46.184 -27.586 -5.351 1.00 29.81 1 A 1 ATOM 9 N N . LYS A 1 2 ? -39.945 -31.236 -7.432 1.00 36.89 2 A 1 ATOM 10 C CA . LYS A 1 2 ? -38.474 -31.279 -7.464 1.00 39.30 2 A 1 ATOM 11 C C . LYS A 1 2 ? -37.986 -29.864 -7.148 1.00 38.69 2 A 1 ATOM 12 O O . LYS A 1 2 ? -38.255 -28.955 -7.927 1.00 36.63 2 A 1 ATOM 13 C CB . LYS A 1 2 ? -37.956 -31.758 -8.834 1.00 38.51 2 A 1 ATOM 14 C CG . LYS A 1 2 ? -38.084 -33.281 -9.037 1.00 35.39 2 A 1 ATOM 15 C CD . LYS A 1 2 ? -37.523 -33.724 -10.401 1.00 33.34 2 A 1 ATOM 16 C CE . LYS A 1 2 ? -37.589 -35.253 -10.558 1.00 28.65 2 A 1 ATOM 17 N NZ . LYS A 1 2 ? -37.079 -35.724 -11.873 1.00 25.84 2 A 1 ATOM 18 N N . LYS A 1 3 ? -37.327 -29.667 -6.007 1.00 35.82 3 A 1 ATOM 19 C CA . LYS A 1 3 ? -36.614 -28.417 -5.734 1.00 37.23 3 A 1 ATOM 20 C C . LYS A 1 3 ? -35.553 -28.283 -6.828 1.00 36.14 3 A 1 ATOM 21 O O . LYS A 1 3 ? -34.561 -29.007 -6.803 1.00 33.11 3 A 1 ATOM 22 C CB . LYS A 1 3 ? -35.982 -28.418 -4.324 1.00 36.28 3 A 1 ATOM 23 C CG . LYS A 1 3 ? -36.992 -28.129 -3.194 1.00 34.31 3 A 1 ATOM 24 C CD . LYS A 1 3 ? -36.282 -28.061 -1.827 1.00 32.82 3 A 1 ATOM 25 C CE . LYS A 1 3 ? -37.253 -27.679 -0.694 1.00 28.87 3 A 1 ATOM 26 N NZ . LYS A 1 3 ? -36.586 -27.595 0.634 1.00 26.65 3 A 1 ATOM 27 N N . ASN A 1 4 ? -35.778 -27.412 -7.806 1.00 38.83 4 A 1 ATOM 28 C CA . ASN A 1 4 ? -34.779 -26.994 -8.788 1.00 38.79 4 A 1 ATOM 29 C C . ASN A 1 4 ? -33.709 -26.157 -8.069 1.00 38.37 4 A 1 ATOM 30 O O . ASN A 1 4 ? -33.558 -24.967 -8.307 1.00 34.90 4 A 1 ATOM 31 C CB . ASN A 1 4 ? -35.456 -26.239 -9.953 1.00 36.10 4 A 1 ATOM 32 C CG . ASN A 1 4 ? -35.957 -27.136 -11.074 1.00 31.52 4 A 1 ATOM 33 O OD1 . ASN A 1 4 ? -35.648 -28.306 -11.160 1.00 30.44 4 A 1 ATOM 34 N ND2 . ASN A 1 4 ? -36.732 -26.591 -11.991 1.00 28.89 4 A 1 ATOM 35 N N . GLY A 1 5 ? -32.994 -26.778 -7.151 1.00 39.61 5 A 1 ATOM 36 C CA . GLY A 1 5 ? -31.852 -26.214 -6.439 1.00 39.89 5 A 1 ATOM 37 C C . GLY A 1 5 ? -30.606 -26.090 -7.306 1.00 40.70 5 A 1 ATOM 38 O O . GLY A 1 5 ? -29.505 -26.183 -6.785 1.00 37.62 5 A 1 ATOM 39 N N . LYS A 1 6 ? -30.756 -25.902 -8.624 1.00 38.96 6 A 1 ATOM 40 C CA . LYS A 1 6 ? -29.691 -25.338 -9.447 1.00 39.73 6 A 1 ATOM 41 C C . LYS A 1 6 ? -29.548 -23.864 -9.053 1.00 40.14 6 A 1 ATOM 42 O O . LYS A 1 6 ? -29.924 -22.979 -9.816 1.00 37.70 6 A 1 ATOM 43 C CB . LYS A 1 6 ? -29.964 -25.508 -10.954 1.00 38.40 6 A 1 ATOM 44 C CG . LYS A 1 6 ? -29.795 -26.946 -11.470 1.00 35.40 6 A 1 ATOM 45 C CD . LYS A 1 6 ? -29.931 -26.950 -13.000 1.00 33.02 6 A 1 ATOM 46 C CE . LYS A 1 6 ? -29.728 -28.351 -13.585 1.00 28.63 6 A 1 ATOM 47 N NZ . LYS A 1 6 ? -29.770 -28.332 -15.071 1.00 25.95 6 A 1 ATOM 48 N N . SER A 1 7 ? -29.001 -23.595 -7.868 1.00 47.42 7 A 1 ATOM 49 C CA . SER A 1 7 ? -28.216 -22.387 -7.661 1.00 48.43 7 A 1 ATOM 50 C C . SER A 1 7 ? -27.057 -22.487 -8.652 1.00 49.63 7 A 1 ATOM 51 O O . SER A 1 7 ? -26.028 -23.102 -8.367 1.00 46.87 7 A 1 ATOM 52 C CB . SER A 1 7 ? -27.732 -22.278 -6.205 1.00 45.25 7 A 1 ATOM 53 O OG . SER A 1 7 ? -27.066 -23.456 -5.799 1.00 41.16 7 A 1 ATOM 54 N N . GLN A 1 8 ? -27.291 -22.020 -9.891 1.00 45.30 8 A 1 ATOM 55 C CA . GLN A 1 8 ? -26.218 -21.803 -10.839 1.00 47.13 8 A 1 ATOM 56 C C . GLN A 1 8 ? -25.314 -20.793 -10.142 1.00 51.12 8 A 1 ATOM 57 O O . GLN A 1 8 ? -25.695 -19.633 -10.000 1.00 48.07 8 A 1 ATOM 58 C CB . GLN A 1 8 ? -26.769 -21.259 -12.167 1.00 42.16 8 A 1 ATOM 59 C CG . GLN A 1 8 ? -27.477 -22.349 -12.997 1.00 37.63 8 A 1 ATOM 60 C CD . GLN A 1 8 ? -28.017 -21.820 -14.330 1.00 33.28 8 A 1 ATOM 61 O OE1 . GLN A 1 8 ? -28.148 -20.637 -14.564 1.00 30.90 8 A 1 ATOM 62 N NE2 . GLN A 1 8 ? -28.376 -22.676 -15.255 1.00 31.38 8 A 1 ATOM 63 N N . ASN A 1 9 ? -24.166 -21.268 -9.638 1.00 60.69 9 A 1 ATOM 64 C CA . ASN A 1 9 ? -23.111 -20.399 -9.137 1.00 60.92 9 A 1 ATOM 65 C C . ASN A 1 9 ? -22.680 -19.531 -10.321 1.00 63.14 9 A 1 ATOM 66 O O . ASN A 1 9 ? -21.845 -19.951 -11.124 1.00 59.21 9 A 1 ATOM 67 C CB . ASN A 1 9 ? -21.939 -21.240 -8.583 1.00 54.93 9 A 1 ATOM 68 C CG . ASN A 1 9 ? -22.110 -21.670 -7.129 1.00 48.65 9 A 1 ATOM 69 O OD1 . ASN A 1 9 ? -22.858 -21.107 -6.363 1.00 45.27 9 A 1 ATOM 70 N ND2 . ASN A 1 9 ? -21.379 -22.678 -6.696 1.00 42.41 9 A 1 ATOM 71 N N . GLN A 1 10 ? -23.339 -18.380 -10.495 1.00 66.54 10 A 1 ATOM 72 C CA . GLN A 1 10 ? -22.904 -17.405 -11.472 1.00 70.31 10 A 1 ATOM 73 C C . GLN A 1 10 ? -21.456 -17.054 -11.137 1.00 74.23 10 A 1 ATOM 74 O O . GLN A 1 10 ? -21.113 -16.952 -9.949 1.00 69.50 10 A 1 ATOM 75 C CB . GLN A 1 10 ? -23.808 -16.169 -11.478 1.00 62.75 10 A 1 ATOM 76 C CG . GLN A 1 10 ? -25.114 -16.443 -12.245 1.00 53.92 10 A 1 ATOM 77 C CD . GLN A 1 10 ? -25.964 -15.182 -12.421 1.00 47.12 10 A 1 ATOM 78 O OE1 . GLN A 1 10 ? -25.842 -14.196 -11.722 1.00 43.18 10 A 1 ATOM 79 N NE2 . GLN A 1 10 ? -26.869 -15.171 -13.372 1.00 40.49 10 A 1 ATOM 80 N N . PRO A 1 11 ? -20.588 -16.942 -12.155 1.00 81.73 11 A 1 ATOM 81 C CA . PRO A 1 11 ? -19.212 -16.546 -11.921 1.00 84.43 11 A 1 ATOM 82 C C . PRO A 1 11 ? -19.205 -15.213 -11.167 1.00 88.07 11 A 1 ATOM 83 O O . PRO A 1 11 ? -19.975 -14.302 -11.489 1.00 84.57 11 A 1 ATOM 84 C CB . PRO A 1 11 ? -18.570 -16.463 -13.310 1.00 77.35 11 A 1 ATOM 85 C CG . PRO A 1 11 ? -19.754 -16.237 -14.248 1.00 71.81 11 A 1 ATOM 86 C CD . PRO A 1 11 ? -20.886 -17.000 -13.574 1.00 74.78 11 A 1 ATOM 87 N N . LEU A 1 12 ? -18.366 -15.120 -10.154 1.00 89.09 12 A 1 ATOM 88 C CA . LEU A 1 12 ? -18.233 -13.911 -9.348 1.00 92.88 12 A 1 ATOM 89 C C . LEU A 1 12 ? -17.786 -12.747 -10.245 1.00 94.88 12 A 1 ATOM 90 O O . LEU A 1 12 ? -16.754 -12.844 -10.911 1.00 93.46 12 A 1 ATOM 91 C CB . LEU A 1 12 ? -17.236 -14.195 -8.210 1.00 90.87 12 A 1 ATOM 92 C CG . LEU A 1 12 ? -17.018 -13.020 -7.234 1.00 91.35 12 A 1 ATOM 93 C CD1 . LEU A 1 12 ? -18.290 -12.689 -6.451 1.00 88.57 12 A 1 ATOM 94 C CD2 . LEU A 1 12 ? -15.934 -13.399 -6.222 1.00 88.73 12 A 1 ATOM 95 N N . ASP A 1 13 ? -18.537 -11.656 -10.241 1.00 95.27 13 A 1 ATOM 96 C CA . ASP A 1 13 ? -18.063 -10.403 -10.825 1.00 96.28 13 A 1 ATOM 97 C C . ASP A 1 13 ? -16.996 -9.810 -9.898 1.00 97.03 13 A 1 ATOM 98 O O . ASP A 1 13 ? -17.295 -9.162 -8.894 1.00 96.52 13 A 1 ATOM 99 C CB . ASP A 1 13 ? -19.225 -9.431 -11.074 1.00 94.97 13 A 1 ATOM 100 C CG . ASP A 1 13 ? -18.772 -8.077 -11.654 1.00 94.12 13 A 1 ATOM 101 O OD1 . ASP A 1 13 ? -17.549 -7.808 -11.735 1.00 90.59 13 A 1 ATOM 102 O OD2 . ASP A 1 13 ? -19.666 -7.271 -11.991 1.00 89.39 13 A 1 ATOM 103 N N . PHE A 1 14 ? -15.732 -10.062 -10.230 1.00 96.99 14 A 1 ATOM 104 C CA . PHE A 1 14 ? -14.601 -9.610 -9.428 1.00 97.10 14 A 1 ATOM 105 C C . PHE A 1 14 ? -14.475 -8.085 -9.362 1.00 97.59 14 A 1 ATOM 106 O O . PHE A 1 14 ? -13.979 -7.570 -8.363 1.00 97.14 14 A 1 ATOM 107 C CB . PHE A 1 14 ? -13.310 -10.239 -9.957 1.00 96.02 14 A 1 ATOM 108 C CG . PHE A 1 14 ? -13.127 -11.679 -9.529 1.00 93.96 14 A 1 ATOM 109 C CD1 . PHE A 1 14 ? -12.736 -11.969 -8.209 1.00 91.22 14 A 1 ATOM 110 C CD2 . PHE A 1 14 ? -13.340 -12.729 -10.437 1.00 91.21 14 A 1 ATOM 111 C CE1 . PHE A 1 14 ? -12.545 -13.301 -7.798 1.00 89.80 14 A 1 ATOM 112 C CE2 . PHE A 1 14 ? -13.150 -14.062 -10.033 1.00 89.50 14 A 1 ATOM 113 C CZ . PHE A 1 14 ? -12.750 -14.347 -8.714 1.00 88.96 14 A 1 ATOM 114 N N . THR A 1 15 ? -14.948 -7.350 -10.370 1.00 97.37 15 A 1 ATOM 115 C CA . THR A 1 15 ? -14.918 -5.881 -10.333 1.00 97.21 15 A 1 ATOM 116 C C . THR A 1 15 ? -15.908 -5.355 -9.298 1.00 97.64 15 A 1 ATOM 117 O O . THR A 1 15 ? -15.550 -4.526 -8.459 1.00 97.16 15 A 1 ATOM 118 C CB . THR A 1 15 ? -15.215 -5.285 -11.714 1.00 96.16 15 A 1 ATOM 119 O OG1 . THR A 1 15 ? -14.239 -5.731 -12.632 1.00 90.15 15 A 1 ATOM 120 C CG2 . THR A 1 15 ? -15.154 -3.760 -11.717 1.00 89.10 15 A 1 ATOM 121 N N . GLN A 1 16 ? -17.133 -5.874 -9.309 1.00 97.23 16 A 1 ATOM 122 C CA . GLN A 1 16 ? -18.135 -5.495 -8.318 1.00 97.40 16 A 1 ATOM 123 C C . GLN A 1 16 ? -17.789 -6.025 -6.924 1.00 97.85 16 A 1 ATOM 124 O O . GLN A 1 16 ? -17.927 -5.302 -5.939 1.00 97.76 16 A 1 ATOM 125 C CB . GLN A 1 16 ? -19.524 -5.961 -8.784 1.00 96.82 16 A 1 ATOM 126 C CG . GLN A 1 16 ? -20.643 -5.374 -7.906 1.00 91.55 16 A 1 ATOM 127 C CD . GLN A 1 16 ? -20.623 -3.837 -7.898 1.00 90.08 16 A 1 ATOM 128 O OE1 . GLN A 1 16 ? -20.565 -3.188 -8.926 1.00 82.26 16 A 1 ATOM 129 N NE2 . GLN A 1 16 ? -20.635 -3.208 -6.747 1.00 79.72 16 A 1 ATOM 130 N N . TYR A 1 17 ? -17.274 -7.254 -6.846 1.00 97.90 17 A 1 ATOM 131 C CA . TYR A 1 17 ? -16.752 -7.837 -5.612 1.00 98.19 17 A 1 ATOM 132 C C . TYR A 1 17 ? -15.667 -6.948 -4.989 1.00 98.43 17 A 1 ATOM 133 O O . TYR A 1 17 ? -15.777 -6.584 -3.822 1.00 98.31 17 A 1 ATOM 134 C CB . TYR A 1 17 ? -16.214 -9.243 -5.902 1.00 98.08 17 A 1 ATOM 135 C CG . TYR A 1 17 ? -15.377 -9.831 -4.786 1.00 98.38 17 A 1 ATOM 136 C CD1 . TYR A 1 17 ? -13.972 -9.879 -4.898 1.00 97.98 17 A 1 ATOM 137 C CD2 . TYR A 1 17 ? -15.995 -10.322 -3.619 1.00 98.13 17 A 1 ATOM 138 C CE1 . TYR A 1 17 ? -13.195 -10.424 -3.865 1.00 97.98 17 A 1 ATOM 139 C CE2 . TYR A 1 17 ? -15.224 -10.871 -2.581 1.00 97.94 17 A 1 ATOM 140 C CZ . TYR A 1 17 ? -13.823 -10.925 -2.711 1.00 98.13 17 A 1 ATOM 141 O OH . TYR A 1 17 ? -13.069 -11.476 -1.707 1.00 97.60 17 A 1 ATOM 142 N N . ALA A 1 18 ? -14.671 -6.533 -5.764 1.00 98.43 18 A 1 ATOM 143 C CA . ALA A 1 18 ? -13.591 -5.687 -5.265 1.00 98.37 18 A 1 ATOM 144 C C . ALA A 1 18 ? -14.110 -4.331 -4.764 1.00 98.43 18 A 1 ATOM 145 O O . ALA A 1 18 ? -13.691 -3.871 -3.701 1.00 98.18 18 A 1 ATOM 146 C CB . ALA A 1 18 ? -12.532 -5.529 -6.361 1.00 98.05 18 A 1 ATOM 147 N N . LYS A 1 19 ? -15.049 -3.712 -5.472 1.00 98.24 19 A 1 ATOM 148 C CA . LYS A 1 19 ? -15.701 -2.473 -5.015 1.00 98.18 19 A 1 ATOM 149 C C . LYS A 1 19 ? -16.438 -2.673 -3.689 1.00 98.19 19 A 1 ATOM 150 O O . LYS A 1 19 ? -16.230 -1.896 -2.763 1.00 97.81 19 A 1 ATOM 151 C CB . LYS A 1 19 ? -16.666 -1.936 -6.082 1.00 97.83 19 A 1 ATOM 152 C CG . LYS A 1 19 ? -15.938 -1.296 -7.272 1.00 95.41 19 A 1 ATOM 153 C CD . LYS A 1 19 ? -16.958 -0.670 -8.225 1.00 93.71 19 A 1 ATOM 154 C CE . LYS A 1 19 ? -16.253 0.086 -9.350 1.00 86.97 19 A 1 ATOM 155 N NZ . LYS A 1 19 ? -17.145 1.123 -9.933 1.00 79.74 19 A 1 ATOM 156 N N . ASN A 1 20 ? -17.238 -3.723 -3.592 1.00 98.20 20 A 1 ATOM 157 C CA . ASN A 1 20 ? -18.013 -4.018 -2.387 1.00 98.14 20 A 1 ATOM 158 C C . ASN A 1 20 ? -17.107 -4.308 -1.179 1.00 98.20 20 A 1 ATOM 159 O O . ASN A 1 20 ? -17.287 -3.718 -0.118 1.00 97.79 20 A 1 ATOM 160 C CB . ASN A 1 20 ? -18.940 -5.206 -2.673 1.00 97.93 20 A 1 ATOM 161 C CG . ASN A 1 20 ? -20.060 -4.900 -3.653 1.00 97.23 20 A 1 ATOM 162 O OD1 . ASN A 1 20 ? -20.349 -3.775 -4.019 1.00 92.75 20 A 1 ATOM 163 N ND2 . ASN A 1 20 ? -20.752 -5.933 -4.096 1.00 92.07 20 A 1 ATOM 164 N N . MET A 1 21 ? -16.091 -5.146 -1.368 1.00 98.47 21 A 1 ATOM 165 C CA . MET A 1 21 ? -15.131 -5.481 -0.312 1.00 98.46 21 A 1 ATOM 166 C C . MET A 1 21 ? -14.359 -4.248 0.166 1.00 98.40 21 A 1 ATOM 167 O O . MET A 1 21 ? -14.191 -4.065 1.368 1.00 98.03 21 A 1 ATOM 168 C CB . MET A 1 21 ? -14.157 -6.555 -0.815 1.00 98.39 21 A 1 ATOM 169 C CG . MET A 1 21 ? -14.824 -7.920 -1.003 1.00 97.68 21 A 1 ATOM 170 S SD . MET A 1 21 ? -15.394 -8.723 0.527 1.00 97.62 21 A 1 ATOM 171 C CE . MET A 1 21 ? -13.804 -9.245 1.226 1.00 94.36 21 A 1 ATOM 172 N N . ARG A 1 22 ? -13.936 -3.372 -0.748 1.00 98.52 22 A 1 ATOM 173 C CA . ARG A 1 22 ? -13.270 -2.114 -0.372 1.00 98.39 22 A 1 ATOM 174 C C . ARG A 1 22 ? -14.193 -1.192 0.418 1.00 98.22 22 A 1 ATOM 175 O O . ARG A 1 22 ? -13.747 -0.642 1.420 1.00 97.66 22 A 1 ATOM 176 C CB . ARG A 1 22 ? -12.723 -1.388 -1.603 1.00 98.10 22 A 1 ATOM 177 C CG . ARG A 1 22 ? -11.420 -2.026 -2.121 1.00 97.05 22 A 1 ATOM 178 C CD . ARG A 1 22 ? -10.775 -1.163 -3.201 1.00 96.61 22 A 1 ATOM 179 N NE . ARG A 1 22 ? -11.634 -1.007 -4.381 1.00 94.79 22 A 1 ATOM 180 C CZ . ARG A 1 22 ? -11.485 -1.578 -5.562 1.00 96.33 22 A 1 ATOM 181 N NH1 . ARG A 1 22 ? -10.513 -2.403 -5.834 1.00 88.84 22 A 1 ATOM 182 N NH2 . ARG A 1 22 ? -12.314 -1.310 -6.526 1.00 90.24 22 A 1 ATOM 183 N N . LYS A 1 23 ? -15.450 -1.058 0.028 1.00 98.01 23 A 1 ATOM 184 C CA . LYS A 1 23 ? -16.420 -0.241 0.771 1.00 97.60 23 A 1 ATOM 185 C C . LYS A 1 23 ? -16.623 -0.735 2.201 1.00 97.43 23 A 1 ATOM 186 O O . LYS A 1 23 ? -16.761 0.081 3.103 1.00 96.44 23 A 1 ATOM 187 C CB . LYS A 1 23 ? -17.768 -0.204 0.040 1.00 97.09 23 A 1 ATOM 188 C CG . LYS A 1 23 ? -17.698 0.672 -1.223 1.00 93.58 23 A 1 ATOM 189 C CD . LYS A 1 23 ? -19.024 0.699 -1.984 1.00 90.77 23 A 1 ATOM 190 C CE . LYS A 1 23 ? -20.076 1.479 -1.179 1.00 82.78 23 A 1 ATOM 191 N NZ . LYS A 1 23 ? -21.196 1.920 -2.038 1.00 76.66 23 A 1 ATOM 192 N N . ASP A 1 24 ? -16.613 -2.051 2.401 1.00 97.87 24 A 1 ATOM 193 C CA . ASP A 1 24 ? -16.854 -2.656 3.712 1.00 97.53 24 A 1 ATOM 194 C C . ASP A 1 24 ? -15.598 -2.698 4.601 1.00 97.45 24 A 1 ATOM 195 O O . ASP A 1 24 ? -15.717 -2.644 5.826 1.00 96.00 24 A 1 ATOM 196 C CB . ASP A 1 24 ? -17.414 -4.076 3.521 1.00 96.99 24 A 1 ATOM 197 C CG . ASP A 1 24 ? -18.882 -4.146 3.079 1.00 96.31 24 A 1 ATOM 198 O OD1 . ASP A 1 24 ? -19.536 -3.105 2.869 1.00 94.13 24 A 1 ATOM 199 O OD2 . ASP A 1 24 ? -19.410 -5.286 3.027 1.00 93.84 24 A 1 ATOM 200 N N . LEU A 1 25 ? -14.402 -2.828 4.009 1.00 97.83 25 A 1 ATOM 201 C CA . LEU A 1 25 ? -13.185 -3.206 4.741 1.00 97.64 25 A 1 ATOM 202 C C . LEU A 1 25 ? -12.008 -2.238 4.599 1.00 97.24 25 A 1 ATOM 203 O O . LEU A 1 25 ? -11.148 -2.189 5.483 1.00 95.63 25 A 1 ATOM 204 C CB . LEU A 1 25 ? -12.735 -4.594 4.260 1.00 97.57 25 A 1 ATOM 205 C CG . LEU A 1 25 ? -13.774 -5.721 4.407 1.00 97.41 25 A 1 ATOM 206 C CD1 . LEU A 1 25 ? -13.222 -6.975 3.741 1.00 96.47 25 A 1 ATOM 207 C CD2 . LEU A 1 25 ? -14.073 -6.029 5.874 1.00 96.14 25 A 1 ATOM 208 N N . SER A 1 26 ? -11.907 -1.525 3.488 1.00 97.06 26 A 1 ATOM 209 C CA . SER A 1 26 ? -10.825 -0.570 3.271 1.00 95.90 26 A 1 ATOM 210 C C . SER A 1 26 ? -11.141 0.740 3.985 1.00 93.71 26 A 1 ATOM 211 O O . SER A 1 26 ? -12.301 1.112 4.141 1.00 88.60 26 A 1 ATOM 212 C CB . SER A 1 26 ? -10.570 -0.320 1.782 1.00 95.42 26 A 1 ATOM 213 O OG . SER A 1 26 ? -10.300 -1.532 1.099 1.00 91.68 26 A 1 ATOM 214 N N . ASN A 1 27 ? -10.113 1.475 4.389 1.00 92.69 27 A 1 ATOM 215 C CA . ASN A 1 27 ? -10.340 2.815 4.922 1.00 89.81 27 A 1 ATOM 216 C C . ASN A 1 27 ? -10.817 3.770 3.810 1.00 90.06 27 A 1 ATOM 217 O O . ASN A 1 27 ? -10.652 3.511 2.618 1.00 86.22 27 A 1 ATOM 218 C CB . ASN A 1 27 ? -9.098 3.302 5.706 1.00 85.47 27 A 1 ATOM 219 C CG . ASN A 1 27 ? -7.910 3.672 4.835 1.00 77.31 27 A 1 ATOM 220 O OD1 . ASN A 1 27 ? -7.933 3.584 3.635 1.00 69.85 27 A 1 ATOM 221 N ND2 . ASN A 1 27 ? -6.824 4.109 5.424 1.00 70.48 27 A 1 ATOM 222 N N . GLN A 1 28 ? -11.403 4.903 4.224 1.00 88.98 28 A 1 ATOM 223 C CA . GLN A 1 28 ? -11.997 5.877 3.296 1.00 87.23 28 A 1 ATOM 224 C C . GLN A 1 28 ? -10.986 6.521 2.333 1.00 89.20 28 A 1 ATOM 225 O O . GLN A 1 28 ? -11.376 7.026 1.289 1.00 85.39 28 A 1 ATOM 226 C CB . GLN A 1 28 ? -12.712 6.968 4.099 1.00 82.86 28 A 1 ATOM 227 C CG . GLN A 1 28 ? -13.955 6.439 4.827 1.00 74.59 28 A 1 ATOM 228 C CD . GLN A 1 28 ? -14.683 7.528 5.615 1.00 68.36 28 A 1 ATOM 229 O OE1 . GLN A 1 28 ? -14.189 8.618 5.847 1.00 61.62 28 A 1 ATOM 230 N NE2 . GLN A 1 28 ? -15.882 7.265 6.075 1.00 59.59 28 A 1 ATOM 231 N N . ASP A 1 29 ? -9.692 6.476 2.641 1.00 93.36 29 A 1 ATOM 232 C CA . ASP A 1 29 ? -8.660 7.024 1.759 1.00 94.30 29 A 1 ATOM 233 C C . ASP A 1 29 ? -8.298 6.057 0.615 1.00 95.58 29 A 1 ATOM 234 O O . ASP A 1 29 ? -7.867 6.489 -0.455 1.00 94.59 29 A 1 ATOM 235 C CB . ASP A 1 29 ? -7.413 7.372 2.578 1.00 92.71 29 A 1 ATOM 236 C CG . ASP A 1 29 ? -7.613 8.489 3.604 1.00 90.59 29 A 1 ATOM 237 O OD1 . ASP A 1 29 ? -8.476 9.368 3.380 1.00 86.83 29 A 1 ATOM 238 O OD2 . ASP A 1 29 ? -6.848 8.487 4.596 1.00 86.14 29 A 1 ATOM 239 N N . ILE A 1 30 ? -8.470 4.744 0.822 1.00 96.84 30 A 1 ATOM 240 C CA . ILE A 1 30 ? -8.109 3.691 -0.140 1.00 96.98 30 A 1 ATOM 241 C C . ILE A 1 30 ? -9.111 3.585 -1.296 1.00 96.83 30 A 1 ATOM 242 O O . ILE A 1 30 ? -8.726 3.228 -2.416 1.00 95.58 30 A 1 ATOM 243 C CB . ILE A 1 30 ? -7.925 2.346 0.603 1.00 96.72 30 A 1 ATOM 244 C CG1 . ILE A 1 30 ? -6.573 2.370 1.346 1.00 95.24 30 A 1 ATOM 245 C CG2 . ILE A 1 30 ? -7.998 1.126 -0.335 1.00 94.84 30 A 1 ATOM 246 C CD1 . ILE A 1 30 ? -6.310 1.167 2.259 1.00 92.79 30 A 1 ATOM 247 N N . CYS A 1 31 ? -10.386 3.858 -1.046 1.00 96.40 31 A 1 ATOM 248 C CA . CYS A 1 31 ? -11.427 3.776 -2.059 1.00 96.03 31 A 1 ATOM 249 C C . CYS A 1 31 ? -12.282 5.044 -2.117 1.00 95.40 31 A 1 ATOM 250 O O . CYS A 1 31 ? -12.388 5.797 -1.149 1.00 94.07 31 A 1 ATOM 251 C CB . CYS A 1 31 ? -12.255 2.495 -1.867 1.00 94.93 31 A 1 ATOM 252 S SG . CYS A 1 31 ? -13.244 2.551 -0.340 1.00 94.34 31 A 1 ATOM 253 N N . LEU A 1 32 ? -12.890 5.258 -3.279 1.00 95.29 32 A 1 ATOM 254 C CA . LEU A 1 32 ? -13.882 6.303 -3.486 1.00 94.55 32 A 1 ATOM 255 C C . LEU A 1 32 ? -15.250 5.856 -2.936 1.00 94.69 32 A 1 ATOM 256 O O . LEU A 1 32 ? -15.433 4.710 -2.534 1.00 92.95 32 A 1 ATOM 257 C CB . LEU A 1 32 ? -13.937 6.654 -4.984 1.00 93.28 32 A 1 ATOM 258 C CG . LEU A 1 32 ? -12.590 7.038 -5.627 1.00 92.29 32 A 1 ATOM 259 C CD1 . LEU A 1 32 ? -12.799 7.391 -7.100 1.00 88.15 32 A 1 ATOM 260 C CD2 . LEU A 1 32 ? -11.931 8.239 -4.938 1.00 87.24 32 A 1 ATOM 261 N N . GLU A 1 33 ? -16.223 6.759 -2.953 1.00 93.42 33 A 1 ATOM 262 C CA . GLU A 1 33 ? -17.555 6.509 -2.389 1.00 93.38 33 A 1 ATOM 263 C C . GLU A 1 33 ? -18.293 5.326 -3.057 1.00 94.73 33 A 1 ATOM 264 O O . GLU A 1 33 ? -19.016 4.574 -2.403 1.00 93.70 33 A 1 ATOM 265 C CB . GLU A 1 33 ? -18.355 7.812 -2.519 1.00 91.57 33 A 1 ATOM 266 C CG . GLU A 1 33 ? -19.658 7.785 -1.708 1.00 80.28 33 A 1 ATOM 267 C CD . GLU A 1 33 ? -20.422 9.111 -1.770 1.00 71.54 33 A 1 ATOM 268 O OE1 . GLU A 1 33 ? -21.387 9.246 -0.982 1.00 63.95 33 A 1 ATOM 269 O OE2 . GLU A 1 33 ? -20.054 9.969 -2.595 1.00 63.74 33 A 1 ATOM 270 N N . ASP A 1 34 ? -18.056 5.099 -4.351 1.00 94.82 34 A 1 ATOM 271 C CA . ASP A 1 34 ? -18.595 3.955 -5.098 1.00 95.21 34 A 1 ATOM 272 C C . ASP A 1 34 ? -17.795 2.652 -4.891 1.00 96.46 34 A 1 ATOM 273 O O . ASP A 1 34 ? -18.152 1.604 -5.431 1.00 95.61 34 A 1 ATOM 274 C CB . ASP A 1 34 ? -18.720 4.322 -6.590 1.00 93.41 34 A 1 ATOM 275 C CG . ASP A 1 34 ? -17.397 4.236 -7.353 1.00 90.39 34 A 1 ATOM 276 O OD1 . ASP A 1 34 ? -16.355 4.560 -6.750 1.00 86.17 34 A 1 ATOM 277 O OD2 . ASP A 1 34 ? -17.411 3.755 -8.514 1.00 85.81 34 A 1 ATOM 278 N N . GLY A 1 35 ? -16.709 2.699 -4.122 1.00 95.67 35 A 1 ATOM 279 C CA . GLY A 1 35 ? -15.777 1.597 -3.896 1.00 96.54 35 A 1 ATOM 280 C C . GLY A 1 35 ? -14.678 1.479 -4.953 1.00 97.31 35 A 1 ATOM 281 O O . GLY A 1 35 ? -13.860 0.563 -4.862 1.00 96.63 35 A 1 ATOM 282 N N . ALA A 1 36 ? -14.608 2.363 -5.955 1.00 96.77 36 A 1 ATOM 283 C CA . ALA A 1 36 ? -13.479 2.391 -6.881 1.00 96.32 36 A 1 ATOM 284 C C . ALA A 1 36 ? -12.165 2.665 -6.132 1.00 96.54 36 A 1 ATOM 285 O O . ALA A 1 36 ? -12.145 3.336 -5.102 1.00 95.68 36 A 1 ATOM 286 C CB . ALA A 1 36 ? -13.724 3.424 -7.986 1.00 95.24 36 A 1 ATOM 287 N N . LEU A 1 37 ? -11.056 2.140 -6.653 1.00 96.59 37 A 1 ATOM 288 C CA . LEU A 1 37 ? -9.750 2.322 -6.022 1.00 96.86 37 A 1 ATOM 289 C C . LEU A 1 37 ? -9.297 3.787 -6.117 1.00 96.83 37 A 1 ATOM 290 O O . LEU A 1 37 ? -9.259 4.370 -7.199 1.00 95.76 37 A 1 ATOM 291 C CB . LEU A 1 37 ? -8.747 1.367 -6.690 1.00 96.02 37 A 1 ATOM 292 C CG . LEU A 1 37 ? -7.415 1.255 -5.920 1.00 93.67 37 A 1 ATOM 293 C CD1 . LEU A 1 37 ? -7.572 0.395 -4.665 1.00 91.56 37 A 1 ATOM 294 C CD2 . LEU A 1 37 ? -6.365 0.602 -6.813 1.00 91.01 37 A 1 ATOM 295 N N . ASN A 1 38 ? -8.898 4.373 -4.995 1.00 96.33 38 A 1 ATOM 296 C CA . ASN A 1 38 ? -8.329 5.716 -4.966 1.00 96.25 38 A 1 ATOM 297 C C . ASN A 1 38 ? -6.838 5.665 -5.334 1.00 96.54 38 A 1 ATOM 298 O O . ASN A 1 38 ? -5.953 5.566 -4.481 1.00 96.12 38 A 1 ATOM 299 C CB . ASN A 1 38 ? -8.590 6.361 -3.598 1.00 95.54 38 A 1 ATOM 300 C CG . ASN A 1 38 ? -8.046 7.778 -3.524 1.00 95.19 38 A 1 ATOM 301 O OD1 . ASN A 1 38 ? -7.628 8.375 -4.508 1.00 92.70 38 A 1 ATOM 302 N ND2 . ASN A 1 38 ? -8.022 8.351 -2.340 1.00 92.22 38 A 1 ATOM 303 N N . HIS A 1 39 ? -6.538 5.756 -6.622 1.00 96.29 39 A 1 ATOM 304 C CA . HIS A 1 39 ? -5.156 5.722 -7.111 1.00 96.19 39 A 1 ATOM 305 C C . HIS A 1 39 ? -4.266 6.823 -6.512 1.00 96.15 39 A 1 ATOM 306 O O . HIS A 1 39 ? -3.069 6.599 -6.327 1.00 95.14 39 A 1 ATOM 307 C CB . HIS A 1 39 ? -5.153 5.796 -8.638 1.00 95.91 39 A 1 ATOM 308 C CG . HIS A 1 39 ? -5.519 4.487 -9.277 1.00 96.23 39 A 1 ATOM 309 N ND1 . HIS A 1 39 ? -4.669 3.398 -9.426 1.00 90.84 39 A 1 ATOM 310 C CD2 . HIS A 1 39 ? -6.740 4.136 -9.798 1.00 91.00 39 A 1 ATOM 311 C CE1 . HIS A 1 39 ? -5.364 2.422 -10.027 1.00 92.02 39 A 1 ATOM 312 N NE2 . HIS A 1 39 ? -6.622 2.836 -10.264 1.00 92.44 39 A 1 ATOM 313 N N . SER A 1 40 ? -4.823 7.981 -6.150 1.00 95.87 40 A 1 ATOM 314 C CA . SER A 1 40 ? -4.049 9.080 -5.559 1.00 95.11 40 A 1 ATOM 315 C C . SER A 1 40 ? -3.442 8.722 -4.197 1.00 95.57 40 A 1 ATOM 316 O O . SER A 1 40 ? -2.308 9.105 -3.910 1.00 94.52 40 A 1 ATOM 317 C CB . SER A 1 40 ? -4.898 10.356 -5.474 1.00 93.26 40 A 1 ATOM 318 O OG . SER A 1 40 ? -5.856 10.305 -4.445 1.00 81.91 40 A 1 ATOM 319 N N . TYR A 1 41 ? -4.130 7.894 -3.418 1.00 95.99 41 A 1 ATOM 320 C CA . TYR A 1 41 ? -3.605 7.360 -2.159 1.00 96.33 41 A 1 ATOM 321 C C . TYR A 1 41 ? -2.344 6.508 -2.385 1.00 96.41 41 A 1 ATOM 322 O O . TYR A 1 41 ? -1.361 6.611 -1.649 1.00 95.51 41 A 1 ATOM 323 C CB . TYR A 1 41 ? -4.704 6.540 -1.470 1.00 96.34 41 A 1 ATOM 324 C CG . TYR A 1 41 ? -4.250 5.852 -0.200 1.00 96.72 41 A 1 ATOM 325 C CD1 . TYR A 1 41 ? -3.795 4.517 -0.227 1.00 95.97 41 A 1 ATOM 326 C CD2 . TYR A 1 41 ? -4.274 6.551 1.024 1.00 96.16 41 A 1 ATOM 327 C CE1 . TYR A 1 41 ? -3.376 3.886 0.952 1.00 95.74 41 A 1 ATOM 328 C CE2 . TYR A 1 41 ? -3.860 5.923 2.210 1.00 95.66 41 A 1 ATOM 329 C CZ . TYR A 1 41 ? -3.412 4.590 2.171 1.00 95.88 41 A 1 ATOM 330 O OH . TYR A 1 41 ? -3.011 3.974 3.330 1.00 94.76 41 A 1 ATOM 331 N N . PHE A 1 42 ? -2.329 5.703 -3.440 1.00 96.60 42 A 1 ATOM 332 C CA . PHE A 1 42 ? -1.206 4.816 -3.754 1.00 96.40 42 A 1 ATOM 333 C C . PHE A 1 42 ? -0.066 5.502 -4.516 1.00 95.78 42 A 1 ATOM 334 O O . PHE A 1 42 ? 1.069 5.022 -4.467 1.00 94.05 42 A 1 ATOM 335 C CB . PHE A 1 42 ? -1.724 3.582 -4.494 1.00 96.51 42 A 1 ATOM 336 C CG . PHE A 1 42 ? -2.605 2.717 -3.620 1.00 96.88 42 A 1 ATOM 337 C CD1 . PHE A 1 42 ? -2.037 1.904 -2.619 1.00 96.08 42 A 1 ATOM 338 C CD2 . PHE A 1 42 ? -4.000 2.754 -3.775 1.00 96.13 42 A 1 ATOM 339 C CE1 . PHE A 1 42 ? -2.850 1.132 -1.784 1.00 95.65 42 A 1 ATOM 340 C CE2 . PHE A 1 42 ? -4.822 1.979 -2.941 1.00 95.67 42 A 1 ATOM 341 C CZ . PHE A 1 42 ? -4.245 1.169 -1.946 1.00 95.97 42 A 1 ATOM 342 N N . LEU A 1 43 ? -0.323 6.628 -5.160 1.00 95.48 43 A 1 ATOM 343 C CA . LEU A 1 43 ? 0.715 7.489 -5.740 1.00 94.49 43 A 1 ATOM 344 C C . LEU A 1 43 ? 1.491 8.256 -4.666 1.00 93.51 43 A 1 ATOM 345 O O . LEU A 1 43 ? 2.648 8.618 -4.873 1.00 91.28 43 A 1 ATOM 346 C CB . LEU A 1 43 ? 0.064 8.459 -6.737 1.00 94.14 43 A 1 ATOM 347 C CG . LEU A 1 43 ? -0.418 7.780 -8.033 1.00 93.76 43 A 1 ATOM 348 C CD1 . LEU A 1 43 ? -1.248 8.768 -8.849 1.00 92.14 43 A 1 ATOM 349 C CD2 . LEU A 1 43 ? 0.755 7.302 -8.896 1.00 91.90 43 A 1 ATOM 350 N N . THR A 1 44 ? 0.882 8.469 -3.503 1.00 93.51 44 A 1 ATOM 351 C CA . THR A 1 44 ? 1.513 9.159 -2.375 1.00 92.28 44 A 1 ATOM 352 C C . THR A 1 44 ? 2.150 8.151 -1.418 1.00 92.41 44 A 1 ATOM 353 O O . THR A 1 44 ? 1.616 7.074 -1.179 1.00 90.41 44 A 1 ATOM 354 C CB . THR A 1 44 ? 0.493 10.048 -1.654 1.00 89.96 44 A 1 ATOM 355 O OG1 . THR A 1 44 ? -0.204 10.856 -2.571 1.00 79.88 44 A 1 ATOM 356 C CG2 . THR A 1 44 ? 1.185 11.003 -0.687 1.00 79.03 44 A 1 ATOM 357 N N . LYS A 1 45 ? 3.305 8.494 -0.837 1.00 90.60 45 A 1 ATOM 358 C CA . LYS A 1 45 ? 3.932 7.632 0.171 1.00 89.33 45 A 1 ATOM 359 C C . LYS A 1 45 ? 3.008 7.458 1.379 1.00 89.98 45 A 1 ATOM 360 O O . LYS A 1 45 ? 2.269 8.370 1.749 1.00 87.92 45 A 1 ATOM 361 C CB . LYS A 1 45 ? 5.290 8.194 0.604 1.00 86.47 45 A 1 ATOM 362 C CG . LYS A 1 45 ? 6.328 8.122 -0.523 1.00 76.80 45 A 1 ATOM 363 C CD . LYS A 1 45 ? 7.666 8.688 -0.039 1.00 71.88 45 A 1 ATOM 364 C CE . LYS A 1 45 ? 8.692 8.663 -1.175 1.00 62.64 45 A 1 ATOM 365 N NZ . LYS A 1 45 ? 9.953 9.334 -0.783 1.00 54.72 45 A 1 ATOM 366 N N . LYS A 1 46 ? 3.113 6.314 2.033 1.00 88.11 46 A 1 ATOM 367 C CA . LYS A 1 46 ? 2.369 6.041 3.265 1.00 86.85 46 A 1 ATOM 368 C C . LYS A 1 46 ? 2.557 7.172 4.282 1.00 87.34 46 A 1 ATOM 369 O O . LYS A 1 46 ? 3.682 7.600 4.528 1.00 81.50 46 A 1 ATOM 370 C CB . LYS A 1 46 ? 2.821 4.689 3.844 1.00 83.14 46 A 1 ATOM 371 C CG . LYS A 1 46 ? 1.965 4.311 5.050 1.00 77.65 46 A 1 ATOM 372 C CD . LYS A 1 46 ? 2.477 3.060 5.742 1.00 71.98 46 A 1 ATOM 373 C CE . LYS A 1 46 ? 1.607 2.840 6.983 1.00 65.44 46 A 1 ATOM 374 N NZ . LYS A 1 46 ? 2.150 1.784 7.845 1.00 57.33 46 A 1 ATOM 375 N N . GLY A 1 47 ? 1.459 7.637 4.866 1.00 86.08 47 A 1 ATOM 376 C CA . GLY A 1 47 ? 1.454 8.731 5.845 1.00 84.68 47 A 1 ATOM 377 C C . GLY A 1 47 ? 1.612 10.138 5.259 1.00 86.56 47 A 1 ATOM 378 O O . GLY A 1 47 ? 1.570 11.100 6.016 1.00 83.03 47 A 1 ATOM 379 N N . GLN A 1 48 ? 1.774 10.272 3.941 1.00 88.25 48 A 1 ATOM 380 C CA . GLN A 1 48 ? 1.898 11.564 3.250 1.00 88.88 48 A 1 ATOM 381 C C . GLN A 1 48 ? 0.692 11.878 2.349 1.00 91.56 48 A 1 ATOM 382 O O . GLN A 1 48 ? 0.711 12.866 1.618 1.00 90.00 48 A 1 ATOM 383 C CB . GLN A 1 48 ? 3.210 11.612 2.445 1.00 85.77 48 A 1 ATOM 384 C CG . GLN A 1 48 ? 4.448 11.475 3.342 1.00 80.84 48 A 1 ATOM 385 C CD . GLN A 1 48 ? 5.761 11.676 2.588 1.00 74.72 48 A 1 ATOM 386 O OE1 . GLN A 1 48 ? 5.892 11.496 1.384 1.00 69.00 48 A 1 ATOM 387 N NE2 . GLN A 1 48 ? 6.811 12.045 3.288 1.00 65.56 48 A 1 ATOM 388 N N . TYR A 1 49 ? -0.343 11.054 2.381 1.00 91.26 49 A 1 ATOM 389 C CA . TYR A 1 49 ? -1.551 11.305 1.603 1.00 93.40 49 A 1 ATOM 390 C C . TYR A 1 49 ? -2.270 12.552 2.127 1.00 94.73 49 A 1 ATOM 391 O O . TYR A 1 49 ? -2.613 12.645 3.308 1.00 94.20 49 A 1 ATOM 392 C CB . TYR A 1 49 ? -2.466 10.075 1.625 1.00 93.20 49 A 1 ATOM 393 C CG . TYR A 1 49 ? -3.754 10.295 0.857 1.00 94.08 49 A 1 ATOM 394 C CD1 . TYR A 1 49 ? -4.990 10.344 1.533 1.00 92.60 49 A 1 ATOM 395 C CD2 . TYR A 1 49 ? -3.726 10.486 -0.538 1.00 92.79 49 A 1 ATOM 396 C CE1 . TYR A 1 49 ? -6.178 10.574 0.828 1.00 92.55 49 A 1 ATOM 397 C CE2 . TYR A 1 49 ? -4.914 10.724 -1.252 1.00 92.46 49 A 1 ATOM 398 C CZ . TYR A 1 49 ? -6.140 10.766 -0.564 1.00 93.06 49 A 1 ATOM 399 O OH . TYR A 1 49 ? -7.301 10.998 -1.256 1.00 91.56 49 A 1 ATOM 400 N N . TRP A 1 50 ? -2.480 13.509 1.228 1.00 94.46 50 A 1 ATOM 401 C CA . TRP A 1 50 ? -3.187 14.745 1.536 1.00 95.36 50 A 1 ATOM 402 C C . TRP A 1 50 ? -4.686 14.535 1.345 1.00 95.42 50 A 1 ATOM 403 O O . TRP A 1 50 ? -5.183 14.509 0.216 1.00 94.23 50 A 1 ATOM 404 C CB . TRP A 1 50 ? -2.648 15.876 0.671 1.00 95.70 50 A 1 ATOM 405 C CG . TRP A 1 50 ? -3.149 17.223 1.091 1.00 96.26 50 A 1 ATOM 406 C CD1 . TRP A 1 50 ? -4.154 17.921 0.517 1.00 95.39 50 A 1 ATOM 407 C CD2 . TRP A 1 50 ? -2.667 18.035 2.204 1.00 96.44 50 A 1 ATOM 408 N NE1 . TRP A 1 50 ? -4.317 19.131 1.182 1.00 95.78 50 A 1 ATOM 409 C CE2 . TRP A 1 50 ? -3.426 19.239 2.223 1.00 96.40 50 A 1 ATOM 410 C CE3 . TRP A 1 50 ? -1.663 17.867 3.186 1.00 96.63 50 A 1 ATOM 411 C CZ2 . TRP A 1 50 ? -3.195 20.252 3.185 1.00 96.56 50 A 1 ATOM 412 C CZ3 . TRP A 1 50 ? -1.438 18.875 4.142 1.00 96.13 50 A 1 ATOM 413 C CH2 . TRP A 1 50 ? -2.198 20.055 4.139 1.00 96.22 50 A 1 ATOM 414 N N . THR A 1 51 ? -5.396 14.383 2.458 1.00 95.16 51 A 1 ATOM 415 C CA . THR A 1 51 ? -6.836 14.111 2.441 1.00 95.06 51 A 1 ATOM 416 C C . THR A 1 51 ? -7.647 15.365 2.074 1.00 95.51 51 A 1 ATOM 417 O O . THR A 1 51 ? -7.180 16.492 2.287 1.00 95.42 51 A 1 ATOM 418 C CB . THR A 1 51 ? -7.321 13.546 3.786 1.00 94.34 51 A 1 ATOM 419 O OG1 . THR A 1 51 ? -7.261 14.528 4.790 1.00 90.68 51 A 1 ATOM 420 C CG2 . THR A 1 51 ? -6.512 12.342 4.263 1.00 90.49 51 A 1 ATOM 421 N N . PRO A 1 52 ? -8.896 15.213 1.608 1.00 94.16 52 A 1 ATOM 422 C CA . PRO A 1 52 ? -9.813 16.347 1.460 1.00 93.96 52 A 1 ATOM 423 C C . PRO A 1 52 ? -10.006 17.139 2.762 1.00 95.70 52 A 1 ATOM 424 O O . PRO A 1 52 ? -10.135 18.362 2.730 1.00 95.58 52 A 1 ATOM 425 C CB . PRO A 1 52 ? -11.133 15.734 0.982 1.00 91.86 52 A 1 ATOM 426 C CG . PRO A 1 52 ? -10.697 14.444 0.283 1.00 88.76 52 A 1 ATOM 427 C CD . PRO A 1 52 ? -9.511 13.983 1.125 1.00 91.70 52 A 1 ATOM 428 N N . LEU A 1 53 ? -9.954 16.464 3.907 1.00 94.15 53 A 1 ATOM 429 C CA . LEU A 1 53 ? -10.025 17.104 5.221 1.00 95.20 53 A 1 ATOM 430 C C . LEU A 1 53 ? -8.800 17.995 5.476 1.00 96.90 53 A 1 ATOM 431 O O . LEU A 1 53 ? -8.954 19.127 5.926 1.00 97.10 53 A 1 ATOM 432 C CB . LEU A 1 53 ? -10.175 16.018 6.300 1.00 94.05 53 A 1 ATOM 433 C CG . LEU A 1 53 ? -10.476 16.581 7.703 1.00 86.98 53 A 1 ATOM 434 C CD1 . LEU A 1 53 ? -11.886 17.176 7.783 1.00 82.09 53 A 1 ATOM 435 C CD2 . LEU A 1 53 ? -10.368 15.457 8.738 1.00 82.08 53 A 1 ATOM 436 N N . ASN A 1 54 ? -7.600 17.525 5.126 1.00 96.83 54 A 1 ATOM 437 C CA . ASN A 1 54 ? -6.374 18.320 5.222 1.00 97.38 54 A 1 ATOM 438 C C . ASN A 1 54 ? -6.438 19.556 4.314 1.00 98.05 54 A 1 ATOM 439 O O . ASN A 1 54 ? -5.992 20.632 4.705 1.00 98.13 54 A 1 ATOM 440 C CB . ASN A 1 54 ? -5.163 17.459 4.830 1.00 96.96 54 A 1 ATOM 441 C CG . ASN A 1 54 ? -4.837 16.329 5.791 1.00 95.93 54 A 1 ATOM 442 O OD1 . ASN A 1 54 ? -5.388 16.175 6.858 1.00 89.55 54 A 1 ATOM 443 N ND2 . ASN A 1 54 ? -3.895 15.483 5.419 1.00 87.78 54 A 1 ATOM 444 N N . GLN A 1 55 ? -6.998 19.414 3.121 1.00 97.37 55 A 1 ATOM 445 C CA . GLN A 1 55 ? -7.175 20.540 2.203 1.00 97.73 55 A 1 ATOM 446 C C . GLN A 1 55 ? -8.076 21.612 2.822 1.00 98.29 55 A 1 ATOM 447 O O . GLN A 1 55 ? -7.687 22.779 2.858 1.00 98.31 55 A 1 ATOM 448 C CB . GLN A 1 55 ? -7.734 20.024 0.870 1.00 97.06 55 A 1 ATOM 449 C CG . GLN A 1 55 ? -7.878 21.132 -0.192 1.00 95.42 55 A 1 ATOM 450 C CD . GLN A 1 55 ? -6.550 21.683 -0.710 1.00 96.08 55 A 1 ATOM 451 O OE1 . GLN A 1 55 ? -5.471 21.158 -0.485 1.00 91.64 55 A 1 ATOM 452 N NE2 . GLN A 1 55 ? -6.596 22.759 -1.461 1.00 90.18 55 A 1 ATOM 453 N N . LYS A 1 56 ? -9.229 21.221 3.361 1.00 97.89 56 A 1 ATOM 454 C CA . LYS A 1 56 ? -10.148 22.140 4.045 1.00 98.17 56 A 1 ATOM 455 C C . LYS A 1 56 ? -9.522 22.777 5.288 1.00 98.54 56 A 1 ATOM 456 O O . LYS A 1 56 ? -9.666 23.978 5.491 1.00 98.43 56 A 1 ATOM 457 C CB . LYS A 1 56 ? -11.449 21.402 4.400 1.00 97.72 56 A 1 ATOM 458 C CG . LYS A 1 56 ? -12.402 21.227 3.201 1.00 87.73 56 A 1 ATOM 459 C CD . LYS A 1 56 ? -12.952 22.597 2.772 1.00 80.45 56 A 1 ATOM 460 C CE . LYS A 1 56 ? -13.980 22.562 1.655 1.00 73.07 56 A 1 ATOM 461 N NZ . LYS A 1 56 ? -14.407 23.955 1.334 1.00 61.67 56 A 1 ATOM 462 N N . ALA A 1 57 ? -8.780 22.006 6.067 1.00 98.51 57 A 1 ATOM 463 C CA . ALA A 1 57 ? -8.061 22.507 7.233 1.00 98.55 57 A 1 ATOM 464 C C . ALA A 1 57 ? -7.030 23.582 6.845 1.00 98.69 57 A 1 ATOM 465 O O . ALA A 1 57 ? -6.971 24.634 7.477 1.00 98.57 57 A 1 ATOM 466 C CB . ALA A 1 57 ? -7.414 21.317 7.946 1.00 98.26 57 A 1 ATOM 467 N N . LEU A 1 58 ? -6.265 23.373 5.769 1.00 98.74 58 A 1 ATOM 468 C CA . LEU A 1 58 ? -5.311 24.374 5.284 1.00 98.80 58 A 1 ATOM 469 C C . LEU A 1 58 ? -6.016 25.642 4.790 1.00 98.84 58 A 1 ATOM 470 O O . LEU A 1 58 ? -5.579 26.742 5.121 1.00 98.75 58 A 1 ATOM 471 C CB . LEU A 1 58 ? -4.424 23.751 4.198 1.00 98.67 58 A 1 ATOM 472 C CG . LEU A 1 58 ? -3.399 24.728 3.591 1.00 98.35 58 A 1 ATOM 473 C CD1 . LEU A 1 58 ? -2.471 25.359 4.633 1.00 97.99 58 A 1 ATOM 474 C CD2 . LEU A 1 58 ? -2.528 23.978 2.579 1.00 97.96 58 A 1 ATOM 475 N N . GLN A 1 59 ? -7.091 25.506 4.027 1.00 98.78 59 A 1 ATOM 476 C CA . GLN A 1 59 ? -7.856 26.654 3.524 1.00 98.79 59 A 1 ATOM 477 C C . GLN A 1 59 ? -8.425 27.495 4.673 1.00 98.80 59 A 1 ATOM 478 O O . GLN A 1 59 ? -8.243 28.713 4.681 1.00 98.62 59 A 1 ATOM 479 C CB . GLN A 1 59 ? -8.972 26.162 2.592 1.00 98.66 59 A 1 ATOM 480 C CG . GLN A 1 59 ? -8.419 25.653 1.258 1.00 98.05 59 A 1 ATOM 481 C CD . GLN A 1 59 ? -9.551 25.257 0.309 1.00 97.09 59 A 1 ATOM 482 O OE1 . GLN A 1 59 ? -10.091 24.167 0.358 1.00 90.71 59 A 1 ATOM 483 N NE2 . GLN A 1 59 ? -9.949 26.136 -0.580 1.00 88.61 59 A 1 ATOM 484 N N . ARG A 1 60 ? -9.000 26.852 5.684 1.00 98.75 60 A 1 ATOM 485 C CA . ARG A 1 60 ? -9.488 27.513 6.898 1.00 98.66 60 A 1 ATOM 486 C C . ARG A 1 60 ? -8.350 28.153 7.697 1.00 98.73 60 A 1 ATOM 487 O O . ARG A 1 60 ? -8.477 29.290 8.139 1.00 98.45 60 A 1 ATOM 488 C CB . ARG A 1 60 ? -10.269 26.485 7.722 1.00 98.07 60 A 1 ATOM 489 C CG . ARG A 1 60 ? -10.898 27.101 8.980 1.00 90.25 60 A 1 ATOM 490 C CD . ARG A 1 60 ? -11.817 26.112 9.690 1.00 90.35 60 A 1 ATOM 491 N NE . ARG A 1 60 ? -11.124 24.860 10.032 1.00 83.04 60 A 1 ATOM 492 C CZ . ARG A 1 60 ? -11.451 23.624 9.701 1.00 79.14 60 A 1 ATOM 493 N NH1 . ARG A 1 60 ? -12.549 23.336 9.067 1.00 68.91 60 A 1 ATOM 494 N NH2 . ARG A 1 60 ? -10.662 22.653 10.021 1.00 70.82 60 A 1 ATOM 495 N N . GLY A 1 61 ? -7.221 27.471 7.823 1.00 98.69 61 A 1 ATOM 496 C CA . GLY A 1 61 ? -6.043 28.015 8.500 1.00 98.67 61 A 1 ATOM 497 C C . GLY A 1 61 ? -5.495 29.280 7.828 1.00 98.75 61 A 1 ATOM 498 O O . GLY A 1 61 ? -5.115 30.230 8.512 1.00 98.57 61 A 1 ATOM 499 N N . ILE A 1 62 ? -5.492 29.336 6.494 1.00 98.83 62 A 1 ATOM 500 C CA . ILE A 1 62 ? -5.108 30.540 5.734 1.00 98.83 62 A 1 ATOM 501 C C . ILE A 1 62 ? -6.064 31.702 6.033 1.00 98.82 62 A 1 ATOM 502 O O . ILE A 1 62 ? -5.602 32.830 6.221 1.00 98.60 62 A 1 ATOM 503 C CB . ILE A 1 62 ? -5.048 30.231 4.221 1.00 98.64 62 A 1 ATOM 504 C CG1 . ILE A 1 62 ? -3.840 29.320 3.904 1.00 97.68 62 A 1 ATOM 505 C CG2 . ILE A 1 62 ? -4.956 31.516 3.370 1.00 97.89 62 A 1 ATOM 506 C CD1 . ILE A 1 62 ? -3.964 28.621 2.543 1.00 96.06 62 A 1 ATOM 507 N N . GLU A 1 63 ? -7.360 31.432 6.110 1.00 98.78 63 A 1 ATOM 508 C CA . GLU A 1 63 ? -8.365 32.449 6.436 1.00 98.69 63 A 1 ATOM 509 C C . GLU A 1 63 ? -8.218 32.978 7.873 1.00 98.66 63 A 1 ATOM 510 O O . GLU A 1 63 ? -8.281 34.189 8.117 1.00 98.17 63 A 1 ATOM 511 C CB . GLU A 1 63 ? -9.754 31.840 6.194 1.00 98.34 63 A 1 ATOM 512 C CG . GLU A 1 63 ? -10.886 32.842 6.442 1.00 95.73 63 A 1 ATOM 513 C CD . GLU A 1 63 ? -12.262 32.307 6.018 1.00 95.05 63 A 1 ATOM 514 O OE1 . GLU A 1 63 ? -13.238 33.069 6.177 1.00 88.84 63 A 1 ATOM 515 O OE2 . GLU A 1 63 ? -12.342 31.167 5.508 1.00 90.57 63 A 1 ATOM 516 N N . LEU A 1 64 ? -7.950 32.091 8.833 1.00 98.67 64 A 1 ATOM 517 C CA . LEU A 1 64 ? -7.872 32.435 10.253 1.00 98.55 64 A 1 ATOM 518 C C . LEU A 1 64 ? -6.562 33.127 10.641 1.00 98.60 64 A 1 ATOM 519 O O . LEU A 1 64 ? -6.576 34.096 11.410 1.00 98.06 64 A 1 ATOM 520 C CB . LEU A 1 64 ? -8.080 31.161 11.089 1.00 98.15 64 A 1 ATOM 521 C CG . LEU A 1 64 ? -9.505 30.577 11.034 1.00 95.75 64 A 1 ATOM 522 C CD1 . LEU A 1 64 ? -9.531 29.258 11.806 1.00 91.61 64 A 1 ATOM 523 C CD2 . LEU A 1 64 ? -10.539 31.519 11.653 1.00 91.30 64 A 1 ATOM 524 N N . PHE A 1 65 ? -5.424 32.649 10.120 1.00 98.63 65 A 1 ATOM 525 C CA . PHE A 1 65 ? -4.087 33.060 10.567 1.00 98.58 65 A 1 ATOM 526 C C . PHE A 1 65 ? -3.299 33.835 9.512 1.00 98.55 65 A 1 ATOM 527 O O . PHE A 1 65 ? -2.419 34.622 9.858 1.00 97.63 65 A 1 ATOM 528 C CB . PHE A 1 65 ? -3.323 31.832 11.065 1.00 98.40 65 A 1 ATOM 529 C CG . PHE A 1 65 ? -4.023 31.110 12.196 1.00 98.33 65 A 1 ATOM 530 C CD1 . PHE A 1 65 ? -3.998 31.645 13.498 1.00 97.19 65 A 1 ATOM 531 C CD2 . PHE A 1 65 ? -4.748 29.930 11.944 1.00 97.34 65 A 1 ATOM 532 C CE1 . PHE A 1 65 ? -4.691 31.009 14.538 1.00 96.62 65 A 1 ATOM 533 C CE2 . PHE A 1 65 ? -5.444 29.292 12.982 1.00 96.81 65 A 1 ATOM 534 C CZ . PHE A 1 65 ? -5.419 29.834 14.278 1.00 97.03 65 A 1 ATOM 535 N N . GLY A 1 66 ? -3.630 33.683 8.251 1.00 98.35 66 A 1 ATOM 536 C CA . GLY A 1 66 ? -2.949 34.318 7.129 1.00 98.35 66 A 1 ATOM 537 C C . GLY A 1 66 ? -1.866 33.447 6.494 1.00 98.49 66 A 1 ATOM 538 O O . GLY A 1 66 ? -1.239 32.593 7.124 1.00 97.82 66 A 1 ATOM 539 N N . VAL A 1 67 ? -1.611 33.701 5.214 1.00 98.50 67 A 1 ATOM 540 C CA . VAL A 1 67 ? -0.565 33.028 4.437 1.00 98.46 67 A 1 ATOM 541 C C . VAL A 1 67 ? 0.804 33.273 5.083 1.00 98.36 67 A 1 ATOM 542 O O . VAL A 1 67 ? 1.135 34.397 5.456 1.00 97.58 67 A 1 ATOM 543 C CB . VAL A 1 67 ? -0.570 33.515 2.977 1.00 98.04 67 A 1 ATOM 544 C CG1 . VAL A 1 67 ? 0.529 32.857 2.143 1.00 96.87 67 A 1 ATOM 545 C CG2 . VAL A 1 67 ? -1.909 33.213 2.289 1.00 97.05 67 A 1 ATOM 546 N N . GLY A 1 68 ? 1.610 32.213 5.201 1.00 97.63 68 A 1 ATOM 547 C CA . GLY A 1 68 ? 2.949 32.272 5.798 1.00 97.21 68 A 1 ATOM 548 C C . GLY A 1 68 ? 2.986 32.014 7.302 1.00 97.60 68 A 1 ATOM 549 O O . GLY A 1 68 ? 4.038 31.620 7.813 1.00 96.33 68 A 1 ATOM 550 N N . ASN A 1 69 ? 1.864 32.124 8.007 1.00 98.20 69 A 1 ATOM 551 C CA . ASN A 1 69 ? 1.759 31.827 9.441 1.00 98.31 69 A 1 ATOM 552 C C . ASN A 1 69 ? 1.611 30.315 9.691 1.00 98.41 69 A 1 ATOM 553 O O . ASN A 1 69 ? 0.678 29.820 10.324 1.00 97.78 69 A 1 ATOM 554 C CB . ASN A 1 69 ? 0.652 32.690 10.060 1.00 98.07 69 A 1 ATOM 555 C CG . ASN A 1 69 ? 0.992 34.170 10.021 1.00 97.02 69 A 1 ATOM 556 O OD1 . ASN A 1 69 ? 2.129 34.591 10.164 1.00 88.47 69 A 1 ATOM 557 N ND2 . ASN A 1 69 ? 0.010 35.018 9.825 1.00 87.35 69 A 1 ATOM 558 N N . TRP A 1 70 ? 2.564 29.551 9.150 1.00 98.26 70 A 1 ATOM 559 C CA . TRP A 1 70 ? 2.495 28.092 9.107 1.00 98.11 70 A 1 ATOM 560 C C . TRP A 1 70 ? 2.521 27.427 10.476 1.00 98.25 70 A 1 ATOM 561 O O . TRP A 1 70 ? 1.970 26.342 10.632 1.00 97.85 70 A 1 ATOM 562 C CB . TRP A 1 70 ? 3.655 27.550 8.268 1.00 97.53 70 A 1 ATOM 563 C CG . TRP A 1 70 ? 3.806 28.161 6.912 1.00 97.38 70 A 1 ATOM 564 C CD1 . TRP A 1 70 ? 4.938 28.695 6.415 1.00 96.36 70 A 1 ATOM 565 C CD2 . TRP A 1 70 ? 2.790 28.333 5.879 1.00 97.15 70 A 1 ATOM 566 N NE1 . TRP A 1 70 ? 4.708 29.187 5.139 1.00 95.85 70 A 1 ATOM 567 C CE2 . TRP A 1 70 ? 3.394 28.997 4.776 1.00 96.49 70 A 1 ATOM 568 C CE3 . TRP A 1 70 ? 1.416 28.005 5.775 1.00 96.29 70 A 1 ATOM 569 C CZ2 . TRP A 1 70 ? 2.667 29.335 3.618 1.00 95.17 70 A 1 ATOM 570 C CZ3 . TRP A 1 70 ? 0.689 28.344 4.619 1.00 95.12 70 A 1 ATOM 571 C CH2 . TRP A 1 70 ? 1.311 29.007 3.555 1.00 94.89 70 A 1 ATOM 572 N N . LYS A 1 71 ? 3.192 28.032 11.468 1.00 98.18 71 A 1 ATOM 573 C CA . LYS A 1 71 ? 3.255 27.466 12.822 1.00 98.01 71 A 1 ATOM 574 C C . LYS A 1 71 ? 1.886 27.497 13.492 1.00 98.21 71 A 1 ATOM 575 O O . LYS A 1 71 ? 1.472 26.489 14.054 1.00 97.67 71 A 1 ATOM 576 C CB . LYS A 1 71 ? 4.278 28.214 13.678 1.00 97.27 71 A 1 ATOM 577 C CG . LYS A 1 71 ? 5.722 27.913 13.261 1.00 85.82 71 A 1 ATOM 578 C CD . LYS A 1 71 ? 6.672 28.649 14.209 1.00 82.67 71 A 1 ATOM 579 C CE . LYS A 1 71 ? 8.130 28.371 13.855 1.00 70.12 71 A 1 ATOM 580 N NZ . LYS A 1 71 ? 9.037 29.119 14.764 1.00 60.43 71 A 1 ATOM 581 N N . GLU A 1 72 ? 1.203 28.620 13.385 1.00 98.30 72 A 1 ATOM 582 C CA . GLU A 1 72 ? -0.137 28.853 13.910 1.00 98.31 72 A 1 ATOM 583 C C . GLU A 1 72 ? -1.148 27.933 13.214 1.00 98.45 72 A 1 ATOM 584 O O . GLU A 1 72 ? -1.844 27.171 13.881 1.00 97.94 72 A 1 ATOM 585 C CB . GLU A 1 72 ? -0.504 30.338 13.727 1.00 97.86 72 A 1 ATOM 586 C CG . GLU A 1 72 ? 0.361 31.338 14.523 1.00 92.54 72 A 1 ATOM 587 C CD . GLU A 1 72 ? 1.767 31.649 13.955 1.00 86.38 72 A 1 ATOM 588 O OE1 . GLU A 1 72 ? 2.489 32.432 14.611 1.00 75.79 72 A 1 ATOM 589 O OE2 . GLU A 1 72 ? 2.171 31.093 12.904 1.00 75.94 72 A 1 ATOM 590 N N . ILE A 1 73 ? -1.122 27.896 11.880 1.00 98.59 73 A 1 ATOM 591 C CA . ILE A 1 73 ? -1.967 26.997 11.078 1.00 98.63 73 A 1 ATOM 592 C C . ILE A 1 73 ? -1.712 25.534 11.453 1.00 98.58 73 A 1 ATOM 593 O O . ILE A 1 73 ? -2.644 24.762 11.664 1.00 98.28 73 A 1 ATOM 594 C CB . ILE A 1 73 ? -1.730 27.230 9.567 1.00 98.56 73 A 1 ATOM 595 C CG1 . ILE A 1 73 ? -2.184 28.652 9.157 1.00 98.18 73 A 1 ATOM 596 C CG2 . ILE A 1 73 ? -2.459 26.170 8.717 1.00 98.19 73 A 1 ATOM 597 C CD1 . ILE A 1 73 ? -1.790 29.060 7.731 1.00 97.31 73 A 1 ATOM 598 N N . ASN A 1 74 ? -0.440 25.134 11.559 1.00 98.57 74 A 1 ATOM 599 C CA . ASN A 1 74 ? -0.096 23.755 11.890 1.00 98.41 74 A 1 ATOM 600 C C . ASN A 1 74 ? -0.570 23.366 13.298 1.00 98.29 74 A 1 ATOM 601 O O . ASN A 1 74 ? -1.045 22.246 13.501 1.00 97.69 74 A 1 ATOM 602 C CB . ASN A 1 74 ? 1.423 23.580 11.733 1.00 97.94 74 A 1 ATOM 603 C CG . ASN A 1 74 ? 1.881 22.132 11.851 1.00 97.61 74 A 1 ATOM 604 O OD1 . ASN A 1 74 ? 1.135 21.175 11.809 1.00 94.92 74 A 1 ATOM 605 N ND2 . ASN A 1 74 ? 3.172 21.919 11.979 1.00 94.08 74 A 1 ATOM 606 N N . TYR A 1 75 ? -0.432 24.280 14.268 1.00 98.32 75 A 1 ATOM 607 C CA . TYR A 1 75 ? -0.842 24.011 15.643 1.00 98.09 75 A 1 ATOM 608 C C . TYR A 1 75 ? -2.365 23.895 15.774 1.00 98.15 75 A 1 ATOM 609 O O . TYR A 1 75 ? -2.845 22.932 16.374 1.00 97.10 75 A 1 ATOM 610 C CB . TYR A 1 75 ? -0.273 25.100 16.558 1.00 97.40 75 A 1 ATOM 611 C CG . TYR A 1 75 ? -0.492 24.799 18.024 1.00 88.16 75 A 1 ATOM 612 C CD1 . TYR A 1 75 ? -1.594 25.350 18.707 1.00 81.43 75 A 1 ATOM 613 C CD2 . TYR A 1 75 ? 0.386 23.933 18.706 1.00 80.04 75 A 1 ATOM 614 C CE1 . TYR A 1 75 ? -1.813 25.046 20.058 1.00 73.12 75 A 1 ATOM 615 C CE2 . TYR A 1 75 ? 0.177 23.622 20.059 1.00 71.45 75 A 1 ATOM 616 C CZ . TYR A 1 75 ? -0.926 24.184 20.729 1.00 70.11 75 A 1 ATOM 617 O OH . TYR A 1 75 ? -1.139 23.885 22.052 1.00 69.85 75 A 1 ATOM 618 N N . ASP A 1 76 ? -3.098 24.825 15.173 1.00 98.06 76 A 1 ATOM 619 C CA . ASP A 1 76 ? -4.558 24.890 15.278 1.00 97.85 76 A 1 ATOM 620 C C . ASP A 1 76 ? -5.251 23.814 14.430 1.00 97.92 76 A 1 ATOM 621 O O . ASP A 1 76 ? -6.018 22.993 14.933 1.00 96.75 76 A 1 ATOM 622 C CB . ASP A 1 76 ? -4.998 26.301 14.880 1.00 97.30 76 A 1 ATOM 623 C CG . ASP A 1 76 ? -6.454 26.573 15.252 1.00 92.52 76 A 1 ATOM 624 O OD1 . ASP A 1 76 ? -6.705 26.710 16.473 1.00 84.40 76 A 1 ATOM 625 O OD2 . ASP A 1 76 ? -7.285 26.687 14.328 1.00 83.56 76 A 1 ATOM 626 N N . GLU A 1 77 ? -4.912 23.738 13.146 1.00 98.06 77 A 1 ATOM 627 C CA . GLU A 1 77 ? -5.626 22.912 12.173 1.00 97.95 77 A 1 ATOM 628 C C . GLU A 1 77 ? -5.075 21.489 12.023 1.00 97.81 77 A 1 ATOM 629 O O . GLU A 1 77 ? -5.786 20.577 11.601 1.00 96.24 77 A 1 ATOM 630 C CB . GLU A 1 77 ? -5.620 23.633 10.819 1.00 97.53 77 A 1 ATOM 631 C CG . GLU A 1 77 ? -6.418 24.951 10.833 1.00 95.41 77 A 1 ATOM 632 C CD . GLU A 1 77 ? -7.932 24.705 10.969 1.00 94.88 77 A 1 ATOM 633 O OE1 . GLU A 1 77 ? -8.702 25.665 11.121 1.00 87.39 77 A 1 ATOM 634 O OE2 . GLU A 1 77 ? -8.390 23.545 10.816 1.00 89.62 77 A 1 ATOM 635 N N . PHE A 1 78 ? -3.790 21.273 12.356 1.00 97.83 78 A 1 ATOM 636 C CA . PHE A 1 78 ? -3.109 19.989 12.147 1.00 97.67 78 A 1 ATOM 637 C C . PHE A 1 78 ? -2.520 19.388 13.429 1.00 97.22 78 A 1 ATOM 638 O O . PHE A 1 78 ? -1.790 18.388 13.368 1.00 94.99 78 A 1 ATOM 639 C CB . PHE A 1 78 ? -2.059 20.125 11.037 1.00 97.59 78 A 1 ATOM 640 C CG . PHE A 1 78 ? -2.622 20.538 9.694 1.00 98.02 78 A 1 ATOM 641 C CD1 . PHE A 1 78 ? -3.065 19.565 8.773 1.00 97.53 78 A 1 ATOM 642 C CD2 . PHE A 1 78 ? -2.729 21.900 9.355 1.00 97.60 78 A 1 ATOM 643 C CE1 . PHE A 1 78 ? -3.597 19.948 7.534 1.00 97.31 78 A 1 ATOM 644 C CE2 . PHE A 1 78 ? -3.265 22.291 8.116 1.00 97.43 78 A 1 ATOM 645 C CZ . PHE A 1 78 ? -3.698 21.314 7.205 1.00 97.72 78 A 1 ATOM 646 N N . SER A 1 79 ? -2.802 19.963 14.586 1.00 97.77 79 A 1 ATOM 647 C CA . SER A 1 79 ? -2.241 19.537 15.880 1.00 97.33 79 A 1 ATOM 648 C C . SER A 1 79 ? -0.702 19.475 15.885 1.00 97.47 79 A 1 ATOM 649 O O . SER A 1 79 ? -0.105 18.589 16.500 1.00 95.03 79 A 1 ATOM 650 C CB . SER A 1 79 ? -2.854 18.207 16.335 1.00 96.15 79 A 1 ATOM 651 O OG . SER A 1 79 ? -4.265 18.224 16.329 1.00 89.20 79 A 1 ATOM 652 N N . GLY A 1 80 ? -0.048 20.358 15.134 1.00 97.14 80 A 1 ATOM 653 C CA . GLY A 1 80 ? 1.412 20.421 14.996 1.00 96.88 80 A 1 ATOM 654 C C . GLY A 1 80 ? 2.051 19.291 14.176 1.00 96.77 80 A 1 ATOM 655 O O . GLY A 1 80 ? 3.278 19.186 14.139 1.00 94.64 80 A 1 ATOM 656 N N . LYS A 1 81 ? 1.259 18.429 13.533 1.00 96.37 81 A 1 ATOM 657 C CA . LYS A 1 81 ? 1.752 17.221 12.838 1.00 95.00 81 A 1 ATOM 658 C C . LYS A 1 81 ? 2.063 17.439 11.358 1.00 94.96 81 A 1 ATOM 659 O O . LYS A 1 81 ? 2.719 16.592 10.750 1.00 92.75 81 A 1 ATOM 660 C CB . LYS A 1 81 ? 0.739 16.082 12.994 1.00 93.49 81 A 1 ATOM 661 C CG . LYS A 1 81 ? 0.557 15.659 14.457 1.00 89.52 81 A 1 ATOM 662 C CD . LYS A 1 81 ? -0.488 14.546 14.553 1.00 81.28 81 A 1 ATOM 663 C CE . LYS A 1 81 ? -0.717 14.189 16.020 1.00 74.00 81 A 1 ATOM 664 N NZ . LYS A 1 81 ? -1.831 13.225 16.183 1.00 64.29 81 A 1 ATOM 665 N N . ALA A 1 82 ? 1.594 18.529 10.765 1.00 95.08 82 A 1 ATOM 666 C CA . ALA A 1 82 ? 1.827 18.805 9.353 1.00 95.12 82 A 1 ATOM 667 C C . ALA A 1 82 ? 3.285 19.217 9.093 1.00 94.84 82 A 1 ATOM 668 O O . ALA A 1 82 ? 3.963 19.821 9.927 1.00 93.36 82 A 1 ATOM 669 C CB . ALA A 1 82 ? 0.837 19.858 8.857 1.00 94.88 82 A 1 ATOM 670 N N . ASN A 1 83 ? 3.763 18.911 7.878 1.00 95.41 83 A 1 ATOM 671 C CA . ASN A 1 83 ? 5.030 19.438 7.397 1.00 94.84 83 A 1 ATOM 672 C C . ASN A 1 83 ? 4.813 20.878 6.899 1.00 95.59 83 A 1 ATOM 673 O O . ASN A 1 83 ? 4.120 21.093 5.910 1.00 94.90 83 A 1 ATOM 674 C CB . ASN A 1 83 ? 5.571 18.492 6.314 1.00 92.71 83 A 1 ATOM 675 C CG . ASN A 1 83 ? 6.915 18.924 5.757 1.00 89.60 83 A 1 ATOM 676 O OD1 . ASN A 1 83 ? 7.399 20.023 5.945 1.00 82.28 83 A 1 ATOM 677 N ND2 . ASN A 1 83 ? 7.568 18.045 5.032 1.00 80.50 83 A 1 ATOM 678 N N . ILE A 1 84 ? 5.452 21.858 7.547 1.00 94.31 84 A 1 ATOM 679 C CA . ILE A 1 84 ? 5.331 23.285 7.193 1.00 94.68 84 A 1 ATOM 680 C C . ILE A 1 84 ? 5.697 23.548 5.723 1.00 95.40 84 A 1 ATOM 681 O O . ILE A 1 84 ? 5.049 24.347 5.055 1.00 94.22 84 A 1 ATOM 682 C CB . ILE A 1 84 ? 6.190 24.139 8.155 1.00 92.43 84 A 1 ATOM 683 C CG1 . ILE A 1 84 ? 5.583 24.087 9.579 1.00 84.60 84 A 1 ATOM 684 C CG2 . ILE A 1 84 ? 6.315 25.586 7.664 1.00 81.43 84 A 1 ATOM 685 C CD1 . ILE A 1 84 ? 6.427 24.794 10.649 1.00 77.53 84 A 1 ATOM 686 N N . VAL A 1 85 ? 6.705 22.843 5.190 1.00 94.42 85 A 1 ATOM 687 C CA . VAL A 1 85 ? 7.082 22.963 3.771 1.00 93.78 85 A 1 ATOM 688 C C . VAL A 1 85 ? 5.950 22.475 2.869 1.00 94.75 85 A 1 ATOM 689 O O . VAL A 1 85 ? 5.685 23.080 1.833 1.00 94.38 85 A 1 ATOM 690 C CB . VAL A 1 85 ? 8.377 22.184 3.468 1.00 92.04 85 A 1 ATOM 691 C CG1 . VAL A 1 85 ? 8.791 22.298 2.000 1.00 87.19 85 A 1 ATOM 692 C CG2 . VAL A 1 85 ? 9.545 22.697 4.324 1.00 87.08 85 A 1 ATOM 693 N N . GLU A 1 86 ? 5.252 21.416 3.265 1.00 94.92 86 A 1 ATOM 694 C CA . GLU A 1 86 ? 4.086 20.952 2.519 1.00 95.32 86 A 1 ATOM 695 C C . GLU A 1 86 ? 2.949 21.977 2.568 1.00 96.13 86 A 1 ATOM 696 O O . GLU A 1 86 ? 2.359 22.249 1.529 1.00 95.99 86 A 1 ATOM 697 C CB . GLU A 1 86 ? 3.644 19.564 3.000 1.00 94.44 86 A 1 ATOM 698 C CG . GLU A 1 86 ? 2.458 19.055 2.165 1.00 93.16 86 A 1 ATOM 699 C CD . GLU A 1 86 ? 2.138 17.570 2.333 1.00 92.89 86 A 1 ATOM 700 O OE1 . GLU A 1 86 ? 1.377 17.066 1.468 1.00 88.43 86 A 1 ATOM 701 O OE2 . GLU A 1 86 ? 2.656 16.926 3.271 1.00 89.46 86 A 1 ATOM 702 N N . LEU A 1 87 ? 2.697 22.611 3.723 1.00 96.66 87 A 1 ATOM 703 C CA . LEU A 1 87 ? 1.680 23.668 3.835 1.00 97.41 87 A 1 ATOM 704 C C . LEU A 1 87 ? 1.961 24.825 2.867 1.00 97.45 87 A 1 ATOM 705 O O . LEU A 1 87 ? 1.053 25.276 2.169 1.00 97.32 87 A 1 ATOM 706 C CB . LEU A 1 87 ? 1.581 24.195 5.279 1.00 97.73 87 A 1 ATOM 707 C CG . LEU A 1 87 ? 1.205 23.164 6.358 1.00 97.16 87 A 1 ATOM 708 C CD1 . LEU A 1 87 ? 1.078 23.866 7.709 1.00 96.66 87 A 1 ATOM 709 C CD2 . LEU A 1 87 ? -0.111 22.450 6.059 1.00 96.19 87 A 1 ATOM 710 N N . GLU A 1 88 ? 3.222 25.252 2.749 1.00 96.82 88 A 1 ATOM 711 C CA . GLU A 1 88 ? 3.629 26.280 1.785 1.00 96.28 88 A 1 ATOM 712 C C . GLU A 1 88 ? 3.374 25.833 0.337 1.00 96.74 88 A 1 ATOM 713 O O . GLU A 1 88 ? 2.748 26.550 -0.446 1.00 96.22 88 A 1 ATOM 714 C CB . GLU A 1 88 ? 5.113 26.629 1.992 1.00 94.86 88 A 1 ATOM 715 C CG . GLU A 1 88 ? 5.519 27.901 1.225 1.00 88.56 88 A 1 ATOM 716 C CD . GLU A 1 88 ? 7.039 28.098 1.154 1.00 82.92 88 A 1 ATOM 717 O OE1 . GLU A 1 88 ? 7.512 28.566 0.085 1.00 75.61 88 A 1 ATOM 718 O OE2 . GLU A 1 88 ? 7.746 27.730 2.115 1.00 75.49 88 A 1 ATOM 719 N N . LEU A 1 89 ? 3.806 24.621 -0.023 1.00 96.48 89 A 1 ATOM 720 C CA . LEU A 1 89 ? 3.625 24.081 -1.373 1.00 96.34 89 A 1 ATOM 721 C C . LEU A 1 89 ? 2.144 23.899 -1.730 1.00 96.87 89 A 1 ATOM 722 O O . LEU A 1 89 ? 1.726 24.234 -2.841 1.00 96.68 89 A 1 ATOM 723 C CB . LEU A 1 89 ? 4.367 22.740 -1.487 1.00 95.41 89 A 1 ATOM 724 C CG . LEU A 1 89 ? 5.901 22.842 -1.443 1.00 93.17 89 A 1 ATOM 725 C CD1 . LEU A 1 89 ? 6.500 21.436 -1.405 1.00 90.07 89 A 1 ATOM 726 C CD2 . LEU A 1 89 ? 6.460 23.568 -2.665 1.00 89.58 89 A 1 ATOM 727 N N . ARG A 1 90 ? 1.339 23.413 -0.791 1.00 97.48 90 A 1 ATOM 728 C CA . ARG A 1 90 ? -0.114 23.269 -0.953 1.00 97.56 90 A 1 ATOM 729 C C . ARG A 1 90 ? -0.783 24.630 -1.112 1.00 97.95 90 A 1 ATOM 730 O O . ARG A 1 90 ? -1.661 24.770 -1.952 1.00 97.70 90 A 1 ATOM 731 C CB . ARG A 1 90 ? -0.699 22.514 0.247 1.00 97.02 90 A 1 ATOM 732 C CG . ARG A 1 90 ? -0.258 21.044 0.350 1.00 95.04 90 A 1 ATOM 733 C CD . ARG A 1 90 ? -0.912 20.139 -0.680 1.00 93.47 90 A 1 ATOM 734 N NE . ARG A 1 90 ? -0.416 18.766 -0.504 1.00 91.90 90 A 1 ATOM 735 C CZ . ARG A 1 90 ? -0.663 17.726 -1.269 1.00 92.52 90 A 1 ATOM 736 N NH1 . ARG A 1 90 ? -1.465 17.791 -2.301 1.00 85.62 90 A 1 ATOM 737 N NH2 . ARG A 1 90 ? -0.079 16.589 -1.008 1.00 88.50 90 A 1 ATOM 738 N N . THR A 1 91 ? -0.315 25.653 -0.392 1.00 98.09 91 A 1 ATOM 739 C CA . THR A 1 91 ? -0.818 27.027 -0.538 1.00 98.36 91 A 1 ATOM 740 C C . THR A 1 91 ? -0.474 27.618 -1.901 1.00 98.34 91 A 1 ATOM 741 O O . THR A 1 91 ? -1.326 28.253 -2.518 1.00 98.13 91 A 1 ATOM 742 C CB . THR A 1 91 ? -0.315 27.920 0.596 1.00 98.37 91 A 1 ATOM 743 O OG1 . THR A 1 91 ? -0.729 27.359 1.819 1.00 96.75 91 A 1 ATOM 744 C CG2 . THR A 1 91 ? -0.908 29.323 0.526 1.00 96.76 91 A 1 ATOM 745 N N . CYS A 1 92 ? 0.712 27.334 -2.454 1.00 98.00 92 A 1 ATOM 746 C CA . CYS A 1 92 ? 1.020 27.685 -3.844 1.00 97.71 92 A 1 ATOM 747 C C . CYS A 1 92 ? -0.010 27.091 -4.821 1.00 97.91 92 A 1 ATOM 748 O O . CYS A 1 92 ? -0.459 27.768 -5.744 1.00 97.58 92 A 1 ATOM 749 C CB . CYS A 1 92 ? 2.429 27.195 -4.219 1.00 96.98 92 A 1 ATOM 750 S SG . CYS A 1 92 ? 3.730 28.066 -3.300 1.00 95.46 92 A 1 ATOM 751 N N . MET A 1 93 ? -0.422 25.839 -4.611 1.00 97.68 93 A 1 ATOM 752 C CA . MET A 1 93 ? -1.455 25.200 -5.439 1.00 97.47 93 A 1 ATOM 753 C C . MET A 1 93 ? -2.852 25.797 -5.216 1.00 97.72 93 A 1 ATOM 754 O O . MET A 1 93 ? -3.606 25.943 -6.178 1.00 97.29 93 A 1 ATOM 755 C CB . MET A 1 93 ? -1.504 23.700 -5.159 1.00 96.72 93 A 1 ATOM 756 C CG . MET A 1 93 ? -0.231 22.958 -5.579 1.00 93.80 93 A 1 ATOM 757 S SD . MET A 1 93 ? -0.238 21.207 -5.098 1.00 89.56 93 A 1 ATOM 758 C CE . MET A 1 93 ? -1.742 20.631 -5.933 1.00 76.16 93 A 1 ATOM 759 N N . ILE A 1 94 ? -3.188 26.155 -3.972 1.00 98.29 94 A 1 ATOM 760 C CA . ILE A 1 94 ? -4.463 26.803 -3.618 1.00 98.41 94 A 1 ATOM 761 C C . ILE A 1 94 ? -4.589 28.150 -4.328 1.00 98.48 94 A 1 ATOM 762 O O . ILE A 1 94 ? -5.632 28.431 -4.914 1.00 98.28 94 A 1 ATOM 763 C CB . ILE A 1 94 ? -4.599 26.933 -2.082 1.00 98.38 94 A 1 ATOM 764 C CG1 . ILE A 1 94 ? -4.894 25.548 -1.465 1.00 97.92 94 A 1 ATOM 765 C CG2 . ILE A 1 94 ? -5.706 27.926 -1.678 1.00 97.84 94 A 1 ATOM 766 C CD1 . ILE A 1 94 ? -4.715 25.498 0.057 1.00 96.95 94 A 1 ATOM 767 N N . LEU A 1 95 ? -3.516 28.947 -4.335 1.00 98.23 95 A 1 ATOM 768 C CA . LEU A 1 95 ? -3.482 30.289 -4.931 1.00 98.39 95 A 1 ATOM 769 C C . LEU A 1 95 ? -3.069 30.295 -6.414 1.00 98.34 95 A 1 ATOM 770 O O . LEU A 1 95 ? -3.105 31.337 -7.069 1.00 97.94 95 A 1 ATOM 771 C CB . LEU A 1 95 ? -2.580 31.192 -4.070 1.00 98.44 95 A 1 ATOM 772 C CG . LEU A 1 95 ? -3.014 31.331 -2.595 1.00 98.13 95 A 1 ATOM 773 C CD1 . LEU A 1 95 ? -2.057 32.272 -1.871 1.00 97.61 95 A 1 ATOM 774 C CD2 . LEU A 1 95 ? -4.434 31.883 -2.447 1.00 97.34 95 A 1 ATOM 775 N N . GLY A 1 96 ? -2.664 29.140 -6.967 1.00 97.92 96 A 1 ATOM 776 C CA . GLY A 1 96 ? -2.321 28.993 -8.384 1.00 97.77 96 A 1 ATOM 777 C C . GLY A 1 96 ? -1.043 29.721 -8.813 1.00 97.82 96 A 1 ATOM 778 O O . GLY A 1 96 ? -0.919 30.105 -9.977 1.00 96.82 96 A 1 ATOM 779 N N . ILE A 1 97 ? -0.086 29.920 -7.901 1.00 97.36 97 A 1 ATOM 780 C CA . ILE A 1 97 ? 1.179 30.625 -8.148 1.00 97.08 97 A 1 ATOM 781 C C . ILE A 1 97 ? 2.344 29.929 -7.431 1.00 96.65 97 A 1 ATOM 782 O O . ILE A 1 97 ? 2.176 29.379 -6.347 1.00 95.79 97 A 1 ATOM 783 C CB . ILE A 1 97 ? 1.029 32.115 -7.768 1.00 96.67 97 A 1 ATOM 784 C CG1 . ILE A 1 97 ? 2.187 32.955 -8.340 1.00 94.38 97 A 1 ATOM 785 C CG2 . ILE A 1 97 ? 0.886 32.305 -6.245 1.00 92.73 97 A 1 ATOM 786 C CD1 . ILE A 1 97 ? 1.956 34.472 -8.228 1.00 92.42 97 A 1 ATOM 787 N N . ASN A 1 98 ? 3.539 29.925 -8.037 1.00 95.69 98 A 1 ATOM 788 C CA . ASN A 1 98 ? 4.710 29.241 -7.470 1.00 94.47 98 A 1 ATOM 789 C C . ASN A 1 98 ? 5.421 30.022 -6.352 1.00 94.18 98 A 1 ATOM 790 O O . ASN A 1 98 ? 6.172 29.431 -5.576 1.00 92.41 98 A 1 ATOM 791 C CB . ASN A 1 98 ? 5.686 28.883 -8.602 1.00 92.71 98 A 1 ATOM 792 C CG . ASN A 1 98 ? 6.398 30.086 -9.207 1.00 92.04 98 A 1 ATOM 793 O OD1 . ASN A 1 98 ? 5.916 31.198 -9.240 1.00 85.82 98 A 1 ATOM 794 N ND2 . ASN A 1 98 ? 7.592 29.885 -9.719 1.00 85.87 98 A 1 ATOM 795 N N . ASP A 1 99 ? 5.197 31.332 -6.284 1.00 94.27 99 A 1 ATOM 796 C CA . ASP A 1 99 ? 5.720 32.232 -5.257 1.00 94.08 99 A 1 ATOM 797 C C . ASP A 1 99 ? 4.553 32.974 -4.606 1.00 95.14 99 A 1 ATOM 798 O O . ASP A 1 99 ? 3.866 33.771 -5.246 1.00 94.47 99 A 1 ATOM 799 C CB . ASP A 1 99 ? 6.742 33.184 -5.886 1.00 92.03 99 A 1 ATOM 800 C CG . ASP A 1 99 ? 7.367 34.155 -4.879 1.00 90.20 99 A 1 ATOM 801 O OD1 . ASP A 1 99 ? 6.997 34.113 -3.684 1.00 86.16 99 A 1 ATOM 802 O OD2 . ASP A 1 99 ? 8.212 34.961 -5.318 1.00 83.83 99 A 1 ATOM 803 N N . ILE A 1 100 ? 4.323 32.688 -3.329 1.00 95.16 100 A 1 ATOM 804 C CA . ILE A 1 100 ? 3.210 33.223 -2.538 1.00 95.82 100 A 1 ATOM 805 C C . ILE A 1 100 ? 3.646 34.325 -1.570 1.00 96.19 100 A 1 ATOM 806 O O . ILE A 1 100 ? 2.850 34.751 -0.740 1.00 95.49 100 A 1 ATOM 807 C CB . ILE A 1 100 ? 2.449 32.093 -1.821 1.00 95.56 100 A 1 ATOM 808 C CG1 . ILE A 1 100 ? 3.395 31.244 -0.939 1.00 93.87 100 A 1 ATOM 809 C CG2 . ILE A 1 100 ? 1.699 31.242 -2.856 1.00 92.01 100 A 1 ATOM 810 C CD1 . ILE A 1 100 ? 2.655 30.273 -0.021 1.00 93.06 100 A 1 ATOM 811 N N . THR A 1 101 ? 4.890 34.813 -1.675 1.00 95.39 101 A 1 ATOM 812 C CA . THR A 1 101 ? 5.437 35.843 -0.775 1.00 94.60 101 A 1 ATOM 813 C C . THR A 1 101 ? 4.601 37.124 -0.771 1.00 95.54 101 A 1 ATOM 814 O O . THR A 1 101 ? 4.424 37.737 0.278 1.00 94.48 101 A 1 ATOM 815 C CB . THR A 1 101 ? 6.886 36.199 -1.135 1.00 91.94 101 A 1 ATOM 816 O OG1 . THR A 1 101 ? 6.999 36.519 -2.495 1.00 83.04 101 A 1 ATOM 817 C CG2 . THR A 1 101 ? 7.859 35.066 -0.814 1.00 80.61 101 A 1 ATOM 818 N N . GLU A 1 102 ? 3.996 37.491 -1.903 1.00 95.74 102 A 1 ATOM 819 C CA . GLU A 1 102 ? 3.114 38.663 -2.003 1.00 95.80 102 A 1 ATOM 820 C C . GLU A 1 102 ? 1.800 38.531 -1.210 1.00 96.91 102 A 1 ATOM 821 O O . GLU A 1 102 ? 1.122 39.531 -0.970 1.00 95.98 102 A 1 ATOM 822 C CB . GLU A 1 102 ? 2.840 38.987 -3.477 1.00 93.35 102 A 1 ATOM 823 C CG . GLU A 1 102 ? 1.876 38.007 -4.185 1.00 83.66 102 A 1 ATOM 824 C CD . GLU A 1 102 ? 1.753 38.306 -5.699 1.00 81.90 102 A 1 ATOM 825 O OE1 . GLU A 1 102 ? 1.288 37.434 -6.458 1.00 74.82 102 A 1 ATOM 826 O OE2 . GLU A 1 102 ? 2.208 39.388 -6.158 1.00 78.03 102 A 1 ATOM 827 N N . TYR A 1 103 ? 1.452 37.313 -0.785 1.00 97.17 103 A 1 ATOM 828 C CA . TYR A 1 103 ? 0.269 37.015 0.023 1.00 97.89 103 A 1 ATOM 829 C C . TYR A 1 103 ? 0.588 36.859 1.515 1.00 98.19 103 A 1 ATOM 830 O O . TYR A 1 103 ? -0.338 36.739 2.311 1.00 97.62 103 A 1 ATOM 831 C CB . TYR A 1 103 ? -0.435 35.767 -0.528 1.00 97.92 103 A 1 ATOM 832 C CG . TYR A 1 103 ? -0.828 35.876 -1.986 1.00 98.07 103 A 1 ATOM 833 C CD1 . TYR A 1 103 ? -2.013 36.542 -2.358 1.00 97.12 103 A 1 ATOM 834 C CD2 . TYR A 1 103 ? 0.006 35.340 -2.984 1.00 97.25 103 A 1 ATOM 835 C CE1 . TYR A 1 103 ? -2.356 36.678 -3.714 1.00 96.78 103 A 1 ATOM 836 C CE2 . TYR A 1 103 ? -0.326 35.475 -4.345 1.00 97.01 103 A 1 ATOM 837 C CZ . TYR A 1 103 ? -1.506 36.148 -4.708 1.00 97.33 103 A 1 ATOM 838 O OH . TYR A 1 103 ? -1.816 36.300 -6.031 1.00 96.40 103 A 1 ATOM 839 N N . TYR A 1 104 ? 1.867 36.861 1.910 1.00 97.31 104 A 1 ATOM 840 C CA . TYR A 1 104 ? 2.244 36.659 3.305 1.00 97.23 104 A 1 ATOM 841 C C . TYR A 1 104 ? 1.570 37.675 4.236 1.00 97.56 104 A 1 ATOM 842 O O . TYR A 1 104 ? 1.456 38.862 3.932 1.00 95.96 104 A 1 ATOM 843 C CB . TYR A 1 104 ? 3.769 36.663 3.480 1.00 95.73 104 A 1 ATOM 844 C CG . TYR A 1 104 ? 4.520 35.423 3.013 1.00 92.80 104 A 1 ATOM 845 C CD1 . TYR A 1 104 ? 3.864 34.274 2.533 1.00 85.26 104 A 1 ATOM 846 C CD2 . TYR A 1 104 ? 5.930 35.412 3.104 1.00 84.77 104 A 1 ATOM 847 C CE1 . TYR A 1 104 ? 4.590 33.132 2.147 1.00 82.58 104 A 1 ATOM 848 C CE2 . TYR A 1 104 ? 6.666 34.278 2.724 1.00 82.41 104 A 1 ATOM 849 C CZ . TYR A 1 104 ? 5.994 33.141 2.243 1.00 82.73 104 A 1 ATOM 850 O OH . TYR A 1 104 ? 6.714 32.034 1.869 1.00 80.65 104 A 1 ATOM 851 N N . GLY A 1 105 ? 1.092 37.173 5.372 1.00 97.29 105 A 1 ATOM 852 C CA . GLY A 1 105 ? 0.332 37.934 6.363 1.00 97.42 105 A 1 ATOM 853 C C . GLY A 1 105 ? -1.129 38.203 5.988 1.00 97.94 105 A 1 ATOM 854 O O . GLY A 1 105 ? -1.895 38.628 6.856 1.00 96.33 105 A 1 ATOM 855 N N . LYS A 1 106 ? -1.545 37.947 4.751 1.00 98.19 106 A 1 ATOM 856 C CA . LYS A 1 106 ? -2.934 38.143 4.334 1.00 98.22 106 A 1 ATOM 857 C C . LYS A 1 106 ? -3.790 36.959 4.767 1.00 98.42 106 A 1 ATOM 858 O O . LYS A 1 106 ? -3.480 35.814 4.442 1.00 97.86 106 A 1 ATOM 859 C CB . LYS A 1 106 ? -3.046 38.370 2.822 1.00 97.65 106 A 1 ATOM 860 C CG . LYS A 1 106 ? -2.267 39.604 2.353 1.00 94.05 106 A 1 ATOM 861 C CD . LYS A 1 106 ? -2.458 39.806 0.848 1.00 89.30 106 A 1 ATOM 862 C CE . LYS A 1 106 ? -1.618 40.986 0.364 1.00 82.53 106 A 1 ATOM 863 N NZ . LYS A 1 106 ? -1.588 41.052 -1.120 1.00 71.97 106 A 1 ATOM 864 N N . LYS A 1 107 ? -4.882 37.270 5.454 1.00 98.54 107 A 1 ATOM 865 C CA . LYS A 1 107 ? -5.978 36.331 5.702 1.00 98.63 107 A 1 ATOM 866 C C . LYS A 1 107 ? -6.892 36.365 4.485 1.00 98.62 107 A 1 ATOM 867 O O . LYS A 1 107 ? -7.291 37.452 4.072 1.00 97.92 107 A 1 ATOM 868 C CB . LYS A 1 107 ? -6.732 36.715 6.975 1.00 98.41 107 A 1 ATOM 869 C CG . LYS A 1 107 ? -5.826 36.688 8.206 1.00 97.81 107 A 1 ATOM 870 C CD . LYS A 1 107 ? -6.644 36.978 9.462 1.00 96.91 107 A 1 ATOM 871 C CE . LYS A 1 107 ? -5.730 36.972 10.684 1.00 93.90 107 A 1 ATOM 872 N NZ . LYS A 1 107 ? -6.528 36.913 11.933 1.00 90.69 107 A 1 ATOM 873 N N . ILE A 1 108 ? -7.140 35.211 3.893 1.00 98.68 108 A 1 ATOM 874 C CA . ILE A 1 108 ? -7.852 35.096 2.621 1.00 98.71 108 A 1 ATOM 875 C C . ILE A 1 108 ? -8.940 34.042 2.807 1.00 98.76 108 A 1 ATOM 876 O O . ILE A 1 108 ? -8.609 32.897 3.121 1.00 98.52 108 A 1 ATOM 877 C CB . ILE A 1 108 ? -6.892 34.717 1.471 1.00 98.51 108 A 1 ATOM 878 C CG1 . ILE A 1 108 ? -5.628 35.613 1.416 1.00 97.39 108 A 1 ATOM 879 C CG2 . ILE A 1 108 ? -7.645 34.795 0.137 1.00 97.23 108 A 1 ATOM 880 C CD1 . ILE A 1 108 ? -4.594 35.182 0.362 1.00 96.70 108 A 1 ATOM 881 N N . SER A 1 109 ? -10.193 34.416 2.603 1.00 98.75 109 A 1 ATOM 882 C CA . SER A 1 109 ? -11.313 33.482 2.710 1.00 98.71 109 A 1 ATOM 883 C C . SER A 1 109 ? -11.223 32.366 1.666 1.00 98.77 109 A 1 ATOM 884 O O . SER A 1 109 ? -10.537 32.501 0.646 1.00 98.52 109 A 1 ATOM 885 C CB . SER A 1 109 ? -12.645 34.228 2.583 1.00 98.29 109 A 1 ATOM 886 O OG . SER A 1 109 ? -12.796 34.756 1.279 1.00 95.42 109 A 1 ATOM 887 N N . GLU A 1 110 ? -11.923 31.258 1.872 1.00 98.45 110 A 1 ATOM 888 C CA . GLU A 1 110 ? -11.937 30.154 0.900 1.00 98.12 110 A 1 ATOM 889 C C . GLU A 1 110 ? -12.413 30.612 -0.491 1.00 98.29 110 A 1 ATOM 890 O O . GLU A 1 110 ? -11.843 30.200 -1.503 1.00 97.73 110 A 1 ATOM 891 C CB . GLU A 1 110 ? -12.827 28.991 1.389 1.00 96.80 110 A 1 ATOM 892 C CG . GLU A 1 110 ? -12.256 28.210 2.583 1.00 87.24 110 A 1 ATOM 893 C CD . GLU A 1 110 ? -12.975 26.865 2.839 1.00 83.87 110 A 1 ATOM 894 O OE1 . GLU A 1 110 ? -12.803 26.275 3.927 1.00 76.40 110 A 1 ATOM 895 O OE2 . GLU A 1 110 ? -13.651 26.311 1.934 1.00 78.34 110 A 1 ATOM 896 N N . GLU A 1 111 ? -13.399 31.494 -0.558 1.00 98.43 111 A 1 ATOM 897 C CA . GLU A 1 111 ? -13.908 32.050 -1.814 1.00 98.33 111 A 1 ATOM 898 C C . GLU A 1 111 ? -12.860 32.930 -2.508 1.00 98.48 111 A 1 ATOM 899 O O . GLU A 1 111 ? -12.568 32.745 -3.693 1.00 97.88 111 A 1 ATOM 900 C CB . GLU A 1 111 ? -15.189 32.853 -1.544 1.00 97.68 111 A 1 ATOM 901 C CG . GLU A 1 111 ? -16.359 31.943 -1.122 1.00 83.48 111 A 1 ATOM 902 C CD . GLU A 1 111 ? -17.655 32.708 -0.821 1.00 76.63 111 A 1 ATOM 903 O OE1 . GLU A 1 111 ? -18.711 32.035 -0.767 1.00 69.85 111 A 1 ATOM 904 O OE2 . GLU A 1 111 ? -17.606 33.941 -0.642 1.00 71.11 111 A 1 ATOM 905 N N . GLU A 1 112 ? -12.204 33.826 -1.768 1.00 98.64 112 A 1 ATOM 906 C CA . GLU A 1 112 ? -11.131 34.677 -2.287 1.00 98.56 112 A 1 ATOM 907 C C . GLU A 1 112 ? -9.918 33.856 -2.735 1.00 98.66 112 A 1 ATOM 908 O O . GLU A 1 112 ? -9.306 34.176 -3.756 1.00 98.38 112 A 1 ATOM 909 C CB . GLU A 1 112 ? -10.678 35.679 -1.224 1.00 98.07 112 A 1 ATOM 910 C CG . GLU A 1 112 ? -11.685 36.808 -0.959 1.00 81.30 112 A 1 ATOM 911 C CD . GLU A 1 112 ? -11.250 37.646 0.253 1.00 74.15 112 A 1 ATOM 912 O OE1 . GLU A 1 112 ? -11.378 38.887 0.189 1.00 67.98 112 A 1 ATOM 913 O OE2 . GLU A 1 112 ? -10.765 37.048 1.243 1.00 70.64 112 A 1 ATOM 914 N N . GLN A 1 113 ? -9.573 32.780 -2.028 1.00 98.77 113 A 1 ATOM 915 C CA . GLN A 1 113 ? -8.507 31.862 -2.433 1.00 98.75 113 A 1 ATOM 916 C C . GLN A 1 113 ? -8.785 31.296 -3.832 1.00 98.73 113 A 1 ATOM 917 O O . GLN A 1 113 ? -7.885 31.235 -4.679 1.00 98.50 113 A 1 ATOM 918 C CB . GLN A 1 113 ? -8.383 30.706 -1.430 1.00 98.59 113 A 1 ATOM 919 C CG . GLN A 1 113 ? -7.792 31.097 -0.064 1.00 98.31 113 A 1 ATOM 920 C CD . GLN A 1 113 ? -7.955 29.973 0.960 1.00 98.46 113 A 1 ATOM 921 O OE1 . GLN A 1 113 ? -7.845 28.797 0.644 1.00 93.73 113 A 1 ATOM 922 N NE2 . GLN A 1 113 ? -8.213 30.275 2.210 1.00 94.54 113 A 1 ATOM 923 N N . GLU A 1 114 ? -10.020 30.923 -4.100 1.00 98.43 114 A 1 ATOM 924 C CA . GLU A 1 114 ? -10.423 30.350 -5.378 1.00 98.14 114 A 1 ATOM 925 C C . GLU A 1 114 ? -10.455 31.399 -6.506 1.00 98.31 114 A 1 ATOM 926 O O . GLU A 1 114 ? -10.035 31.123 -7.637 1.00 97.83 114 A 1 ATOM 927 C CB . GLU A 1 114 ? -11.757 29.620 -5.184 1.00 97.17 114 A 1 ATOM 928 C CG . GLU A 1 114 ? -12.027 28.656 -6.344 1.00 80.94 114 A 1 ATOM 929 C CD . GLU A 1 114 ? -12.835 27.412 -5.949 1.00 69.89 114 A 1 ATOM 930 O OE1 . GLU A 1 114 ? -12.728 26.429 -6.718 1.00 64.13 114 A 1 ATOM 931 O OE2 . GLU A 1 114 ? -13.539 27.429 -4.923 1.00 63.47 114 A 1 ATOM 932 N N . GLU A 1 115 ? -10.857 32.638 -6.202 1.00 98.59 115 A 1 ATOM 933 C CA . GLU A 1 115 ? -10.763 33.781 -7.120 1.00 98.56 115 A 1 ATOM 934 C C . GLU A 1 115 ? -9.306 34.118 -7.472 1.00 98.62 115 A 1 ATOM 935 O O . GLU A 1 115 ? -8.953 34.257 -8.652 1.00 98.25 115 A 1 ATOM 936 C CB . GLU A 1 115 ? -11.435 35.012 -6.509 1.00 98.28 115 A 1 ATOM 937 C CG . GLU A 1 115 ? -12.969 34.950 -6.498 1.00 88.12 115 A 1 ATOM 938 C CD . GLU A 1 115 ? -13.598 36.156 -7.215 1.00 75.37 115 A 1 ATOM 939 O OE1 . GLU A 1 115 ? -14.566 35.921 -7.972 1.00 68.61 115 A 1 ATOM 940 O OE2 . GLU A 1 115 ? -13.055 37.279 -7.088 1.00 69.84 115 A 1 ATOM 941 N N . ILE A 1 116 ? -8.428 34.188 -6.469 1.00 98.59 116 A 1 ATOM 942 C CA . ILE A 1 116 ? -6.994 34.423 -6.660 1.00 98.57 116 A 1 ATOM 943 C C . ILE A 1 116 ? -6.398 33.338 -7.553 1.00 98.54 116 A 1 ATOM 944 O O . ILE A 1 116 ? -5.673 33.656 -8.500 1.00 98.28 116 A 1 ATOM 945 C CB . ILE A 1 116 ? -6.274 34.518 -5.301 1.00 98.45 116 A 1 ATOM 946 C CG1 . ILE A 1 116 ? -6.647 35.849 -4.603 1.00 97.75 116 A 1 ATOM 947 C CG2 . ILE A 1 116 ? -4.745 34.434 -5.474 1.00 97.77 116 A 1 ATOM 948 C CD1 . ILE A 1 116 ? -6.260 35.893 -3.122 1.00 95.83 116 A 1 ATOM 949 N N . LYS A 1 117 ? -6.730 32.073 -7.317 1.00 98.59 117 A 1 ATOM 950 C CA . LYS A 1 117 ? -6.287 30.957 -8.158 1.00 98.45 117 A 1 ATOM 951 C C . LYS A 1 117 ? -6.705 31.149 -9.612 1.00 98.46 117 A 1 ATOM 952 O O . LYS A 1 117 ? -5.863 31.046 -10.510 1.00 98.16 117 A 1 ATOM 953 C CB . LYS A 1 117 ? -6.833 29.641 -7.597 1.00 98.08 117 A 1 ATOM 954 C CG . LYS A 1 117 ? -6.311 28.425 -8.372 1.00 97.16 117 A 1 ATOM 955 C CD . LYS A 1 117 ? -6.836 27.146 -7.725 1.00 95.09 117 A 1 ATOM 956 C CE . LYS A 1 117 ? -6.258 25.907 -8.408 1.00 90.17 117 A 1 ATOM 957 N NZ . LYS A 1 117 ? -6.605 24.692 -7.635 1.00 84.28 117 A 1 ATOM 958 N N . LYS A 1 118 ? -7.971 31.464 -9.871 1.00 98.32 118 A 1 ATOM 959 C CA . LYS A 1 118 ? -8.488 31.725 -11.224 1.00 98.24 118 A 1 ATOM 960 C C . LYS A 1 118 ? -7.748 32.890 -11.883 1.00 98.28 118 A 1 ATOM 961 O O . LYS A 1 118 ? -7.321 32.770 -13.037 1.00 97.89 118 A 1 ATOM 962 C CB . LYS A 1 118 ? -10.003 31.997 -11.164 1.00 97.84 118 A 1 ATOM 963 C CG . LYS A 1 118 ? -10.835 30.734 -10.881 1.00 90.58 118 A 1 ATOM 964 C CD . LYS A 1 118 ? -12.296 31.100 -10.578 1.00 88.68 118 A 1 ATOM 965 C CE . LYS A 1 118 ? -13.092 29.867 -10.135 1.00 79.58 118 A 1 ATOM 966 N NZ . LYS A 1 118 ? -14.363 30.219 -9.436 1.00 71.12 118 A 1 ATOM 967 N N . SER A 1 119 ? -7.523 33.980 -11.145 1.00 98.35 119 A 1 ATOM 968 C CA . SER A 1 119 ? -6.784 35.159 -11.612 1.00 98.25 119 A 1 ATOM 969 C C . SER A 1 119 ? -5.334 34.826 -11.974 1.00 98.29 119 A 1 ATOM 970 O O . SER A 1 119 ? -4.877 35.155 -13.072 1.00 97.70 119 A 1 ATOM 971 C CB . SER A 1 119 ? -6.838 36.246 -10.535 1.00 97.69 119 A 1 ATOM 972 O OG . SER A 1 119 ? -6.234 37.438 -11.005 1.00 83.74 119 A 1 ATOM 973 N N . ASN A 1 120 ? -4.624 34.111 -11.106 1.00 98.28 120 A 1 ATOM 974 C CA . ASN A 1 120 ? -3.237 33.708 -11.340 1.00 98.20 120 A 1 ATOM 975 C C . ASN A 1 120 ? -3.103 32.749 -12.531 1.00 98.07 120 A 1 ATOM 976 O O . ASN A 1 120 ? -2.228 32.939 -13.379 1.00 97.52 120 A 1 ATOM 977 C CB . ASN A 1 120 ? -2.659 33.118 -10.044 1.00 98.01 120 A 1 ATOM 978 C CG . ASN A 1 120 ? -2.274 34.198 -9.044 1.00 97.97 120 A 1 ATOM 979 O OD1 . ASN A 1 120 ? -1.936 35.316 -9.403 1.00 94.47 120 A 1 ATOM 980 N ND2 . ASN A 1 120 ? -2.270 33.878 -7.767 1.00 94.04 120 A 1 ATOM 981 N N . ILE A 1 121 ? -3.997 31.783 -12.676 1.00 97.97 121 A 1 ATOM 982 C CA . ILE A 1 121 ? -4.030 30.896 -13.850 1.00 97.66 121 A 1 ATOM 983 C C . ILE A 1 121 ? -4.276 31.698 -15.136 1.00 97.75 121 A 1 ATOM 984 O O . ILE A 1 121 ? -3.621 31.456 -16.154 1.00 97.21 121 A 1 ATOM 985 C CB . ILE A 1 121 ? -5.081 29.782 -13.648 1.00 96.99 121 A 1 ATOM 986 C CG1 . ILE A 1 121 ? -4.593 28.795 -12.558 1.00 95.31 121 A 1 ATOM 987 C CG2 . ILE A 1 121 ? -5.370 29.023 -14.955 1.00 95.35 121 A 1 ATOM 988 C CD1 . ILE A 1 121 ? -5.659 27.789 -12.106 1.00 89.97 121 A 1 ATOM 989 N N . ALA A 1 122 ? -5.185 32.673 -15.112 1.00 98.06 122 A 1 ATOM 990 C CA . ALA A 1 122 ? -5.457 33.537 -16.261 1.00 98.11 122 A 1 ATOM 991 C C . ALA A 1 122 ? -4.233 34.388 -16.640 1.00 98.11 122 A 1 ATOM 992 O O . ALA A 1 122 ? -3.871 34.439 -17.819 1.00 97.44 122 A 1 ATOM 993 C CB . ALA A 1 122 ? -6.687 34.396 -15.961 1.00 97.90 122 A 1 ATOM 994 N N . LYS A 1 123 ? -3.541 34.989 -15.661 1.00 97.79 123 A 1 ATOM 995 C CA . LYS A 1 123 ? -2.269 35.699 -15.875 1.00 97.34 123 A 1 ATOM 996 C C . LYS A 1 123 ? -1.213 34.776 -16.470 1.00 97.45 123 A 1 ATOM 997 O O . LYS A 1 123 ? -0.616 35.119 -17.488 1.00 96.49 123 A 1 ATOM 998 C CB . LYS A 1 123 ? -1.753 36.300 -14.561 1.00 95.94 123 A 1 ATOM 999 C CG . LYS A 1 123 ? -2.520 37.560 -14.128 1.00 85.41 123 A 1 ATOM 1000 C CD . LYS A 1 123 ? -1.989 38.035 -12.766 1.00 84.60 123 A 1 ATOM 1001 C CE . LYS A 1 123 ? -2.751 39.262 -12.262 1.00 75.34 123 A 1 ATOM 1002 N NZ . LYS A 1 123 ? -2.350 39.604 -10.866 1.00 68.17 123 A 1 ATOM 1003 N N . GLY A 1 124 ? -1.035 33.588 -15.897 1.00 97.41 124 A 1 ATOM 1004 C CA . GLY A 1 124 ? -0.072 32.601 -16.378 1.00 97.11 124 A 1 ATOM 1005 C C . GLY A 1 124 ? -0.316 32.183 -17.826 1.00 97.23 124 A 1 ATOM 1006 O O . GLY A 1 124 ? 0.630 32.110 -18.608 1.00 96.35 124 A 1 ATOM 1007 N N . LYS A 1 125 ? -1.569 31.990 -18.227 1.00 97.46 125 A 1 ATOM 1008 C CA . LYS A 1 125 ? -1.946 31.728 -19.626 1.00 97.23 125 A 1 ATOM 1009 C C . LYS A 1 125 ? -1.606 32.911 -20.532 1.00 97.25 125 A 1 ATOM 1010 O O . LYS A 1 125 ? -0.992 32.715 -21.574 1.00 96.20 125 A 1 ATOM 1011 C CB . LYS A 1 125 ? -3.442 31.396 -19.736 1.00 96.55 125 A 1 ATOM 1012 C CG . LYS A 1 125 ? -3.764 29.978 -19.251 1.00 87.11 125 A 1 ATOM 1013 C CD . LYS A 1 125 ? -5.269 29.705 -19.334 1.00 86.13 125 A 1 ATOM 1014 C CE . LYS A 1 125 ? -5.577 28.288 -18.845 1.00 77.94 125 A 1 ATOM 1015 N NZ . LYS A 1 125 ? -7.031 27.967 -18.907 1.00 69.41 125 A 1 ATOM 1016 N N . LYS A 1 126 ? -1.982 34.131 -20.126 1.00 97.42 126 A 1 ATOM 1017 C CA . LYS A 1 126 ? -1.769 35.355 -20.915 1.00 97.39 126 A 1 ATOM 1018 C C . LYS A 1 126 ? -0.287 35.668 -21.125 1.00 97.31 126 A 1 ATOM 1019 O O . LYS A 1 126 ? 0.099 36.132 -22.193 1.00 95.95 126 A 1 ATOM 1020 C CB . LYS A 1 126 ? -2.497 36.517 -20.229 1.00 96.78 126 A 1 ATOM 1021 C CG . LYS A 1 126 ? -2.523 37.784 -21.099 1.00 87.42 126 A 1 ATOM 1022 C CD . LYS A 1 126 ? -3.273 38.916 -20.390 1.00 83.85 126 A 1 ATOM 1023 C CE . LYS A 1 126 ? -3.290 40.162 -21.282 1.00 72.63 126 A 1 ATOM 1024 N NZ . LYS A 1 126 ? -3.964 41.313 -20.624 1.00 63.29 126 A 1 ATOM 1025 N N . GLU A 1 127 ? 0.546 35.400 -20.118 1.00 97.00 127 A 1 ATOM 1026 C CA . GLU A 1 127 ? 1.992 35.642 -20.142 1.00 96.31 127 A 1 ATOM 1027 C C . GLU A 1 127 ? 2.815 34.444 -20.644 1.00 96.20 127 A 1 ATOM 1028 O O . GLU A 1 127 ? 4.045 34.513 -20.660 1.00 93.93 127 A 1 ATOM 1029 C CB . GLU A 1 127 ? 2.465 36.058 -18.745 1.00 94.79 127 A 1 ATOM 1030 C CG . GLU A 1 127 ? 1.905 37.417 -18.297 1.00 91.44 127 A 1 ATOM 1031 C CD . GLU A 1 127 ? 2.459 37.835 -16.931 1.00 91.67 127 A 1 ATOM 1032 O OE1 . GLU A 1 127 ? 1.729 38.525 -16.189 1.00 85.46 127 A 1 ATOM 1033 O OE2 . GLU A 1 127 ? 3.626 37.472 -16.622 1.00 88.14 127 A 1 ATOM 1034 N N . ASN A 1 128 ? 2.175 33.349 -21.036 1.00 96.47 128 A 1 ATOM 1035 C CA . ASN A 1 128 ? 2.838 32.099 -21.419 1.00 96.31 128 A 1 ATOM 1036 C C . ASN A 1 128 ? 3.739 31.517 -20.303 1.00 96.22 128 A 1 ATOM 1037 O O . ASN A 1 128 ? 4.757 30.881 -20.563 1.00 93.92 128 A 1 ATOM 1038 C CB . ASN A 1 128 ? 3.518 32.277 -22.790 1.00 95.49 128 A 1 ATOM 1039 C CG . ASN A 1 128 ? 3.010 31.324 -23.857 1.00 87.41 128 A 1 ATOM 1040 O OD1 . ASN A 1 128 ? 2.105 30.533 -23.678 1.00 79.31 128 A 1 ATOM 1041 N ND2 . ASN A 1 128 ? 3.594 31.389 -25.036 1.00 77.12 128 A 1 ATOM 1042 N N . LYS A 1 129 ? 3.357 31.741 -19.049 1.00 95.96 129 A 1 ATOM 1043 C CA . LYS A 1 129 ? 4.069 31.317 -17.828 1.00 95.89 129 A 1 ATOM 1044 C C . LYS A 1 129 ? 3.235 30.359 -16.976 1.00 96.32 129 A 1 ATOM 1045 O O . LYS A 1 129 ? 3.410 30.294 -15.764 1.00 94.82 129 A 1 ATOM 1046 C CB . LYS A 1 129 ? 4.496 32.546 -17.023 1.00 94.40 129 A 1 ATOM 1047 C CG . LYS A 1 129 ? 5.569 33.399 -17.703 1.00 91.97 129 A 1 ATOM 1048 C CD . LYS A 1 129 ? 5.822 34.615 -16.806 1.00 87.51 129 A 1 ATOM 1049 C CE . LYS A 1 129 ? 6.681 35.676 -17.480 1.00 81.91 129 A 1 ATOM 1050 N NZ . LYS A 1 129 ? 6.505 36.967 -16.759 1.00 72.93 129 A 1 ATOM 1051 N N . LEU A 1 130 ? 2.303 29.637 -17.584 1.00 95.71 130 A 1 ATOM 1052 C CA . LEU A 1 130 ? 1.526 28.619 -16.883 1.00 95.54 130 A 1 ATOM 1053 C C . LEU A 1 130 ? 2.188 27.255 -17.057 1.00 95.17 130 A 1 ATOM 1054 O O . LEU A 1 130 ? 2.402 26.803 -18.181 1.00 93.38 130 A 1 ATOM 1055 C CB . LEU A 1 130 ? 0.078 28.625 -17.384 1.00 94.55 130 A 1 ATOM 1056 C CG . LEU A 1 130 ? -0.864 27.823 -16.462 1.00 93.30 130 A 1 ATOM 1057 C CD1 . LEU A 1 130 ? -1.197 28.605 -15.189 1.00 90.42 130 A 1 ATOM 1058 C CD2 . LEU A 1 130 ? -2.176 27.519 -17.180 1.00 90.78 130 A 1 ATOM 1059 N N . LYS A 1 131 ? 2.486 26.581 -15.940 1.00 95.74 131 A 1 ATOM 1060 C CA . LYS A 1 131 ? 2.996 25.212 -15.935 1.00 95.19 131 A 1 ATOM 1061 C C . LYS A 1 131 ? 2.333 24.444 -14.801 1.00 95.69 131 A 1 ATOM 1062 O O . LYS A 1 131 ? 2.191 24.984 -13.710 1.00 94.53 131 A 1 ATOM 1063 C CB . LYS A 1 131 ? 4.521 25.241 -15.799 1.00 93.16 131 A 1 ATOM 1064 C CG . LYS A 1 131 ? 5.138 23.856 -15.998 1.00 86.14 131 A 1 ATOM 1065 C CD . LYS A 1 131 ? 6.650 23.927 -15.816 1.00 81.12 131 A 1 ATOM 1066 C CE . LYS A 1 131 ? 7.245 22.533 -15.971 1.00 72.68 131 A 1 ATOM 1067 N NZ . LYS A 1 131 ? 8.693 22.541 -15.675 1.00 63.89 131 A 1 ATOM 1068 N N . ASP A 1 132 ? 1.906 23.217 -15.068 1.00 95.66 132 A 1 ATOM 1069 C CA . ASP A 1 132 ? 1.230 22.355 -14.087 1.00 95.64 132 A 1 ATOM 1070 C C . ASP A 1 132 ? 0.033 23.047 -13.389 1.00 95.84 132 A 1 ATOM 1071 O O . ASP A 1 132 ? -0.228 22.845 -12.210 1.00 93.89 132 A 1 ATOM 1072 C CB . ASP A 1 132 ? 2.271 21.741 -13.129 1.00 94.97 132 A 1 ATOM 1073 C CG . ASP A 1 132 ? 3.369 20.994 -13.897 1.00 94.10 132 A 1 ATOM 1074 O OD1 . ASP A 1 132 ? 3.018 20.157 -14.759 1.00 89.88 132 A 1 ATOM 1075 O OD2 . ASP A 1 132 ? 4.568 21.289 -13.680 1.00 90.34 132 A 1 ATOM 1076 N N . ASN A 1 133 ? -0.681 23.881 -14.130 1.00 95.37 133 A 1 ATOM 1077 C CA . ASN A 1 133 ? -1.802 24.707 -13.664 1.00 95.09 133 A 1 ATOM 1078 C C . ASN A 1 133 ? -1.422 25.772 -12.606 1.00 96.11 133 A 1 ATOM 1079 O O . ASN A 1 133 ? -2.270 26.231 -11.846 1.00 93.96 133 A 1 ATOM 1080 C CB . ASN A 1 133 ? -2.967 23.784 -13.256 1.00 92.60 133 A 1 ATOM 1081 C CG . ASN A 1 133 ? -4.336 24.374 -13.524 1.00 87.24 133 A 1 ATOM 1082 O OD1 . ASN A 1 133 ? -4.553 25.142 -14.447 1.00 78.05 133 A 1 ATOM 1083 N ND2 . ASN A 1 133 ? -5.324 23.974 -12.747 1.00 76.64 133 A 1 ATOM 1084 N N . ILE A 1 134 ? -0.146 26.177 -12.583 1.00 96.01 134 A 1 ATOM 1085 C CA . ILE A 1 134 ? 0.423 27.166 -11.659 1.00 96.26 134 A 1 ATOM 1086 C C . ILE A 1 134 ? 1.118 28.270 -12.454 1.00 96.52 134 A 1 ATOM 1087 O O . ILE A 1 134 ? 1.922 28.004 -13.350 1.00 95.54 134 A 1 ATOM 1088 C CB . ILE A 1 134 ? 1.368 26.475 -10.653 1.00 95.13 134 A 1 ATOM 1089 C CG1 . ILE A 1 134 ? 0.554 25.485 -9.787 1.00 91.93 134 A 1 ATOM 1090 C CG2 . ILE A 1 134 ? 2.113 27.489 -9.770 1.00 92.54 134 A 1 ATOM 1091 C CD1 . ILE A 1 134 ? 1.385 24.683 -8.799 1.00 86.40 134 A 1 ATOM 1092 N N . TYR A 1 135 ? 0.837 29.529 -12.104 1.00 96.65 135 A 1 ATOM 1093 C CA . TYR A 1 135 ? 1.534 30.688 -12.653 1.00 96.59 135 A 1 ATOM 1094 C C . TYR A 1 135 ? 2.988 30.705 -12.167 1.00 96.23 135 A 1 ATOM 1095 O O . TYR A 1 135 ? 3.262 30.776 -10.971 1.00 95.21 135 A 1 ATOM 1096 C CB . TYR A 1 135 ? 0.781 31.964 -12.273 1.00 96.20 135 A 1 ATOM 1097 C CG . TYR A 1 135 ? 1.462 33.250 -12.697 1.00 96.50 135 A 1 ATOM 1098 C CD1 . TYR A 1 135 ? 1.691 34.272 -11.752 1.00 94.20 135 A 1 ATOM 1099 C CD2 . TYR A 1 135 ? 1.861 33.451 -14.032 1.00 94.48 135 A 1 ATOM 1100 C CE1 . TYR A 1 135 ? 2.292 35.479 -12.140 1.00 94.30 135 A 1 ATOM 1101 C CE2 . TYR A 1 135 ? 2.470 34.653 -14.421 1.00 94.04 135 A 1 ATOM 1102 C CZ . TYR A 1 135 ? 2.678 35.672 -13.477 1.00 94.48 135 A 1 ATOM 1103 O OH . TYR A 1 135 ? 3.245 36.856 -13.857 1.00 92.46 135 A 1 ATOM 1104 N N . GLN A 1 136 ? 3.925 30.633 -13.103 1.00 95.30 136 A 1 ATOM 1105 C CA . GLN A 1 136 ? 5.356 30.639 -12.838 1.00 93.94 136 A 1 ATOM 1106 C C . GLN A 1 136 ? 5.852 32.087 -12.750 1.00 93.40 136 A 1 ATOM 1107 O O . GLN A 1 136 ? 6.423 32.628 -13.704 1.00 90.90 136 A 1 ATOM 1108 C CB . GLN A 1 136 ? 6.103 29.836 -13.913 1.00 92.10 136 A 1 ATOM 1109 C CG . GLN A 1 136 ? 5.603 28.393 -14.071 1.00 87.43 136 A 1 ATOM 1110 C CD . GLN A 1 136 ? 5.778 27.555 -12.806 1.00 84.95 136 A 1 ATOM 1111 O OE1 . GLN A 1 136 ? 6.873 27.359 -12.310 1.00 75.99 136 A 1 ATOM 1112 N NE2 . GLN A 1 136 ? 4.703 27.029 -12.265 1.00 74.45 136 A 1 ATOM 1113 N N . LYS A 1 137 ? 5.615 32.719 -11.606 1.00 90.86 137 A 1 ATOM 1114 C CA . LYS A 1 137 ? 6.231 34.010 -11.306 1.00 87.81 137 A 1 ATOM 1115 C C . LYS A 1 137 ? 7.730 33.780 -11.149 1.00 84.45 137 A 1 ATOM 1116 O O . LYS A 1 137 ? 8.152 32.934 -10.361 1.00 76.18 137 A 1 ATOM 1117 C CB . LYS A 1 137 ? 5.570 34.631 -10.068 1.00 83.55 137 A 1 ATOM 1118 C CG . LYS A 1 137 ? 5.920 36.116 -9.877 1.00 77.77 137 A 1 ATOM 1119 C CD . LYS A 1 137 ? 5.127 36.683 -8.687 1.00 73.52 137 A 1 ATOM 1120 C CE . LYS A 1 137 ? 5.406 38.165 -8.438 1.00 66.53 137 A 1 ATOM 1121 N NZ . LYS A 1 137 ? 4.618 38.659 -7.278 1.00 59.56 137 A 1 ATOM 1122 N N . LEU A 1 138 ? 8.541 34.497 -11.945 1.00 80.60 138 A 1 ATOM 1123 C CA . LEU A 1 138 ? 9.992 34.475 -11.789 1.00 75.03 138 A 1 ATOM 1124 C C . LEU A 1 138 ? 10.297 35.003 -10.391 1.00 72.45 138 A 1 ATOM 1125 O O . LEU A 1 138 ? 10.000 36.159 -10.103 1.00 63.40 138 A 1 ATOM 1126 C CB . LEU A 1 138 ? 10.663 35.335 -12.874 1.00 68.31 138 A 1 ATOM 1127 C CG . LEU A 1 138 ? 10.682 34.669 -14.263 1.00 60.79 138 A 1 ATOM 1128 C CD1 . LEU A 1 138 ? 10.989 35.711 -15.344 1.00 55.98 138 A 1 ATOM 1129 C CD2 . LEU A 1 138 ? 11.742 33.570 -14.359 1.00 55.02 138 A 1 ATOM 1130 N N . GLN A 1 139 ? 10.873 34.154 -9.537 1.00 69.78 139 A 1 ATOM 1131 C CA . GLN A 1 139 ? 11.497 34.642 -8.316 1.00 64.51 139 A 1 ATOM 1132 C C . GLN A 1 139 ? 12.592 35.609 -8.764 1.00 61.87 139 A 1 ATOM 1133 O O . GLN A 1 139 ? 13.514 35.218 -9.483 1.00 54.69 139 A 1 ATOM 1134 C CB . GLN A 1 139 ? 12.050 33.485 -7.475 1.00 57.85 139 A 1 ATOM 1135 C CG . GLN A 1 139 ? 10.913 32.729 -6.758 1.00 52.32 139 A 1 ATOM 1136 C CD . GLN A 1 139 ? 11.412 31.584 -5.876 1.00 48.20 139 A 1 ATOM 1137 O OE1 . GLN A 1 139 ? 12.388 30.912 -6.158 1.00 44.79 139 A 1 ATOM 1138 N NE2 . GLN A 1 139 ? 10.734 31.299 -4.788 1.00 43.04 139 A 1 ATOM 1139 N N . GLN A 1 140 ? 12.444 36.884 -8.409 1.00 53.80 140 A 1 ATOM 1140 C CA . GLN A 1 140 ? 13.573 37.790 -8.483 1.00 50.52 140 A 1 ATOM 1141 C C . GLN A 1 140 ? 14.597 37.220 -7.509 1.00 48.93 140 A 1 ATOM 1142 O O . GLN A 1 140 ? 14.378 37.246 -6.301 1.00 44.29 140 A 1 ATOM 1143 C CB . GLN A 1 140 ? 13.159 39.223 -8.124 1.00 46.27 140 A 1 ATOM 1144 C CG . GLN A 1 140 ? 12.359 39.893 -9.256 1.00 41.66 140 A 1 ATOM 1145 C CD . GLN A 1 140 ? 11.987 41.351 -8.951 1.00 38.27 140 A 1 ATOM 1146 O OE1 . GLN A 1 140 ? 12.056 41.834 -7.842 1.00 35.69 140 A 1 ATOM 1147 N NE2 . GLN A 1 140 ? 11.559 42.105 -9.939 1.00 34.59 140 A 1 ATOM 1148 N N . MET A 1 141 ? 15.700 36.664 -8.047 1.00 47.86 141 A 1 ATOM 1149 C CA . MET A 1 141 ? 16.917 36.520 -7.265 1.00 44.71 141 A 1 ATOM 1150 C C . MET A 1 141 ? 17.299 37.939 -6.848 1.00 43.25 141 A 1 ATOM 1151 O O . MET A 1 141 ? 17.791 38.705 -7.674 1.00 40.49 141 A 1 ATOM 1152 C CB . MET A 1 141 ? 18.033 35.858 -8.088 1.00 42.26 141 A 1 ATOM 1153 C CG . MET A 1 141 ? 17.822 34.353 -8.263 1.00 39.53 141 A 1 ATOM 1154 S SD . MET A 1 141 ? 19.197 33.491 -9.105 1.00 37.78 141 A 1 ATOM 1155 C CE . MET A 1 141 ? 18.822 33.858 -10.838 1.00 34.57 141 A 1 ATOM 1156 N N . GLN A 1 142 ? 16.943 38.317 -5.617 1.00 35.25 142 A 1 ATOM 1157 C CA . GLN A 1 142 ? 17.545 39.469 -4.959 1.00 33.54 142 A 1 ATOM 1158 C C . GLN A 1 142 ? 18.973 39.113 -4.528 1.00 31.11 142 A 1 ATOM 1159 O O . GLN A 1 142 ? 19.198 37.954 -4.126 1.00 28.35 142 A 1 ATOM 1160 C CB . GLN A 1 142 ? 16.703 39.948 -3.773 1.00 31.96 142 A 1 ATOM 1161 C CG . GLN A 1 142 ? 15.432 40.684 -4.238 1.00 30.54 142 A 1 ATOM 1162 C CD . GLN A 1 142 ? 14.710 41.416 -3.098 1.00 28.50 142 A 1 ATOM 1163 O OE1 . GLN A 1 142 ? 15.034 41.324 -1.925 1.00 26.92 142 A 1 ATOM 1164 N NE2 . GLN A 1 142 ? 13.706 42.201 -3.400 1.00 27.11 142 A 1 ATOM 1165 O OXT . GLN A 1 142 ? 19.804 40.042 -4.601 1.00 26.81 142 A 1 ATOM 1166 N N . ASP B 2 1 ? 26.895 21.623 15.996 1.00 53.21 1 B 1 ATOM 1167 C CA . ASP B 2 1 ? 28.166 22.346 15.745 1.00 58.02 1 B 1 ATOM 1168 C C . ASP B 2 1 ? 28.825 21.968 14.425 1.00 60.67 1 B 1 ATOM 1169 O O . ASP B 2 1 ? 28.910 22.824 13.552 1.00 57.68 1 B 1 ATOM 1170 C CB . ASP B 2 1 ? 29.085 22.257 16.961 1.00 54.46 1 B 1 ATOM 1171 C CG . ASP B 2 1 ? 28.361 22.832 18.178 1.00 49.97 1 B 1 ATOM 1172 O OD1 . ASP B 2 1 ? 27.307 23.464 17.933 1.00 46.90 1 B 1 ATOM 1173 O OD2 . ASP B 2 1 ? 28.764 22.519 19.308 1.00 44.93 1 B 1 ATOM 1174 N N . ASP B 2 2 ? 29.161 20.709 14.198 1.00 65.37 2 B 1 ATOM 1175 C CA . ASP B 2 2 ? 29.927 20.217 13.026 1.00 68.09 2 B 1 ATOM 1176 C C . ASP B 2 2 ? 29.343 20.590 11.635 1.00 69.40 2 B 1 ATOM 1177 O O . ASP B 2 2 ? 30.032 20.571 10.614 1.00 65.47 2 B 1 ATOM 1178 C CB . ASP B 2 2 ? 30.034 18.687 13.179 1.00 62.91 2 B 1 ATOM 1179 C CG . ASP B 2 2 ? 31.182 18.054 12.389 1.00 57.17 2 B 1 ATOM 1180 O OD1 . ASP B 2 2 ? 32.247 18.689 12.293 1.00 53.29 2 B 1 ATOM 1181 O OD2 . ASP B 2 2 ? 30.973 16.946 11.837 1.00 52.14 2 B 1 ATOM 1182 N N . TYR B 2 3 ? 28.075 20.977 11.573 1.00 77.43 3 B 1 ATOM 1183 C CA . TYR B 2 3 ? 27.456 21.416 10.315 1.00 77.37 3 B 1 ATOM 1184 C C . TYR B 2 3 ? 27.919 22.820 9.888 1.00 78.32 3 B 1 ATOM 1185 O O . TYR B 2 3 ? 28.032 23.095 8.694 1.00 75.56 3 B 1 ATOM 1186 C CB . TYR B 2 3 ? 25.927 21.360 10.448 1.00 72.95 3 B 1 ATOM 1187 C CG . TYR B 2 3 ? 25.240 20.928 9.176 1.00 66.00 3 B 1 ATOM 1188 C CD1 . TYR B 2 3 ? 24.860 21.868 8.197 1.00 60.96 3 B 1 ATOM 1189 C CD2 . TYR B 2 3 ? 24.984 19.557 8.954 1.00 59.62 3 B 1 ATOM 1190 C CE1 . TYR B 2 3 ? 24.229 21.448 7.013 1.00 54.56 3 B 1 ATOM 1191 C CE2 . TYR B 2 3 ? 24.353 19.127 7.777 1.00 54.75 3 B 1 ATOM 1192 C CZ . TYR B 2 3 ? 23.973 20.076 6.804 1.00 52.73 3 B 1 ATOM 1193 O OH . TYR B 2 3 ? 23.352 19.658 5.653 1.00 50.27 3 B 1 ATOM 1194 N N . LEU B 2 4 ? 28.211 23.710 10.859 1.00 81.39 4 B 1 ATOM 1195 C CA . LEU B 2 4 ? 28.681 25.079 10.606 1.00 81.88 4 B 1 ATOM 1196 C C . LEU B 2 4 ? 30.115 25.097 10.067 1.00 82.26 4 B 1 ATOM 1197 O O . LEU B 2 4 ? 30.421 25.896 9.185 1.00 78.48 4 B 1 ATOM 1198 C CB . LEU B 2 4 ? 28.572 25.911 11.898 1.00 79.42 4 B 1 ATOM 1199 C CG . LEU B 2 4 ? 27.130 26.292 12.278 1.00 73.97 4 B 1 ATOM 1200 C CD1 . LEU B 2 4 ? 27.095 26.809 13.717 1.00 69.80 4 B 1 ATOM 1201 C CD2 . LEU B 2 4 ? 26.582 27.398 11.370 1.00 70.01 4 B 1 ATOM 1202 N N . ASP B 2 5 ? 30.966 24.175 10.522 1.00 80.04 5 B 1 ATOM 1203 C CA . ASP B 2 5 ? 32.364 24.087 10.069 1.00 80.11 5 B 1 ATOM 1204 C C . ASP B 2 5 ? 32.504 23.669 8.599 1.00 80.46 5 B 1 ATOM 1205 O O . ASP B 2 5 ? 33.524 23.944 7.954 1.00 77.30 5 B 1 ATOM 1206 C CB . ASP B 2 5 ? 33.135 23.117 10.973 1.00 76.99 5 B 1 ATOM 1207 C CG . ASP B 2 5 ? 33.614 23.766 12.273 1.00 70.17 5 B 1 ATOM 1208 O OD1 . ASP B 2 5 ? 33.809 25.004 12.273 1.00 64.75 5 B 1 ATOM 1209 O OD2 . ASP B 2 5 ? 33.836 23.006 13.235 1.00 63.17 5 B 1 ATOM 1210 N N . ARG B 2 6 ? 31.472 23.049 8.029 1.00 82.07 6 B 1 ATOM 1211 C CA . ARG B 2 6 ? 31.427 22.667 6.608 1.00 81.62 6 B 1 ATOM 1212 C C . ARG B 2 6 ? 30.925 23.790 5.699 1.00 83.18 6 B 1 ATOM 1213 O O . ARG B 2 6 ? 30.936 23.622 4.476 1.00 80.14 6 B 1 ATOM 1214 C CB . ARG B 2 6 ? 30.592 21.396 6.430 1.00 77.77 6 B 1 ATOM 1215 C CG . ARG B 2 6 ? 31.197 20.215 7.188 1.00 70.91 6 B 1 ATOM 1216 C CD . ARG B 2 6 ? 30.369 18.959 6.934 1.00 66.65 6 B 1 ATOM 1217 N NE . ARG B 2 6 ? 30.721 17.899 7.877 1.00 60.19 6 B 1 ATOM 1218 C CZ . ARG B 2 6 ? 30.443 16.612 7.787 1.00 54.17 6 B 1 ATOM 1219 N NH1 . ARG B 2 6 ? 29.842 16.104 6.741 1.00 50.26 6 B 1 ATOM 1220 N NH2 . ARG B 2 6 ? 30.763 15.827 8.779 1.00 47.85 6 B 1 ATOM 1221 N N . LEU B 2 7 ? 30.464 24.903 6.258 1.00 86.46 7 B 1 ATOM 1222 C CA . LEU B 2 7 ? 30.026 26.033 5.453 1.00 86.57 7 B 1 ATOM 1223 C C . LEU B 2 7 ? 31.240 26.730 4.820 1.00 86.99 7 B 1 ATOM 1224 O O . LEU B 2 7 ? 32.268 26.916 5.469 1.00 84.95 7 B 1 ATOM 1225 C CB . LEU B 2 7 ? 29.183 27.008 6.288 1.00 84.39 7 B 1 ATOM 1226 C CG . LEU B 2 7 ? 27.795 26.464 6.666 1.00 79.50 7 B 1 ATOM 1227 C CD1 . LEU B 2 7 ? 27.139 27.399 7.684 1.00 75.34 7 B 1 ATOM 1228 C CD2 . LEU B 2 7 ? 26.860 26.372 5.453 1.00 75.15 7 B 1 ATOM 1229 N N . PRO B 2 8 ? 31.113 27.168 3.561 1.00 84.13 8 B 1 ATOM 1230 C CA . PRO B 2 8 ? 32.156 27.969 2.931 1.00 83.77 8 B 1 ATOM 1231 C C . PRO B 2 8 ? 32.465 29.201 3.787 1.00 85.45 8 B 1 ATOM 1232 O O . PRO B 2 8 ? 31.575 29.987 4.106 1.00 83.34 8 B 1 ATOM 1233 C CB . PRO B 2 8 ? 31.610 28.356 1.552 1.00 79.43 8 B 1 ATOM 1234 C CG . PRO B 2 8 ? 30.528 27.319 1.270 1.00 78.71 8 B 1 ATOM 1235 C CD . PRO B 2 8 ? 29.995 26.967 2.655 1.00 81.59 8 B 1 ATOM 1236 N N . LYS B 2 9 ? 33.739 29.415 4.127 1.00 83.48 9 B 1 ATOM 1237 C CA . LYS B 2 9 ? 34.149 30.559 4.965 1.00 82.98 9 B 1 ATOM 1238 C C . LYS B 2 9 ? 34.208 31.881 4.190 1.00 84.62 9 B 1 ATOM 1239 O O . LYS B 2 9 ? 34.262 32.951 4.788 1.00 80.37 9 B 1 ATOM 1240 C CB . LYS B 2 9 ? 35.479 30.252 5.679 1.00 78.44 9 B 1 ATOM 1241 C CG . LYS B 2 9 ? 35.345 29.080 6.662 1.00 73.96 9 B 1 ATOM 1242 C CD . LYS B 2 9 ? 36.575 28.923 7.573 1.00 66.74 9 B 1 ATOM 1243 C CE . LYS B 2 9 ? 36.312 27.761 8.547 1.00 62.83 9 B 1 ATOM 1244 N NZ . LYS B 2 9 ? 37.365 27.590 9.582 1.00 54.97 9 B 1 ATOM 1245 N N . SER B 2 10 ? 34.200 31.821 2.864 1.00 85.94 10 B 1 ATOM 1246 C CA . SER B 2 10 ? 34.209 33.019 2.023 1.00 86.45 10 B 1 ATOM 1247 C C . SER B 2 10 ? 32.785 33.470 1.683 1.00 87.94 10 B 1 ATOM 1248 O O . SER B 2 10 ? 31.914 32.644 1.399 1.00 86.37 10 B 1 ATOM 1249 C CB . SER B 2 10 ? 35.058 32.813 0.765 1.00 83.14 10 B 1 ATOM 1250 O OG . SER B 2 10 ? 34.388 32.036 -0.205 1.00 76.86 10 B 1 ATOM 1251 N N . LYS B 2 11 ? 32.568 34.800 1.626 1.00 88.16 11 B 1 ATOM 1252 C CA . LYS B 2 11 ? 31.277 35.387 1.228 1.00 88.52 11 B 1 ATOM 1253 C C . LYS B 2 11 ? 30.814 34.869 -0.141 1.00 89.44 11 B 1 ATOM 1254 O O . LYS B 2 11 ? 29.641 34.552 -0.317 1.00 88.79 11 B 1 ATOM 1255 C CB . LYS B 2 11 ? 31.390 36.923 1.256 1.00 87.04 11 B 1 ATOM 1256 C CG . LYS B 2 11 ? 30.029 37.621 1.085 1.00 80.42 11 B 1 ATOM 1257 C CD . LYS B 2 11 ? 30.159 39.151 1.202 1.00 75.72 11 B 1 ATOM 1258 C CE . LYS B 2 11 ? 28.780 39.811 1.076 1.00 67.68 11 B 1 ATOM 1259 N NZ . LYS B 2 11 ? 28.836 41.294 1.195 1.00 59.92 11 B 1 ATOM 1260 N N . LYS B 2 12 ? 31.754 34.724 -1.077 1.00 89.20 12 B 1 ATOM 1261 C CA . LYS B 2 12 ? 31.486 34.198 -2.422 1.00 89.48 12 B 1 ATOM 1262 C C . LYS B 2 12 ? 31.083 32.715 -2.394 1.00 90.54 12 B 1 ATOM 1263 O O . LYS B 2 12 ? 30.178 32.313 -3.119 1.00 88.15 12 B 1 ATOM 1264 C CB . LYS B 2 12 ? 32.719 34.447 -3.310 1.00 87.99 12 B 1 ATOM 1265 C CG . LYS B 2 12 ? 32.396 34.298 -4.804 1.00 78.60 12 B 1 ATOM 1266 C CD . LYS B 2 12 ? 33.616 34.642 -5.673 1.00 73.27 12 B 1 ATOM 1267 C CE . LYS B 2 12 ? 33.241 34.599 -7.154 1.00 64.41 12 B 1 ATOM 1268 N NZ . LYS B 2 12 ? 34.387 34.940 -8.041 1.00 56.28 12 B 1 ATOM 1269 N N . GLY B 2 13 ? 31.720 31.926 -1.535 1.00 91.12 13 B 1 ATOM 1270 C CA . GLY B 2 13 ? 31.363 30.518 -1.339 1.00 90.72 13 B 1 ATOM 1271 C C . GLY B 2 13 ? 29.984 30.350 -0.686 1.00 92.10 13 B 1 ATOM 1272 O O . GLY B 2 13 ? 29.200 29.515 -1.132 1.00 91.07 13 B 1 ATOM 1273 N N . LEU B 2 14 ? 29.663 31.199 0.302 1.00 92.51 14 B 1 ATOM 1274 C CA . LEU B 2 14 ? 28.327 31.237 0.912 1.00 92.45 14 B 1 ATOM 1275 C C . LEU B 2 14 ? 27.241 31.622 -0.100 1.00 93.00 14 B 1 ATOM 1276 O O . LEU B 2 14 ? 26.200 30.975 -0.144 1.00 93.14 14 B 1 ATOM 1277 C CB . LEU B 2 14 ? 28.334 32.223 2.094 1.00 91.41 14 B 1 ATOM 1278 C CG . LEU B 2 14 ? 28.950 31.634 3.377 1.00 84.13 14 B 1 ATOM 1279 C CD1 . LEU B 2 14 ? 29.327 32.755 4.344 1.00 78.73 14 B 1 ATOM 1280 C CD2 . LEU B 2 14 ? 27.959 30.706 4.088 1.00 80.24 14 B 1 ATOM 1281 N N . GLN B 2 15 ? 27.494 32.619 -0.945 1.00 92.36 15 B 1 ATOM 1282 C CA . GLN B 2 15 ? 26.570 33.005 -2.017 1.00 91.41 15 B 1 ATOM 1283 C C . GLN B 2 15 ? 26.360 31.872 -3.031 1.00 91.81 15 B 1 ATOM 1284 O O . GLN B 2 15 ? 25.221 31.617 -3.424 1.00 91.20 15 B 1 ATOM 1285 C CB . GLN B 2 15 ? 27.092 34.259 -2.730 1.00 90.29 15 B 1 ATOM 1286 C CG . GLN B 2 15 ? 26.813 35.533 -1.919 1.00 83.09 15 B 1 ATOM 1287 C CD . GLN B 2 15 ? 27.382 36.790 -2.587 1.00 78.19 15 B 1 ATOM 1288 O OE1 . GLN B 2 15 ? 28.397 36.786 -3.267 1.00 73.05 15 B 1 ATOM 1289 N NE2 . GLN B 2 15 ? 26.752 37.928 -2.401 1.00 68.80 15 B 1 ATOM 1290 N N . GLY B 2 16 ? 27.428 31.175 -3.406 1.00 91.16 16 B 1 ATOM 1291 C CA . GLY B 2 16 ? 27.324 30.009 -4.290 1.00 90.56 16 B 1 ATOM 1292 C C . GLY B 2 16 ? 26.486 28.886 -3.679 1.00 91.71 16 B 1 ATOM 1293 O O . GLY B 2 16 ? 25.588 28.356 -4.338 1.00 90.29 16 B 1 ATOM 1294 N N . LEU B 2 17 ? 26.710 28.594 -2.397 1.00 94.13 17 B 1 ATOM 1295 C CA . LEU B 2 17 ? 25.920 27.597 -1.673 1.00 93.59 17 B 1 ATOM 1296 C C . LEU B 2 17 ? 24.437 27.995 -1.584 1.00 93.98 17 B 1 ATOM 1297 O O . LEU B 2 17 ? 23.570 27.148 -1.795 1.00 93.66 17 B 1 ATOM 1298 C CB . LEU B 2 17 ? 26.532 27.388 -0.279 1.00 92.89 17 B 1 ATOM 1299 C CG . LEU B 2 17 ? 25.823 26.292 0.545 1.00 87.50 17 B 1 ATOM 1300 C CD1 . LEU B 2 17 ? 26.033 24.900 -0.060 1.00 80.78 17 B 1 ATOM 1301 C CD2 . LEU B 2 17 ? 26.370 26.278 1.970 1.00 82.44 17 B 1 ATOM 1302 N N . LEU B 2 18 ? 24.142 29.273 -1.298 1.00 92.87 18 B 1 ATOM 1303 C CA . LEU B 2 18 ? 22.769 29.790 -1.273 1.00 91.94 18 B 1 ATOM 1304 C C . LEU B 2 18 ? 22.082 29.617 -2.628 1.00 91.90 18 B 1 ATOM 1305 O O . LEU B 2 18 ? 20.987 29.063 -2.678 1.00 92.44 18 B 1 ATOM 1306 C CB . LEU B 2 18 ? 22.771 31.267 -0.839 1.00 91.47 18 B 1 ATOM 1307 C CG . LEU B 2 18 ? 22.880 31.453 0.689 1.00 80.48 18 B 1 ATOM 1308 C CD1 . LEU B 2 18 ? 23.271 32.898 1.011 1.00 75.43 18 B 1 ATOM 1309 C CD2 . LEU B 2 18 ? 21.555 31.153 1.389 1.00 78.02 18 B 1 ATOM 1310 N N . GLN B 2 19 ? 22.755 29.976 -3.720 1.00 93.06 19 B 1 ATOM 1311 C CA . GLN B 2 19 ? 22.216 29.788 -5.073 1.00 91.88 19 B 1 ATOM 1312 C C . GLN B 2 19 ? 21.951 28.313 -5.399 1.00 91.87 19 B 1 ATOM 1313 O O . GLN B 2 19 ? 20.941 27.985 -6.033 1.00 91.02 19 B 1 ATOM 1314 C CB . GLN B 2 19 ? 23.195 30.359 -6.102 1.00 90.80 19 B 1 ATOM 1315 C CG . GLN B 2 19 ? 23.169 31.895 -6.133 1.00 83.39 19 B 1 ATOM 1316 C CD . GLN B 2 19 ? 24.140 32.474 -7.166 1.00 79.63 19 B 1 ATOM 1317 O OE1 . GLN B 2 19 ? 24.937 31.797 -7.799 1.00 74.27 19 B 1 ATOM 1318 N NE2 . GLN B 2 19 ? 24.096 33.770 -7.388 1.00 71.17 19 B 1 ATOM 1319 N N . ASP B 2 20 ? 22.822 27.408 -4.967 1.00 93.45 20 B 1 ATOM 1320 C CA . ASP B 2 20 ? 22.618 25.972 -5.175 1.00 92.34 20 B 1 ATOM 1321 C C . ASP B 2 20 ? 21.441 25.431 -4.351 1.00 91.97 20 B 1 ATOM 1322 O O . ASP B 2 20 ? 20.671 24.593 -4.840 1.00 91.40 20 B 1 ATOM 1323 C CB . ASP B 2 20 ? 23.902 25.201 -4.843 1.00 91.97 20 B 1 ATOM 1324 C CG . ASP B 2 20 ? 24.945 25.212 -5.970 1.00 82.35 20 B 1 ATOM 1325 O OD1 . ASP B 2 20 ? 24.596 25.572 -7.123 1.00 77.08 20 B 1 ATOM 1326 O OD2 . ASP B 2 20 ? 26.076 24.760 -5.686 1.00 76.76 20 B 1 ATOM 1327 N N . ILE B 2 21 ? 21.269 25.929 -3.123 1.00 93.35 21 B 1 ATOM 1328 C CA . ILE B 2 21 ? 20.119 25.597 -2.276 1.00 92.06 21 B 1 ATOM 1329 C C . ILE B 2 21 ? 18.827 26.120 -2.914 1.00 91.20 21 B 1 ATOM 1330 O O . ILE B 2 21 ? 17.874 25.351 -3.050 1.00 91.00 21 B 1 ATOM 1331 C CB . ILE B 2 21 ? 20.322 26.116 -0.837 1.00 91.85 21 B 1 ATOM 1332 C CG1 . ILE B 2 21 ? 21.431 25.299 -0.133 1.00 87.59 21 B 1 ATOM 1333 C CG2 . ILE B 2 21 ? 19.017 26.040 -0.025 1.00 86.16 21 B 1 ATOM 1334 C CD1 . ILE B 2 21 ? 21.925 25.928 1.176 1.00 79.28 21 B 1 ATOM 1335 N N . GLU B 2 22 ? 18.798 27.375 -3.362 1.00 91.80 22 B 1 ATOM 1336 C CA . GLU B 2 22 ? 17.637 27.967 -4.040 1.00 89.99 22 B 1 ATOM 1337 C C . GLU B 2 22 ? 17.257 27.189 -5.302 1.00 90.05 22 B 1 ATOM 1338 O O . GLU B 2 22 ? 16.090 26.841 -5.490 1.00 89.12 22 B 1 ATOM 1339 C CB . GLU B 2 22 ? 17.935 29.418 -4.414 1.00 88.84 22 B 1 ATOM 1340 C CG . GLU B 2 22 ? 17.877 30.353 -3.202 1.00 83.06 22 B 1 ATOM 1341 C CD . GLU B 2 22 ? 18.298 31.787 -3.547 1.00 77.90 22 B 1 ATOM 1342 O OE1 . GLU B 2 22 ? 18.199 32.634 -2.635 1.00 72.60 22 B 1 ATOM 1343 O OE2 . GLU B 2 22 ? 18.745 32.017 -4.697 1.00 75.73 22 B 1 ATOM 1344 N N . LYS B 2 23 ? 18.249 26.827 -6.133 1.00 92.22 23 B 1 ATOM 1345 C CA . LYS B 2 23 ? 18.020 25.976 -7.310 1.00 91.36 23 B 1 ATOM 1346 C C . LYS B 2 23 ? 17.430 24.619 -6.935 1.00 90.89 23 B 1 ATOM 1347 O O . LYS B 2 23 ? 16.507 24.148 -7.607 1.00 89.81 23 B 1 ATOM 1348 C CB . LYS B 2 23 ? 19.330 25.766 -8.075 1.00 90.89 23 B 1 ATOM 1349 C CG . LYS B 2 23 ? 19.694 26.980 -8.939 1.00 82.13 23 B 1 ATOM 1350 C CD . LYS B 2 23 ? 21.061 26.731 -9.580 1.00 80.03 23 B 1 ATOM 1351 C CE . LYS B 2 23 ? 21.497 27.946 -10.395 1.00 70.91 23 B 1 ATOM 1352 N NZ . LYS B 2 23 ? 22.896 27.784 -10.868 1.00 63.87 23 B 1 ATOM 1353 N N . ARG B 2 24 ? 17.937 23.993 -5.865 1.00 92.20 24 B 1 ATOM 1354 C CA . ARG B 2 24 ? 17.375 22.736 -5.356 1.00 91.00 24 B 1 ATOM 1355 C C . ARG B 2 24 ? 15.937 22.910 -4.887 1.00 90.62 24 B 1 ATOM 1356 O O . ARG B 2 24 ? 15.094 22.104 -5.271 1.00 89.80 24 B 1 ATOM 1357 C CB . ARG B 2 24 ? 18.238 22.160 -4.226 1.00 91.19 24 B 1 ATOM 1358 C CG . ARG B 2 24 ? 19.219 21.113 -4.756 1.00 81.17 24 B 1 ATOM 1359 C CD . ARG B 2 24 ? 20.011 20.525 -3.592 1.00 78.04 24 B 1 ATOM 1360 N NE . ARG B 2 24 ? 20.777 19.336 -4.011 1.00 70.22 24 B 1 ATOM 1361 C CZ . ARG B 2 24 ? 21.596 18.636 -3.241 1.00 63.11 24 B 1 ATOM 1362 N NH1 . ARG B 2 24 ? 21.818 18.965 -1.997 1.00 56.53 24 B 1 ATOM 1363 N NH2 . ARG B 2 24 ? 22.201 17.584 -3.711 1.00 54.60 24 B 1 ATOM 1364 N N . ILE B 2 25 ? 15.653 23.955 -4.105 1.00 90.75 25 B 1 ATOM 1365 C CA . ILE B 2 25 ? 14.298 24.250 -3.623 1.00 88.70 25 B 1 ATOM 1366 C C . ILE B 2 25 ? 13.352 24.458 -4.809 1.00 89.40 25 B 1 ATOM 1367 O O . ILE B 2 25 ? 12.288 23.842 -4.854 1.00 89.01 25 B 1 ATOM 1368 C CB . ILE B 2 25 ? 14.309 25.463 -2.671 1.00 87.21 25 B 1 ATOM 1369 C CG1 . ILE B 2 25 ? 15.015 25.087 -1.347 1.00 83.36 25 B 1 ATOM 1370 C CG2 . ILE B 2 25 ? 12.875 25.956 -2.387 1.00 82.61 25 B 1 ATOM 1371 C CD1 . ILE B 2 25 ? 15.341 26.295 -0.463 1.00 76.64 25 B 1 ATOM 1372 N N . LEU B 2 26 ? 13.758 25.255 -5.799 1.00 89.17 26 B 1 ATOM 1373 C CA . LEU B 2 26 ? 12.967 25.491 -7.005 1.00 88.97 26 B 1 ATOM 1374 C C . LEU B 2 26 ? 12.697 24.188 -7.767 1.00 91.12 26 B 1 ATOM 1375 O O . LEU B 2 26 ? 11.568 23.938 -8.192 1.00 91.02 26 B 1 ATOM 1376 C CB . LEU B 2 26 ? 13.705 26.509 -7.889 1.00 86.49 26 B 1 ATOM 1377 C CG . LEU B 2 26 ? 12.842 27.025 -9.058 1.00 76.93 26 B 1 ATOM 1378 C CD1 . LEU B 2 26 ? 11.741 27.965 -8.569 1.00 72.18 26 B 1 ATOM 1379 C CD2 . LEU B 2 26 ? 13.716 27.778 -10.061 1.00 73.34 26 B 1 ATOM 1380 N N . HIS B 2 27 ? 13.712 23.325 -7.900 1.00 91.98 27 B 1 ATOM 1381 C CA . HIS B 2 27 ? 13.562 22.019 -8.532 1.00 92.66 27 B 1 ATOM 1382 C C . HIS B 2 27 ? 12.573 21.123 -7.776 1.00 92.96 27 B 1 ATOM 1383 O O . HIS B 2 27 ? 11.682 20.536 -8.395 1.00 92.91 27 B 1 ATOM 1384 C CB . HIS B 2 27 ? 14.936 21.356 -8.659 1.00 92.57 27 B 1 ATOM 1385 C CG . HIS B 2 27 ? 14.870 20.044 -9.394 1.00 88.94 27 B 1 ATOM 1386 N ND1 . HIS B 2 27 ? 14.509 19.879 -10.716 1.00 76.35 27 B 1 ATOM 1387 C CD2 . HIS B 2 27 ? 15.136 18.792 -8.897 1.00 78.19 27 B 1 ATOM 1388 C CE1 . HIS B 2 27 ? 14.565 18.572 -11.003 1.00 77.40 27 B 1 ATOM 1389 N NE2 . HIS B 2 27 ? 14.946 17.881 -9.926 1.00 78.14 27 B 1 ATOM 1390 N N . TYR B 2 28 ? 12.672 21.074 -6.446 1.00 93.15 28 B 1 ATOM 1391 C CA . TYR B 2 28 ? 11.723 20.314 -5.626 1.00 92.81 28 B 1 ATOM 1392 C C . TYR B 2 28 ? 10.296 20.864 -5.718 1.00 93.80 28 B 1 ATOM 1393 O O . TYR B 2 28 ? 9.363 20.071 -5.859 1.00 93.60 28 B 1 ATOM 1394 C CB . TYR B 2 28 ? 12.189 20.276 -4.166 1.00 91.42 28 B 1 ATOM 1395 C CG . TYR B 2 28 ? 13.297 19.279 -3.888 1.00 82.42 28 B 1 ATOM 1396 C CD1 . TYR B 2 28 ? 13.077 17.902 -4.088 1.00 75.91 28 B 1 ATOM 1397 C CD2 . TYR B 2 28 ? 14.548 19.716 -3.410 1.00 74.15 28 B 1 ATOM 1398 C CE1 . TYR B 2 28 ? 14.095 16.973 -3.824 1.00 68.87 28 B 1 ATOM 1399 C CE2 . TYR B 2 28 ? 15.575 18.792 -3.145 1.00 67.78 28 B 1 ATOM 1400 C CZ . TYR B 2 28 ? 15.346 17.423 -3.356 1.00 66.74 28 B 1 ATOM 1401 O OH . TYR B 2 28 ? 16.345 16.518 -3.105 1.00 61.33 28 B 1 ATOM 1402 N N . LYS B 2 29 ? 10.112 22.198 -5.713 1.00 93.03 29 B 1 ATOM 1403 C CA . LYS B 2 29 ? 8.799 22.825 -5.942 1.00 93.43 29 B 1 ATOM 1404 C C . LYS B 2 29 ? 8.219 22.390 -7.290 1.00 94.61 29 B 1 ATOM 1405 O O . LYS B 2 29 ? 7.076 21.944 -7.354 1.00 94.68 29 B 1 ATOM 1406 C CB . LYS B 2 29 ? 8.879 24.367 -5.846 1.00 91.75 29 B 1 ATOM 1407 C CG . LYS B 2 29 ? 8.943 24.902 -4.402 1.00 86.55 29 B 1 ATOM 1408 C CD . LYS B 2 29 ? 8.749 26.430 -4.308 1.00 86.54 29 B 1 ATOM 1409 C CE . LYS B 2 29 ? 8.673 26.875 -2.832 1.00 80.32 29 B 1 ATOM 1410 N NZ . LYS B 2 29 ? 8.236 28.291 -2.612 1.00 75.89 29 B 1 ATOM 1411 N N . GLN B 2 30 ? 9.016 22.451 -8.364 1.00 93.91 30 B 1 ATOM 1412 C CA . GLN B 2 30 ? 8.572 22.050 -9.702 1.00 94.13 30 B 1 ATOM 1413 C C . GLN B 2 30 ? 8.191 20.566 -9.777 1.00 95.13 30 B 1 ATOM 1414 O O . GLN B 2 30 ? 7.166 20.238 -10.374 1.00 94.69 30 B 1 ATOM 1415 C CB . GLN B 2 30 ? 9.672 22.344 -10.725 1.00 92.85 30 B 1 ATOM 1416 C CG . GLN B 2 30 ? 9.800 23.845 -11.010 1.00 84.36 30 B 1 ATOM 1417 C CD . GLN B 2 30 ? 10.960 24.161 -11.959 1.00 76.80 30 B 1 ATOM 1418 O OE1 . GLN B 2 30 ? 11.674 23.298 -12.453 1.00 70.47 30 B 1 ATOM 1419 N NE2 . GLN B 2 30 ? 11.167 25.421 -12.269 1.00 65.64 30 B 1 ATOM 1420 N N . LEU B 2 31 ? 8.986 19.684 -9.172 1.00 94.82 31 B 1 ATOM 1421 C CA . LEU B 2 31 ? 8.667 18.257 -9.104 1.00 94.86 31 B 1 ATOM 1422 C C . LEU B 2 31 ? 7.366 18.007 -8.343 1.00 95.48 31 B 1 ATOM 1423 O O . LEU B 2 31 ? 6.520 17.262 -8.827 1.00 95.23 31 B 1 ATOM 1424 C CB . LEU B 2 31 ? 9.816 17.487 -8.435 1.00 94.05 31 B 1 ATOM 1425 C CG . LEU B 2 31 ? 11.057 17.271 -9.320 1.00 85.39 31 B 1 ATOM 1426 C CD1 . LEU B 2 31 ? 12.135 16.588 -8.471 1.00 82.24 31 B 1 ATOM 1427 C CD2 . LEU B 2 31 ? 10.767 16.382 -10.530 1.00 83.41 31 B 1 ATOM 1428 N N . PHE B 2 32 ? 7.187 18.678 -7.203 1.00 94.91 32 B 1 ATOM 1429 C CA . PHE B 2 32 ? 5.968 18.566 -6.409 1.00 95.25 32 B 1 ATOM 1430 C C . PHE B 2 32 ? 4.739 19.008 -7.209 1.00 95.65 32 B 1 ATOM 1431 O O . PHE B 2 32 ? 3.767 18.268 -7.299 1.00 95.72 32 B 1 ATOM 1432 C CB . PHE B 2 32 ? 6.128 19.382 -5.126 1.00 94.95 32 B 1 ATOM 1433 C CG . PHE B 2 32 ? 4.905 19.333 -4.235 1.00 94.91 32 B 1 ATOM 1434 C CD1 . PHE B 2 32 ? 3.906 20.317 -4.343 1.00 93.38 32 B 1 ATOM 1435 C CD2 . PHE B 2 32 ? 4.757 18.291 -3.303 1.00 93.47 32 B 1 ATOM 1436 C CE1 . PHE B 2 32 ? 2.772 20.263 -3.520 1.00 92.95 32 B 1 ATOM 1437 C CE2 . PHE B 2 32 ? 3.626 18.238 -2.476 1.00 92.59 32 B 1 ATOM 1438 C CZ . PHE B 2 32 ? 2.635 19.223 -2.584 1.00 92.78 32 B 1 ATOM 1439 N N . PHE B 2 33 ? 4.789 20.178 -7.848 1.00 96.14 33 B 1 ATOM 1440 C CA . PHE B 2 33 ? 3.665 20.682 -8.635 1.00 96.35 33 B 1 ATOM 1441 C C . PHE B 2 33 ? 3.334 19.773 -9.817 1.00 96.48 33 B 1 ATOM 1442 O O . PHE B 2 33 ? 2.160 19.498 -10.063 1.00 96.09 33 B 1 ATOM 1443 C CB . PHE B 2 33 ? 3.959 22.102 -9.126 1.00 96.15 33 B 1 ATOM 1444 C CG . PHE B 2 33 ? 4.176 23.143 -8.049 1.00 96.13 33 B 1 ATOM 1445 C CD1 . PHE B 2 33 ? 3.516 23.077 -6.808 1.00 94.07 33 B 1 ATOM 1446 C CD2 . PHE B 2 33 ? 5.040 24.228 -8.311 1.00 94.19 33 B 1 ATOM 1447 C CE1 . PHE B 2 33 ? 3.722 24.067 -5.837 1.00 93.64 33 B 1 ATOM 1448 C CE2 . PHE B 2 33 ? 5.245 25.222 -7.344 1.00 93.45 33 B 1 ATOM 1449 C CZ . PHE B 2 33 ? 4.588 25.142 -6.105 1.00 94.06 33 B 1 ATOM 1450 N N . LYS B 2 34 ? 4.358 19.259 -10.511 1.00 96.59 34 B 1 ATOM 1451 C CA . LYS B 2 34 ? 4.174 18.299 -11.594 1.00 96.52 34 B 1 ATOM 1452 C C . LYS B 2 34 ? 3.475 17.033 -11.100 1.00 96.41 34 B 1 ATOM 1453 O O . LYS B 2 34 ? 2.492 16.608 -11.700 1.00 96.05 34 B 1 ATOM 1454 C CB . LYS B 2 34 ? 5.533 17.985 -12.230 1.00 96.34 34 B 1 ATOM 1455 C CG . LYS B 2 34 ? 5.356 17.046 -13.425 1.00 91.80 34 B 1 ATOM 1456 C CD . LYS B 2 34 ? 6.697 16.654 -14.041 1.00 88.81 34 B 1 ATOM 1457 C CE . LYS B 2 34 ? 6.384 15.617 -15.116 1.00 79.53 34 B 1 ATOM 1458 N NZ . LYS B 2 34 ? 7.604 14.977 -15.660 1.00 71.89 34 B 1 ATOM 1459 N N . GLU B 2 35 ? 3.955 16.456 -10.004 1.00 95.20 35 B 1 ATOM 1460 C CA . GLU B 2 35 ? 3.389 15.232 -9.440 1.00 94.16 35 B 1 ATOM 1461 C C . GLU B 2 35 ? 1.932 15.438 -8.995 1.00 94.40 35 B 1 ATOM 1462 O O . GLU B 2 35 ? 1.062 14.640 -9.345 1.00 93.64 35 B 1 ATOM 1463 C CB . GLU B 2 35 ? 4.289 14.758 -8.290 1.00 92.83 35 B 1 ATOM 1464 C CG . GLU B 2 35 ? 3.858 13.398 -7.717 1.00 82.52 35 B 1 ATOM 1465 C CD . GLU B 2 35 ? 4.865 12.833 -6.699 1.00 76.80 35 B 1 ATOM 1466 O OE1 . GLU B 2 35 ? 4.887 11.591 -6.535 1.00 70.81 35 B 1 ATOM 1467 O OE2 . GLU B 2 35 ? 5.630 13.620 -6.093 1.00 72.70 35 B 1 ATOM 1468 N N . GLN B 2 36 ? 1.639 16.546 -8.308 1.00 94.81 36 B 1 ATOM 1469 C CA . GLN B 2 36 ? 0.272 16.859 -7.884 1.00 94.85 36 B 1 ATOM 1470 C C . GLN B 2 36 ? -0.660 17.115 -9.075 1.00 95.05 36 B 1 ATOM 1471 O O . GLN B 2 36 ? -1.811 16.687 -9.047 1.00 94.19 36 B 1 ATOM 1472 C CB . GLN B 2 36 ? 0.267 18.064 -6.936 1.00 94.34 36 B 1 ATOM 1473 C CG . GLN B 2 36 ? 1.002 17.825 -5.606 1.00 92.77 36 B 1 ATOM 1474 C CD . GLN B 2 36 ? 0.527 16.575 -4.868 1.00 92.42 36 B 1 ATOM 1475 O OE1 . GLN B 2 36 ? -0.639 16.406 -4.557 1.00 85.52 36 B 1 ATOM 1476 N NE2 . GLN B 2 36 ? 1.423 15.662 -4.567 1.00 84.38 36 B 1 ATOM 1477 N N . ASN B 2 37 ? -0.178 17.750 -10.134 1.00 95.31 37 B 1 ATOM 1478 C CA . ASN B 2 37 ? -0.964 17.964 -11.349 1.00 95.20 37 B 1 ATOM 1479 C C . ASN B 2 37 ? -1.237 16.648 -12.091 1.00 94.83 37 B 1 ATOM 1480 O O . ASN B 2 37 ? -2.348 16.419 -12.570 1.00 93.81 37 B 1 ATOM 1481 C CB . ASN B 2 37 ? -0.226 18.974 -12.230 1.00 95.00 37 B 1 ATOM 1482 C CG . ASN B 2 37 ? -1.052 19.389 -13.434 1.00 92.84 37 B 1 ATOM 1483 O OD1 . ASN B 2 37 ? -2.184 19.819 -13.336 1.00 84.41 37 B 1 ATOM 1484 N ND2 . ASN B 2 37 ? -0.481 19.300 -14.616 1.00 84.03 37 B 1 ATOM 1485 N N . GLU B 2 38 ? -0.262 15.736 -12.152 1.00 95.47 38 B 1 ATOM 1486 C CA . GLU B 2 38 ? -0.464 14.393 -12.704 1.00 94.84 38 B 1 ATOM 1487 C C . GLU B 2 38 ? -1.510 13.595 -11.907 1.00 94.44 38 B 1 ATOM 1488 O O . GLU B 2 38 ? -2.365 12.942 -12.507 1.00 92.93 38 B 1 ATOM 1489 C CB . GLU B 2 38 ? 0.870 13.628 -12.728 1.00 94.43 38 B 1 ATOM 1490 C CG . GLU B 2 38 ? 1.843 14.093 -13.822 1.00 92.55 38 B 1 ATOM 1491 C CD . GLU B 2 38 ? 3.200 13.355 -13.788 1.00 91.73 38 B 1 ATOM 1492 O OE1 . GLU B 2 38 ? 4.095 13.720 -14.587 1.00 85.36 38 B 1 ATOM 1493 O OE2 . GLU B 2 38 ? 3.373 12.381 -13.005 1.00 88.05 38 B 1 ATOM 1494 N N . ILE B 2 39 ? -1.471 13.678 -10.574 1.00 94.37 39 B 1 ATOM 1495 C CA . ILE B 2 39 ? -2.470 13.056 -9.693 1.00 93.36 39 B 1 ATOM 1496 C C . ILE B 2 39 ? -3.858 13.660 -9.941 1.00 92.89 39 B 1 ATOM 1497 O O . ILE B 2 39 ? -4.821 12.918 -10.130 1.00 91.27 39 B 1 ATOM 1498 C CB . ILE B 2 39 ? -2.041 13.179 -8.210 1.00 92.40 39 B 1 ATOM 1499 C CG1 . ILE B 2 39 ? -0.801 12.294 -7.927 1.00 90.42 39 B 1 ATOM 1500 C CG2 . ILE B 2 39 ? -3.188 12.788 -7.257 1.00 90.34 39 B 1 ATOM 1501 C CD1 . ILE B 2 39 ? -0.108 12.590 -6.589 1.00 86.50 39 B 1 ATOM 1502 N N . ALA B 2 40 ? -3.963 14.990 -9.987 1.00 93.15 40 B 1 ATOM 1503 C CA . ALA B 2 40 ? -5.222 15.688 -10.240 1.00 92.42 40 B 1 ATOM 1504 C C . ALA B 2 40 ? -5.823 15.360 -11.621 1.00 92.97 40 B 1 ATOM 1505 O O . ALA B 2 40 ? -7.041 15.315 -11.773 1.00 91.08 40 B 1 ATOM 1506 C CB . ALA B 2 40 ? -4.982 17.194 -10.086 1.00 90.95 40 B 1 ATOM 1507 N N . ASN B 2 41 ? -4.979 15.062 -12.603 1.00 93.78 41 B 1 ATOM 1508 C CA . ASN B 2 41 ? -5.389 14.636 -13.943 1.00 94.25 41 B 1 ATOM 1509 C C . ASN B 2 41 ? -5.714 13.131 -14.046 1.00 94.04 41 B 1 ATOM 1510 O O . ASN B 2 41 ? -5.840 12.603 -15.153 1.00 90.85 41 B 1 ATOM 1511 C CB . ASN B 2 41 ? -4.312 15.082 -14.947 1.00 93.22 41 B 1 ATOM 1512 C CG . ASN B 2 41 ? -4.272 16.591 -15.137 1.00 89.58 41 B 1 ATOM 1513 O OD1 . ASN B 2 41 ? -5.254 17.304 -15.044 1.00 80.92 41 B 1 ATOM 1514 N ND2 . ASN B 2 41 ? -3.117 17.128 -15.451 1.00 79.66 41 B 1 ATOM 1515 N N . GLY B 2 42 ? -5.845 12.434 -12.912 1.00 93.06 42 B 1 ATOM 1516 C CA . GLY B 2 42 ? -6.272 11.034 -12.888 1.00 92.68 42 B 1 ATOM 1517 C C . GLY B 2 42 ? -5.171 10.026 -13.217 1.00 93.77 42 B 1 ATOM 1518 O O . GLY B 2 42 ? -5.466 8.929 -13.699 1.00 91.48 42 B 1 ATOM 1519 N N . LYS B 2 43 ? -3.909 10.355 -12.957 1.00 94.95 43 B 1 ATOM 1520 C CA . LYS B 2 43 ? -2.803 9.397 -13.067 1.00 95.65 43 B 1 ATOM 1521 C C . LYS B 2 43 ? -3.107 8.150 -12.241 1.00 95.89 43 B 1 ATOM 1522 O O . LYS B 2 43 ? -3.377 8.233 -11.042 1.00 95.00 43 B 1 ATOM 1523 C CB . LYS B 2 43 ? -1.494 10.054 -12.618 1.00 94.40 43 B 1 ATOM 1524 C CG . LYS B 2 43 ? -0.278 9.125 -12.770 1.00 91.69 43 B 1 ATOM 1525 C CD . LYS B 2 43 ? 0.958 9.851 -12.246 1.00 89.10 43 B 1 ATOM 1526 C CE . LYS B 2 43 ? 2.235 9.032 -12.426 1.00 83.98 43 B 1 ATOM 1527 N NZ . LYS B 2 43 ? 3.401 9.842 -12.004 1.00 76.85 43 B 1 ATOM 1528 N N . ARG B 2 44 ? -3.001 6.988 -12.880 1.00 95.72 44 B 1 ATOM 1529 C CA . ARG B 2 44 ? -3.151 5.701 -12.198 1.00 95.45 44 B 1 ATOM 1530 C C . ARG B 2 44 ? -1.855 5.315 -11.488 1.00 95.67 44 B 1 ATOM 1531 O O . ARG B 2 44 ? -0.754 5.564 -11.981 1.00 93.61 44 B 1 ATOM 1532 C CB . ARG B 2 44 ? -3.620 4.608 -13.164 1.00 93.17 44 B 1 ATOM 1533 C CG . ARG B 2 44 ? -5.028 4.895 -13.712 1.00 84.26 44 B 1 ATOM 1534 C CD . ARG B 2 44 ? -5.570 3.675 -14.451 1.00 82.19 44 B 1 ATOM 1535 N NE . ARG B 2 44 ? -6.893 3.944 -15.047 1.00 75.68 44 B 1 ATOM 1536 C CZ . ARG B 2 44 ? -7.772 3.027 -15.408 1.00 69.91 44 B 1 ATOM 1537 N NH1 . ARG B 2 44 ? -7.550 1.747 -15.264 1.00 62.44 44 B 1 ATOM 1538 N NH2 . ARG B 2 44 ? -8.901 3.392 -15.938 1.00 62.57 44 B 1 ATOM 1539 N N . SER B 2 45 ? -2.005 4.695 -10.323 1.00 96.27 45 B 1 ATOM 1540 C CA . SER B 2 45 ? -0.909 4.025 -9.632 1.00 95.91 45 B 1 ATOM 1541 C C . SER B 2 45 ? -0.602 2.674 -10.290 1.00 96.32 45 B 1 ATOM 1542 O O . SER B 2 45 ? -1.291 2.238 -11.211 1.00 95.18 45 B 1 ATOM 1543 C CB . SER B 2 45 ? -1.261 3.863 -8.149 1.00 94.40 45 B 1 ATOM 1544 O OG . SER B 2 45 ? -2.249 2.875 -7.977 1.00 93.35 45 B 1 ATOM 1545 N N . MET B 2 46 ? 0.420 1.979 -9.771 1.00 95.61 46 B 1 ATOM 1546 C CA . MET B 2 46 ? 0.722 0.594 -10.150 1.00 95.32 46 B 1 ATOM 1547 C C . MET B 2 46 ? -0.178 -0.434 -9.449 1.00 96.61 46 B 1 ATOM 1548 O O . MET B 2 46 ? -0.000 -1.629 -9.652 1.00 95.26 46 B 1 ATOM 1549 C CB . MET B 2 46 ? 2.202 0.298 -9.850 1.00 93.11 46 B 1 ATOM 1550 C CG . MET B 2 46 ? 3.173 1.147 -10.675 1.00 86.22 46 B 1 ATOM 1551 S SD . MET B 2 46 ? 3.069 0.951 -12.481 1.00 75.90 46 B 1 ATOM 1552 C CE . MET B 2 46 ? 3.537 -0.791 -12.672 1.00 65.33 46 B 1 ATOM 1553 N N . VAL B 2 47 ? -1.092 0.002 -8.592 1.00 97.31 47 B 1 ATOM 1554 C CA . VAL B 2 47 ? -1.990 -0.888 -7.851 1.00 97.70 47 B 1 ATOM 1555 C C . VAL B 2 47 ? -3.130 -1.319 -8.775 1.00 97.87 47 B 1 ATOM 1556 O O . VAL B 2 47 ? -3.783 -0.451 -9.354 1.00 97.24 47 B 1 ATOM 1557 C CB . VAL B 2 47 ? -2.512 -0.209 -6.577 1.00 97.03 47 B 1 ATOM 1558 C CG1 . VAL B 2 47 ? -3.508 -1.090 -5.836 1.00 94.63 47 B 1 ATOM 1559 C CG2 . VAL B 2 47 ? -1.345 0.076 -5.620 1.00 94.77 47 B 1 ATOM 1560 N N . PRO B 2 48 ? -3.388 -2.637 -8.915 1.00 98.15 48 B 1 ATOM 1561 C CA . PRO B 2 48 ? -4.439 -3.127 -9.800 1.00 98.04 48 B 1 ATOM 1562 C C . PRO B 2 48 ? -5.844 -2.718 -9.346 1.00 98.05 48 B 1 ATOM 1563 O O . PRO B 2 48 ? -6.151 -2.723 -8.153 1.00 97.41 48 B 1 ATOM 1564 C CB . PRO B 2 48 ? -4.266 -4.646 -9.840 1.00 97.48 48 B 1 ATOM 1565 C CG . PRO B 2 48 ? -2.809 -4.865 -9.442 1.00 96.14 48 B 1 ATOM 1566 C CD . PRO B 2 48 ? -2.573 -3.748 -8.439 1.00 97.66 48 B 1 ATOM 1567 N N . ASP B 2 49 ? -6.722 -2.417 -10.303 1.00 97.35 49 B 1 ATOM 1568 C CA . ASP B 2 49 ? -8.062 -1.873 -10.031 1.00 97.13 49 B 1 ATOM 1569 C C . ASP B 2 49 ? -8.974 -2.838 -9.245 1.00 97.64 49 B 1 ATOM 1570 O O . ASP B 2 49 ? -9.861 -2.387 -8.519 1.00 96.59 49 B 1 ATOM 1571 C CB . ASP B 2 49 ? -8.733 -1.461 -11.357 1.00 95.50 49 B 1 ATOM 1572 C CG . ASP B 2 49 ? -8.210 -0.146 -11.953 1.00 92.76 49 B 1 ATOM 1573 O OD1 . ASP B 2 49 ? -7.895 0.786 -11.180 1.00 88.10 49 B 1 ATOM 1574 O OD2 . ASP B 2 49 ? -8.168 -0.006 -13.199 1.00 87.22 49 B 1 ATOM 1575 N N . ASN B 2 50 ? -8.753 -4.150 -9.358 1.00 97.58 50 B 1 ATOM 1576 C CA . ASN B 2 50 ? -9.501 -5.179 -8.623 1.00 97.74 50 B 1 ATOM 1577 C C . ASN B 2 50 ? -8.764 -5.706 -7.376 1.00 98.04 50 B 1 ATOM 1578 O O . ASN B 2 50 ? -9.167 -6.723 -6.806 1.00 97.33 50 B 1 ATOM 1579 C CB . ASN B 2 50 ? -9.916 -6.306 -9.583 1.00 97.12 50 B 1 ATOM 1580 C CG . ASN B 2 50 ? -10.970 -5.900 -10.598 1.00 96.04 50 B 1 ATOM 1581 O OD1 . ASN B 2 50 ? -11.595 -4.852 -10.543 1.00 89.93 50 B 1 ATOM 1582 N ND2 . ASN B 2 50 ? -11.226 -6.761 -11.559 1.00 88.79 50 B 1 ATOM 1583 N N . SER B 2 51 ? -7.703 -5.041 -6.931 1.00 98.30 51 B 1 ATOM 1584 C CA . SER B 2 51 ? -7.082 -5.321 -5.634 1.00 98.32 51 B 1 ATOM 1585 C C . SER B 2 51 ? -7.951 -4.795 -4.487 1.00 98.45 51 B 1 ATOM 1586 O O . SER B 2 51 ? -8.697 -3.823 -4.644 1.00 98.05 51 B 1 ATOM 1587 C CB . SER B 2 51 ? -5.666 -4.742 -5.566 1.00 97.67 51 B 1 ATOM 1588 O OG . SER B 2 51 ? -5.693 -3.331 -5.576 1.00 94.63 51 B 1 ATOM 1589 N N . ILE B 2 52 ? -7.849 -5.422 -3.319 1.00 98.50 52 B 1 ATOM 1590 C CA . ILE B 2 52 ? -8.638 -5.075 -2.130 1.00 98.56 52 B 1 ATOM 1591 C C . ILE B 2 52 ? -7.687 -4.824 -0.950 1.00 98.55 52 B 1 ATOM 1592 O O . ILE B 2 52 ? -7.440 -5.723 -0.144 1.00 98.30 52 B 1 ATOM 1593 C CB . ILE B 2 52 ? -9.703 -6.160 -1.847 1.00 98.52 52 B 1 ATOM 1594 C CG1 . ILE B 2 52 ? -10.617 -6.413 -3.075 1.00 97.97 52 B 1 ATOM 1595 C CG2 . ILE B 2 52 ? -10.566 -5.743 -0.638 1.00 98.05 52 B 1 ATOM 1596 C CD1 . ILE B 2 52 ? -11.336 -7.765 -3.016 1.00 95.85 52 B 1 ATOM 1597 N N . PRO B 2 53 ? -7.100 -3.627 -0.844 1.00 98.59 53 B 1 ATOM 1598 C CA . PRO B 2 53 ? -6.151 -3.302 0.215 1.00 98.46 53 B 1 ATOM 1599 C C . PRO B 2 53 ? -6.862 -2.993 1.535 1.00 98.39 53 B 1 ATOM 1600 O O . PRO B 2 53 ? -7.749 -2.142 1.591 1.00 97.65 53 B 1 ATOM 1601 C CB . PRO B 2 53 ? -5.351 -2.094 -0.289 1.00 98.00 53 B 1 ATOM 1602 C CG . PRO B 2 53 ? -5.740 -1.943 -1.761 1.00 96.68 53 B 1 ATOM 1603 C CD . PRO B 2 53 ? -7.128 -2.552 -1.825 1.00 98.10 53 B 1 ATOM 1604 N N . ILE B 2 54 ? -6.416 -3.628 2.611 1.00 98.31 54 B 1 ATOM 1605 C CA . ILE B 2 54 ? -6.866 -3.366 3.980 1.00 98.28 54 B 1 ATOM 1606 C C . ILE B 2 54 ? -5.653 -2.932 4.804 1.00 98.10 54 B 1 ATOM 1607 O O . ILE B 2 54 ? -4.818 -3.751 5.198 1.00 97.49 54 B 1 ATOM 1608 C CB . ILE B 2 54 ? -7.581 -4.599 4.582 1.00 98.22 54 B 1 ATOM 1609 C CG1 . ILE B 2 54 ? -8.760 -5.063 3.687 1.00 97.57 54 B 1 ATOM 1610 C CG2 . ILE B 2 54 ? -8.067 -4.274 6.008 1.00 97.64 54 B 1 ATOM 1611 C CD1 . ILE B 2 54 ? -9.424 -6.363 4.162 1.00 95.92 54 B 1 ATOM 1612 N N . CYS B 2 55 ? -5.547 -1.644 5.074 1.00 97.45 55 B 1 ATOM 1613 C CA . CYS B 2 55 ? -4.496 -1.113 5.934 1.00 96.87 55 B 1 ATOM 1614 C C . CYS B 2 55 ? -4.871 -1.332 7.402 1.00 96.68 55 B 1 ATOM 1615 O O . CYS B 2 55 ? -5.652 -0.567 7.975 1.00 95.64 55 B 1 ATOM 1616 C CB . CYS B 2 55 ? -4.240 0.361 5.595 1.00 96.04 55 B 1 ATOM 1617 S SG . CYS B 2 55 ? -2.781 0.947 6.513 1.00 94.19 55 B 1 ATOM 1618 N N . SER B 2 56 ? -4.320 -2.366 8.016 1.00 96.81 56 B 1 ATOM 1619 C CA . SER B 2 56 ? -4.594 -2.690 9.415 1.00 96.94 56 B 1 ATOM 1620 C C . SER B 2 56 ? -3.435 -3.431 10.079 1.00 97.23 56 B 1 ATOM 1621 O O . SER B 2 56 ? -2.681 -4.167 9.444 1.00 96.44 56 B 1 ATOM 1622 C CB . SER B 2 56 ? -5.880 -3.518 9.516 1.00 96.33 56 B 1 ATOM 1623 O OG . SER B 2 56 ? -6.303 -3.599 10.867 1.00 91.43 56 B 1 ATOM 1624 N N . ASP B 2 57 ? -3.323 -3.242 11.382 1.00 96.77 57 B 1 ATOM 1625 C CA . ASP B 2 57 ? -2.588 -4.146 12.262 1.00 97.28 57 B 1 ATOM 1626 C C . ASP B 2 57 ? -3.456 -5.387 12.501 1.00 97.61 57 B 1 ATOM 1627 O O . ASP B 2 57 ? -4.570 -5.275 13.016 1.00 96.95 57 B 1 ATOM 1628 C CB . ASP B 2 57 ? -2.261 -3.382 13.554 1.00 96.89 57 B 1 ATOM 1629 C CG . ASP B 2 57 ? -1.577 -4.196 14.656 1.00 96.54 57 B 1 ATOM 1630 O OD1 . ASP B 2 57 ? -1.456 -5.434 14.533 1.00 94.06 57 B 1 ATOM 1631 O OD2 . ASP B 2 57 ? -1.223 -3.563 15.681 1.00 93.24 57 B 1 ATOM 1632 N N . VAL B 2 58 ? -2.949 -6.570 12.129 1.00 97.79 58 B 1 ATOM 1633 C CA . VAL B 2 58 ? -3.699 -7.828 12.269 1.00 97.94 58 B 1 ATOM 1634 C C . VAL B 2 58 ? -4.057 -8.155 13.717 1.00 98.03 58 B 1 ATOM 1635 O O . VAL B 2 58 ? -5.019 -8.868 13.957 1.00 97.33 58 B 1 ATOM 1636 C CB . VAL B 2 58 ? -2.969 -9.028 11.641 1.00 97.27 58 B 1 ATOM 1637 C CG1 . VAL B 2 58 ? -2.732 -8.817 10.143 1.00 94.04 58 B 1 ATOM 1638 C CG2 . VAL B 2 58 ? -1.634 -9.333 12.336 1.00 94.58 58 B 1 ATOM 1639 N N . THR B 2 59 ? -3.333 -7.609 14.686 1.00 97.57 59 B 1 ATOM 1640 C CA . THR B 2 59 ? -3.637 -7.799 16.113 1.00 97.23 59 B 1 ATOM 1641 C C . THR B 2 59 ? -4.848 -6.985 16.578 1.00 97.22 59 B 1 ATOM 1642 O O . THR B 2 59 ? -5.359 -7.211 17.672 1.00 95.85 59 B 1 ATOM 1643 C CB . THR B 2 59 ? -2.431 -7.486 17.012 1.00 96.55 59 B 1 ATOM 1644 O OG1 . THR B 2 59 ? -2.118 -6.115 17.059 1.00 90.41 59 B 1 ATOM 1645 C CG2 . THR B 2 59 ? -1.170 -8.245 16.589 1.00 89.12 59 B 1 ATOM 1646 N N . LYS B 2 60 ? -5.313 -6.041 15.749 1.00 97.11 60 B 1 ATOM 1647 C CA . LYS B 2 60 ? -6.459 -5.159 16.016 1.00 96.57 60 B 1 ATOM 1648 C C . LYS B 2 60 ? -7.569 -5.295 14.976 1.00 96.86 60 B 1 ATOM 1649 O O . LYS B 2 60 ? -8.625 -4.689 15.135 1.00 95.07 60 B 1 ATOM 1650 C CB . LYS B 2 60 ? -5.977 -3.707 16.082 1.00 95.47 60 B 1 ATOM 1651 C CG . LYS B 2 60 ? -4.938 -3.485 17.190 1.00 92.92 60 B 1 ATOM 1652 C CD . LYS B 2 60 ? -4.424 -2.049 17.138 1.00 86.92 60 B 1 ATOM 1653 C CE . LYS B 2 60 ? -3.252 -1.914 18.104 1.00 80.85 60 B 1 ATOM 1654 N NZ . LYS B 2 60 ? -2.472 -0.689 17.824 1.00 69.61 60 B 1 ATOM 1655 N N . LEU B 2 61 ? -7.333 -6.064 13.914 1.00 96.99 61 B 1 ATOM 1656 C CA . LEU B 2 61 ? -8.291 -6.251 12.833 1.00 97.44 61 B 1 ATOM 1657 C C . LEU B 2 61 ? -9.538 -6.990 13.336 1.00 97.75 61 B 1 ATOM 1658 O O . LEU B 2 61 ? -9.450 -8.040 13.969 1.00 97.18 61 B 1 ATOM 1659 C CB . LEU B 2 61 ? -7.608 -6.999 11.678 1.00 97.11 61 B 1 ATOM 1660 C CG . LEU B 2 61 ? -8.528 -7.276 10.475 1.00 96.61 61 B 1 ATOM 1661 C CD1 . LEU B 2 61 ? -8.980 -5.990 9.785 1.00 94.27 61 B 1 ATOM 1662 C CD2 . LEU B 2 61 ? -7.782 -8.124 9.449 1.00 94.05 61 B 1 ATOM 1663 N N . ASN B 2 62 ? -10.708 -6.471 12.972 1.00 97.39 62 B 1 ATOM 1664 C CA . ASN B 2 62 ? -11.958 -7.190 13.156 1.00 97.54 62 B 1 ATOM 1665 C C . ASN B 2 62 ? -12.102 -8.279 12.075 1.00 97.98 62 B 1 ATOM 1666 O O . ASN B 2 62 ? -12.656 -8.047 10.999 1.00 97.62 62 B 1 ATOM 1667 C CB . ASN B 2 62 ? -13.128 -6.192 13.180 1.00 96.72 62 B 1 ATOM 1668 C CG . ASN B 2 62 ? -14.448 -6.885 13.483 1.00 95.34 62 B 1 ATOM 1669 O OD1 . ASN B 2 62 ? -14.545 -8.094 13.577 1.00 90.83 62 B 1 ATOM 1670 N ND2 . ASN B 2 62 ? -15.509 -6.128 13.651 1.00 88.79 62 B 1 ATOM 1671 N N . PHE B 2 63 ? -11.611 -9.485 12.370 1.00 98.16 63 B 1 ATOM 1672 C CA . PHE B 2 63 ? -11.714 -10.630 11.464 1.00 98.32 63 B 1 ATOM 1673 C C . PHE B 2 63 ? -13.164 -11.052 11.194 1.00 98.41 63 B 1 ATOM 1674 O O . PHE B 2 63 ? -13.446 -11.548 10.107 1.00 97.98 63 B 1 ATOM 1675 C CB . PHE B 2 63 ? -10.907 -11.802 12.024 1.00 98.12 63 B 1 ATOM 1676 C CG . PHE B 2 63 ? -9.414 -11.674 11.797 1.00 98.19 63 B 1 ATOM 1677 C CD1 . PHE B 2 63 ? -8.860 -12.045 10.558 1.00 97.24 63 B 1 ATOM 1678 C CD2 . PHE B 2 63 ? -8.573 -11.190 12.813 1.00 97.26 63 B 1 ATOM 1679 C CE1 . PHE B 2 63 ? -7.478 -11.945 10.336 1.00 96.58 63 B 1 ATOM 1680 C CE2 . PHE B 2 63 ? -7.187 -11.085 12.595 1.00 96.59 63 B 1 ATOM 1681 C CZ . PHE B 2 63 ? -6.641 -11.466 11.356 1.00 96.99 63 B 1 ATOM 1682 N N . GLN B 2 64 ? -14.089 -10.814 12.123 1.00 98.10 64 B 1 ATOM 1683 C CA . GLN B 2 64 ? -15.500 -11.122 11.890 1.00 98.07 64 B 1 ATOM 1684 C C . GLN B 2 64 ? -16.081 -10.236 10.785 1.00 98.21 64 B 1 ATOM 1685 O O . GLN B 2 64 ? -16.774 -10.735 9.905 1.00 97.88 64 B 1 ATOM 1686 C CB . GLN B 2 64 ? -16.298 -11.011 13.197 1.00 97.69 64 B 1 ATOM 1687 C CG . GLN B 2 64 ? -17.733 -11.551 13.038 1.00 93.53 64 B 1 ATOM 1688 C CD . GLN B 2 64 ? -17.740 -13.026 12.631 1.00 93.96 64 B 1 ATOM 1689 O OE1 . GLN B 2 64 ? -17.082 -13.857 13.238 1.00 85.88 64 B 1 ATOM 1690 N NE2 . GLN B 2 64 ? -18.449 -13.389 11.588 1.00 84.87 64 B 1 ATOM 1691 N N . ALA B 2 65 ? -15.728 -8.951 10.752 1.00 98.20 65 B 1 ATOM 1692 C CA . ALA B 2 65 ? -16.140 -8.063 9.664 1.00 98.08 65 B 1 ATOM 1693 C C . ALA B 2 65 ? -15.591 -8.521 8.299 1.00 98.32 65 B 1 ATOM 1694 O O . ALA B 2 65 ? -16.306 -8.450 7.297 1.00 97.87 65 B 1 ATOM 1695 C CB . ALA B 2 65 ? -15.700 -6.635 9.994 1.00 97.57 65 B 1 ATOM 1696 N N . LEU B 2 66 ? -14.359 -9.041 8.252 1.00 98.47 66 B 1 ATOM 1697 C CA . LEU B 2 66 ? -13.787 -9.647 7.043 1.00 98.55 66 B 1 ATOM 1698 C C . LEU B 2 66 ? -14.584 -10.886 6.606 1.00 98.60 66 B 1 ATOM 1699 O O . LEU B 2 66 ? -14.925 -11.008 5.428 1.00 98.37 66 B 1 ATOM 1700 C CB . LEU B 2 66 ? -12.300 -9.970 7.287 1.00 98.38 66 B 1 ATOM 1701 C CG . LEU B 2 66 ? -11.618 -10.787 6.169 1.00 97.72 66 B 1 ATOM 1702 C CD1 . LEU B 2 66 ? -11.581 -10.033 4.840 1.00 96.66 66 B 1 ATOM 1703 C CD2 . LEU B 2 66 ? -10.181 -11.117 6.571 1.00 96.39 66 B 1 ATOM 1704 N N . ILE B 2 67 ? -14.907 -11.779 7.541 1.00 98.51 67 B 1 ATOM 1705 C CA . ILE B 2 67 ? -15.704 -12.987 7.285 1.00 98.40 67 B 1 ATOM 1706 C C . ILE B 2 67 ? -17.089 -12.607 6.751 1.00 98.43 67 B 1 ATOM 1707 O O . ILE B 2 67 ? -17.521 -13.128 5.721 1.00 98.18 67 B 1 ATOM 1708 C CB . ILE B 2 67 ? -15.794 -13.847 8.571 1.00 98.08 67 B 1 ATOM 1709 C CG1 . ILE B 2 67 ? -14.419 -14.479 8.894 1.00 96.56 67 B 1 ATOM 1710 C CG2 . ILE B 2 67 ? -16.860 -14.954 8.452 1.00 96.95 67 B 1 ATOM 1711 C CD1 . ILE B 2 67 ? -14.295 -14.982 10.337 1.00 93.28 67 B 1 ATOM 1712 N N . ASP B 2 68 ? -17.760 -11.675 7.405 1.00 98.38 68 B 1 ATOM 1713 C CA . ASP B 2 68 ? -19.109 -11.246 7.046 1.00 98.30 68 B 1 ATOM 1714 C C . ASP B 2 68 ? -19.145 -10.604 5.651 1.00 98.28 68 B 1 ATOM 1715 O O . ASP B 2 68 ? -20.018 -10.929 4.842 1.00 97.80 68 B 1 ATOM 1716 C CB . ASP B 2 68 ? -19.641 -10.262 8.098 1.00 98.08 68 B 1 ATOM 1717 C CG . ASP B 2 68 ? -19.869 -10.869 9.484 1.00 96.53 68 B 1 ATOM 1718 O OD1 . ASP B 2 68 ? -19.871 -12.113 9.619 1.00 93.84 68 B 1 ATOM 1719 O OD2 . ASP B 2 68 ? -20.062 -10.068 10.430 1.00 93.81 68 B 1 ATOM 1720 N N . ALA B 2 69 ? -18.177 -9.743 5.337 1.00 98.34 69 B 1 ATOM 1721 C CA . ALA B 2 69 ? -18.054 -9.132 4.013 1.00 98.28 69 B 1 ATOM 1722 C C . ALA B 2 69 ? -17.751 -10.180 2.930 1.00 98.38 69 B 1 ATOM 1723 O O . ALA B 2 69 ? -18.399 -10.196 1.880 1.00 98.00 69 B 1 ATOM 1724 C CB . ALA B 2 69 ? -16.973 -8.050 4.073 1.00 98.01 69 B 1 ATOM 1725 N N . GLN B 2 70 ? -16.831 -11.099 3.189 1.00 98.38 70 B 1 ATOM 1726 C CA . GLN B 2 70 ? -16.480 -12.168 2.256 1.00 98.35 70 B 1 ATOM 1727 C C . GLN B 2 70 ? -17.682 -13.076 1.960 1.00 98.28 70 B 1 ATOM 1728 O O . GLN B 2 70 ? -17.970 -13.367 0.794 1.00 97.88 70 B 1 ATOM 1729 C CB . GLN B 2 70 ? -15.278 -12.943 2.821 1.00 98.10 70 B 1 ATOM 1730 C CG . GLN B 2 70 ? -14.830 -14.123 1.944 1.00 97.07 70 B 1 ATOM 1731 C CD . GLN B 2 70 ? -14.412 -13.742 0.528 1.00 97.93 70 B 1 ATOM 1732 O OE1 . GLN B 2 70 ? -14.103 -12.614 0.199 1.00 93.44 70 B 1 ATOM 1733 N NE2 . GLN B 2 70 ? -14.401 -14.699 -0.375 1.00 93.08 70 B 1 ATOM 1734 N N . MET B 2 71 ? -18.432 -13.475 2.982 1.00 98.14 71 B 1 ATOM 1735 C CA . MET B 2 71 ? -19.648 -14.269 2.799 1.00 97.86 71 B 1 ATOM 1736 C C . MET B 2 71 ? -20.736 -13.490 2.056 1.00 97.73 71 B 1 ATOM 1737 O O . MET B 2 71 ? -21.382 -14.044 1.168 1.00 96.92 71 B 1 ATOM 1738 C CB . MET B 2 71 ? -20.167 -14.763 4.155 1.00 97.45 71 B 1 ATOM 1739 C CG . MET B 2 71 ? -19.314 -15.899 4.720 1.00 93.59 71 B 1 ATOM 1740 S SD . MET B 2 71 ? -19.225 -17.396 3.681 1.00 92.23 71 B 1 ATOM 1741 C CE . MET B 2 71 ? -20.941 -17.959 3.745 1.00 80.71 71 B 1 ATOM 1742 N N . ARG B 2 72 ? -20.912 -12.208 2.360 1.00 97.82 72 B 1 ATOM 1743 C CA . ARG B 2 72 ? -21.910 -11.343 1.712 1.00 97.62 72 B 1 ATOM 1744 C C . ARG B 2 72 ? -21.637 -11.147 0.219 1.00 97.46 72 B 1 ATOM 1745 O O . ARG B 2 72 ? -22.569 -11.189 -0.576 1.00 96.56 72 B 1 ATOM 1746 C CB . ARG B 2 72 ? -21.940 -9.999 2.451 1.00 97.04 72 B 1 ATOM 1747 C CG . ARG B 2 72 ? -23.109 -9.102 2.022 1.00 89.72 72 B 1 ATOM 1748 C CD . ARG B 2 72 ? -23.033 -7.730 2.713 1.00 89.26 72 B 1 ATOM 1749 N NE . ARG B 2 72 ? -22.907 -7.854 4.178 1.00 81.74 72 B 1 ATOM 1750 C CZ . ARG B 2 72 ? -22.073 -7.186 4.962 1.00 77.81 72 B 1 ATOM 1751 N NH1 . ARG B 2 72 ? -21.320 -6.226 4.522 1.00 68.11 72 B 1 ATOM 1752 N NH2 . ARG B 2 72 ? -21.982 -7.484 6.223 1.00 69.79 72 B 1 ATOM 1753 N N . HIS B 2 73 ? -20.374 -10.948 -0.158 1.00 97.65 73 B 1 ATOM 1754 C CA . HIS B 2 73 ? -20.004 -10.536 -1.515 1.00 97.25 73 B 1 ATOM 1755 C C . HIS B 2 73 ? -19.510 -11.673 -2.415 1.00 96.75 73 B 1 ATOM 1756 O O . HIS B 2 73 ? -19.597 -11.541 -3.637 1.00 95.44 73 B 1 ATOM 1757 C CB . HIS B 2 73 ? -18.986 -9.394 -1.435 1.00 97.23 73 B 1 ATOM 1758 C CG . HIS B 2 73 ? -19.520 -8.179 -0.723 1.00 97.56 73 B 1 ATOM 1759 N ND1 . HIS B 2 73 ? -20.723 -7.539 -0.990 1.00 89.76 73 B 1 ATOM 1760 C CD2 . HIS B 2 73 ? -18.920 -7.531 0.323 1.00 90.89 73 B 1 ATOM 1761 C CE1 . HIS B 2 73 ? -20.835 -6.531 -0.117 1.00 93.06 73 B 1 ATOM 1762 N NE2 . HIS B 2 73 ? -19.761 -6.497 0.690 1.00 94.21 73 B 1 ATOM 1763 N N . ALA B 2 74 ? -19.026 -12.781 -1.848 1.00 97.69 74 B 1 ATOM 1764 C CA . ALA B 2 74 ? -18.572 -13.955 -2.604 1.00 97.13 74 B 1 ATOM 1765 C C . ALA B 2 74 ? -19.377 -15.237 -2.312 1.00 96.53 74 B 1 ATOM 1766 O O . ALA B 2 74 ? -19.270 -16.212 -3.057 1.00 93.90 74 B 1 ATOM 1767 C CB . ALA B 2 74 ? -17.074 -14.157 -2.351 1.00 96.52 74 B 1 ATOM 1768 N N . GLY B 2 75 ? -20.154 -15.271 -1.232 1.00 96.80 75 B 1 ATOM 1769 C CA . GLY B 2 75 ? -20.941 -16.444 -0.828 1.00 95.99 75 B 1 ATOM 1770 C C . GLY B 2 75 ? -20.118 -17.633 -0.316 1.00 95.95 75 B 1 ATOM 1771 O O . GLY B 2 75 ? -20.650 -18.733 -0.167 1.00 93.76 75 B 1 ATOM 1772 N N . LYS B 2 76 ? -18.821 -17.443 -0.083 1.00 96.14 76 B 1 ATOM 1773 C CA . LYS B 2 76 ? -17.896 -18.469 0.412 1.00 96.01 76 B 1 ATOM 1774 C C . LYS B 2 76 ? -16.649 -17.833 1.029 1.00 96.93 76 B 1 ATOM 1775 O O . LYS B 2 76 ? -16.317 -16.696 0.715 1.00 96.38 76 B 1 ATOM 1776 C CB . LYS B 2 76 ? -17.502 -19.429 -0.723 1.00 93.31 76 B 1 ATOM 1777 C CG . LYS B 2 76 ? -16.649 -18.767 -1.815 1.00 89.49 76 B 1 ATOM 1778 C CD . LYS B 2 76 ? -16.350 -19.761 -2.952 1.00 88.02 76 B 1 ATOM 1779 C CE . LYS B 2 76 ? -15.373 -19.178 -3.970 1.00 83.06 76 B 1 ATOM 1780 N NZ . LYS B 2 76 ? -13.979 -19.228 -3.469 1.00 78.56 76 B 1 ATOM 1781 N N . MET B 2 77 ? -15.937 -18.611 1.836 1.00 97.14 77 B 1 ATOM 1782 C CA . MET B 2 77 ? -14.618 -18.241 2.355 1.00 97.38 77 B 1 ATOM 1783 C C . MET B 2 77 ? -13.515 -18.327 1.287 1.00 97.55 77 B 1 ATOM 1784 O O . MET B 2 77 ? -13.771 -18.685 0.131 1.00 96.79 77 B 1 ATOM 1785 C CB . MET B 2 77 ? -14.301 -19.100 3.586 1.00 96.86 77 B 1 ATOM 1786 C CG . MET B 2 77 ? -15.194 -18.776 4.796 1.00 93.75 77 B 1 ATOM 1787 S SD . MET B 2 77 ? -14.928 -17.112 5.462 1.00 91.14 77 B 1 ATOM 1788 C CE . MET B 2 77 ? -16.173 -16.155 4.607 1.00 79.52 77 B 1 ATOM 1789 N N . PHE B 2 78 ? -12.292 -17.973 1.674 1.00 98.14 78 B 1 ATOM 1790 C CA . PHE B 2 78 ? -11.136 -17.942 0.782 1.00 98.35 78 B 1 ATOM 1791 C C . PHE B 2 78 ? -10.709 -19.348 0.340 1.00 98.20 78 B 1 ATOM 1792 O O . PHE B 2 78 ? -10.716 -20.289 1.129 1.00 97.61 78 B 1 ATOM 1793 C CB . PHE B 2 78 ? -9.997 -17.181 1.462 1.00 98.49 78 B 1 ATOM 1794 C CG . PHE B 2 78 ? -10.345 -15.738 1.754 1.00 98.62 78 B 1 ATOM 1795 C CD1 . PHE B 2 78 ? -10.347 -14.796 0.711 1.00 98.29 78 B 1 ATOM 1796 C CD2 . PHE B 2 78 ? -10.724 -15.340 3.049 1.00 98.18 78 B 1 ATOM 1797 C CE1 . PHE B 2 78 ? -10.716 -13.465 0.955 1.00 98.05 78 B 1 ATOM 1798 C CE2 . PHE B 2 78 ? -11.094 -14.008 3.299 1.00 98.03 78 B 1 ATOM 1799 C CZ . PHE B 2 78 ? -11.091 -13.070 2.251 1.00 98.25 78 B 1 ATOM 1800 N N . ASP B 2 79 ? -10.310 -19.477 -0.928 1.00 98.14 79 B 1 ATOM 1801 C CA . ASP B 2 79 ? -9.785 -20.731 -1.486 1.00 98.01 79 B 1 ATOM 1802 C C . ASP B 2 79 ? -8.286 -20.885 -1.198 1.00 98.25 79 B 1 ATOM 1803 O O . ASP B 2 79 ? -7.810 -21.989 -0.939 1.00 97.77 79 B 1 ATOM 1804 C CB . ASP B 2 79 ? -10.005 -20.770 -3.005 1.00 97.47 79 B 1 ATOM 1805 C CG . ASP B 2 79 ? -11.456 -20.590 -3.443 1.00 96.94 79 B 1 ATOM 1806 O OD1 . ASP B 2 79 ? -12.341 -21.413 -3.121 1.00 94.70 79 B 1 ATOM 1807 O OD2 . ASP B 2 79 ? -11.740 -19.605 -4.162 1.00 94.48 79 B 1 ATOM 1808 N N . VAL B 2 80 ? -7.547 -19.790 -1.242 1.00 98.41 80 B 1 ATOM 1809 C CA . VAL B 2 80 ? -6.121 -19.773 -0.901 1.00 98.58 80 B 1 ATOM 1810 C C . VAL B 2 80 ? -5.836 -18.613 0.045 1.00 98.71 80 B 1 ATOM 1811 O O . VAL B 2 80 ? -6.225 -17.474 -0.212 1.00 98.55 80 B 1 ATOM 1812 C CB . VAL B 2 80 ? -5.213 -19.712 -2.146 1.00 98.34 80 B 1 ATOM 1813 C CG1 . VAL B 2 80 ? -3.733 -19.806 -1.753 1.00 97.46 80 B 1 ATOM 1814 C CG2 . VAL B 2 80 ? -5.509 -20.855 -3.130 1.00 97.50 80 B 1 ATOM 1815 N N . ILE B 2 81 ? -5.141 -18.902 1.128 1.00 98.75 81 B 1 ATOM 1816 C CA . ILE B 2 81 ? -4.577 -17.907 2.039 1.00 98.82 81 B 1 ATOM 1817 C C . ILE B 2 81 ? -3.062 -17.946 1.891 1.00 98.84 81 B 1 ATOM 1818 O O . ILE B 2 81 ? -2.462 -19.009 2.006 1.00 98.68 81 B 1 ATOM 1819 C CB . ILE B 2 81 ? -5.022 -18.148 3.498 1.00 98.75 81 B 1 ATOM 1820 C CG1 . ILE B 2 81 ? -6.566 -18.133 3.603 1.00 98.25 81 B 1 ATOM 1821 C CG2 . ILE B 2 81 ? -4.388 -17.090 4.426 1.00 98.43 81 B 1 ATOM 1822 C CD1 . ILE B 2 81 ? -7.108 -18.410 5.008 1.00 97.61 81 B 1 ATOM 1823 N N . MET B 2 82 ? -2.428 -16.805 1.689 1.00 98.85 82 B 1 ATOM 1824 C CA . MET B 2 82 ? -0.976 -16.681 1.733 1.00 98.82 82 B 1 ATOM 1825 C C . MET B 2 82 ? -0.572 -15.725 2.843 1.00 98.86 82 B 1 ATOM 1826 O O . MET B 2 82 ? -1.237 -14.720 3.093 1.00 98.66 82 B 1 ATOM 1827 C CB . MET B 2 82 ? -0.433 -16.260 0.360 1.00 98.39 82 B 1 ATOM 1828 C CG . MET B 2 82 ? 1.106 -16.206 0.341 1.00 96.76 82 B 1 ATOM 1829 S SD . MET B 2 82 ? 1.850 -16.045 -1.306 1.00 96.08 82 B 1 ATOM 1830 C CE . MET B 2 82 ? 1.183 -14.444 -1.823 1.00 89.90 82 B 1 ATOM 1831 N N . MET B 2 83 ? 0.541 -16.013 3.512 1.00 98.62 83 B 1 ATOM 1832 C CA . MET B 2 83 ? 1.139 -15.058 4.434 1.00 98.42 83 B 1 ATOM 1833 C C . MET B 2 83 ? 2.661 -15.065 4.369 1.00 98.64 83 B 1 ATOM 1834 O O . MET B 2 83 ? 3.302 -16.100 4.196 1.00 98.15 83 B 1 ATOM 1835 C CB . MET B 2 83 ? 0.606 -15.250 5.861 1.00 95.88 83 B 1 ATOM 1836 C CG . MET B 2 83 ? 0.946 -16.613 6.467 1.00 88.73 83 B 1 ATOM 1837 S SD . MET B 2 83 ? 0.375 -16.825 8.185 1.00 91.27 83 B 1 ATOM 1838 C CE . MET B 2 83 ? -1.407 -16.853 7.917 1.00 84.21 83 B 1 ATOM 1839 N N . ASP B 2 84 ? 3.235 -13.881 4.543 1.00 98.44 84 B 1 ATOM 1840 C CA . ASP B 2 84 ? 4.674 -13.665 4.674 1.00 98.27 84 B 1 ATOM 1841 C C . ASP B 2 84 ? 4.944 -12.962 6.011 1.00 98.22 84 B 1 ATOM 1842 O O . ASP B 2 84 ? 5.060 -11.733 6.059 1.00 97.58 84 B 1 ATOM 1843 C CB . ASP B 2 84 ? 5.187 -12.870 3.465 1.00 97.72 84 B 1 ATOM 1844 C CG . ASP B 2 84 ? 6.706 -12.692 3.485 1.00 96.94 84 B 1 ATOM 1845 O OD1 . ASP B 2 84 ? 7.427 -13.436 4.193 1.00 95.21 84 B 1 ATOM 1846 O OD2 . ASP B 2 84 ? 7.237 -11.878 2.696 1.00 94.17 84 B 1 ATOM 1847 N N . PRO B 2 85 ? 4.973 -13.717 7.123 1.00 98.15 85 B 1 ATOM 1848 C CA . PRO B 2 85 ? 4.930 -13.123 8.449 1.00 97.99 85 B 1 ATOM 1849 C C . PRO B 2 85 ? 6.147 -12.244 8.763 1.00 97.66 85 B 1 ATOM 1850 O O . PRO B 2 85 ? 7.281 -12.582 8.401 1.00 96.74 85 B 1 ATOM 1851 C CB . PRO B 2 85 ? 4.802 -14.291 9.431 1.00 97.82 85 B 1 ATOM 1852 C CG . PRO B 2 85 ? 4.187 -15.408 8.590 1.00 97.15 85 B 1 ATOM 1853 C CD . PRO B 2 85 ? 4.815 -15.168 7.222 1.00 98.06 85 B 1 ATOM 1854 N N . PRO B 2 86 ? 5.946 -11.165 9.525 1.00 97.63 86 B 1 ATOM 1855 C CA . PRO B 2 86 ? 7.034 -10.328 10.016 1.00 97.06 86 B 1 ATOM 1856 C C . PRO B 2 86 ? 7.703 -10.996 11.228 1.00 96.49 86 B 1 ATOM 1857 O O . PRO B 2 86 ? 7.569 -10.553 12.370 1.00 95.00 86 B 1 ATOM 1858 C CB . PRO B 2 86 ? 6.365 -8.984 10.327 1.00 96.63 86 B 1 ATOM 1859 C CG . PRO B 2 86 ? 4.992 -9.401 10.838 1.00 96.23 86 B 1 ATOM 1860 C CD . PRO B 2 86 ? 4.663 -10.620 9.973 1.00 97.04 86 B 1 ATOM 1861 N N . TRP B 2 87 ? 8.401 -12.101 10.976 1.00 96.70 87 B 1 ATOM 1862 C CA . TRP B 2 87 ? 8.985 -12.952 12.007 1.00 96.31 87 B 1 ATOM 1863 C C . TRP B 2 87 ? 9.891 -12.169 12.958 1.00 95.65 87 B 1 ATOM 1864 O O . TRP B 2 87 ? 10.887 -11.568 12.538 1.00 93.99 87 B 1 ATOM 1865 C CB . TRP B 2 87 ? 9.778 -14.085 11.355 1.00 96.22 87 B 1 ATOM 1866 C CG . TRP B 2 87 ? 8.967 -15.035 10.529 1.00 96.52 87 B 1 ATOM 1867 C CD1 . TRP B 2 87 ? 9.043 -15.168 9.188 1.00 95.39 87 B 1 ATOM 1868 C CD2 . TRP B 2 87 ? 7.956 -15.987 10.983 1.00 96.70 87 B 1 ATOM 1869 N NE1 . TRP B 2 87 ? 8.153 -16.152 8.768 1.00 95.66 87 B 1 ATOM 1870 C CE2 . TRP B 2 87 ? 7.470 -16.678 9.839 1.00 96.40 87 B 1 ATOM 1871 C CE3 . TRP B 2 87 ? 7.422 -16.331 12.245 1.00 96.43 87 B 1 ATOM 1872 C CZ2 . TRP B 2 87 ? 6.473 -17.680 9.946 1.00 96.08 87 B 1 ATOM 1873 C CZ3 . TRP B 2 87 ? 6.427 -17.325 12.344 1.00 95.72 87 B 1 ATOM 1874 C CH2 . TRP B 2 87 ? 5.961 -17.988 11.206 1.00 95.77 87 B 1 ATOM 1875 N N . GLN B 2 88 ? 9.596 -12.265 14.247 1.00 94.50 88 B 1 ATOM 1876 C CA . GLN B 2 88 ? 10.463 -11.714 15.273 1.00 93.18 88 B 1 ATOM 1877 C C . GLN B 2 88 ? 11.702 -12.600 15.418 1.00 91.65 88 B 1 ATOM 1878 O O . GLN B 2 88 ? 11.634 -13.748 15.864 1.00 88.54 88 B 1 ATOM 1879 C CB . GLN B 2 88 ? 9.679 -11.550 16.578 1.00 91.43 88 B 1 ATOM 1880 C CG . GLN B 2 88 ? 10.474 -10.712 17.590 1.00 86.22 88 B 1 ATOM 1881 C CD . GLN B 2 88 ? 9.654 -10.393 18.840 1.00 85.38 88 B 1 ATOM 1882 O OE1 . GLN B 2 88 ? 8.687 -11.058 19.180 1.00 77.88 88 B 1 ATOM 1883 N NE2 . GLN B 2 88 ? 10.013 -9.364 19.565 1.00 75.41 88 B 1 ATOM 1884 N N . LEU B 2 89 ? 12.850 -12.052 15.031 1.00 90.19 89 B 1 ATOM 1885 C CA . LEU B 2 89 ? 14.138 -12.707 15.217 1.00 86.62 89 B 1 ATOM 1886 C C . LEU B 2 89 ? 14.574 -12.544 16.674 1.00 84.80 89 B 1 ATOM 1887 O O . LEU B 2 89 ? 14.518 -11.446 17.227 1.00 75.80 89 B 1 ATOM 1888 C CB . LEU B 2 89 ? 15.170 -12.137 14.231 1.00 81.25 89 B 1 ATOM 1889 C CG . LEU B 2 89 ? 14.845 -12.437 12.753 1.00 75.07 89 B 1 ATOM 1890 C CD1 . LEU B 2 89 ? 15.823 -11.698 11.836 1.00 70.01 89 B 1 ATOM 1891 C CD2 . LEU B 2 89 ? 14.949 -13.938 12.446 1.00 69.40 89 B 1 ATOM 1892 N N . SER B 2 90 ? 15.029 -13.635 17.285 1.00 78.16 90 B 1 ATOM 1893 C CA . SER B 2 90 ? 15.669 -13.547 18.594 1.00 75.85 90 B 1 ATOM 1894 C C . SER B 2 90 ? 16.955 -12.727 18.477 1.00 75.21 90 B 1 ATOM 1895 O O . SER B 2 90 ? 17.743 -12.922 17.550 1.00 66.78 90 B 1 ATOM 1896 C CB . SER B 2 90 ? 15.947 -14.941 19.167 1.00 69.27 90 B 1 ATOM 1897 O OG . SER B 2 90 ? 16.740 -15.703 18.283 1.00 60.11 90 B 1 ATOM 1898 N N . SER B 2 91 ? 17.206 -11.852 19.453 1.00 66.93 91 B 1 ATOM 1899 C CA . SER B 2 91 ? 18.405 -11.003 19.502 1.00 63.86 91 B 1 ATOM 1900 C C . SER B 2 91 ? 19.724 -11.785 19.503 1.00 63.79 91 B 1 ATOM 1901 O O . SER B 2 91 ? 20.761 -11.243 19.140 1.00 57.77 91 B 1 ATOM 1902 C CB . SER B 2 91 ? 18.344 -10.137 20.764 1.00 57.11 91 B 1 ATOM 1903 O OG . SER B 2 91 ? 18.126 -10.956 21.900 1.00 51.67 91 B 1 ATOM 1904 N N . SER B 2 92 ? 19.695 -13.063 19.886 1.00 58.16 92 B 1 ATOM 1905 C CA . SER B 2 92 ? 20.872 -13.940 19.939 1.00 55.66 92 B 1 ATOM 1906 C C . SER B 2 92 ? 21.419 -14.338 18.569 1.00 56.56 92 B 1 ATOM 1907 O O . SER B 2 92 ? 22.593 -14.687 18.462 1.00 52.19 92 B 1 ATOM 1908 C CB . SER B 2 92 ? 20.525 -15.209 20.718 1.00 49.27 92 B 1 ATOM 1909 O OG . SER B 2 92 ? 19.435 -15.883 20.118 1.00 46.01 92 B 1 ATOM 1910 N N . GLN B 2 93 ? 20.607 -14.312 17.534 1.00 56.76 93 B 1 ATOM 1911 C CA . GLN B 2 93 ? 21.063 -14.441 16.153 1.00 55.69 93 B 1 ATOM 1912 C C . GLN B 2 93 ? 20.869 -13.098 15.439 1.00 56.52 93 B 1 ATOM 1913 O O . GLN B 2 93 ? 19.973 -12.972 14.601 1.00 51.67 93 B 1 ATOM 1914 C CB . GLN B 2 93 ? 20.375 -15.607 15.434 1.00 50.14 93 B 1 ATOM 1915 C CG . GLN B 2 93 ? 20.877 -16.969 15.928 1.00 45.70 93 B 1 ATOM 1916 C CD . GLN B 2 93 ? 20.403 -18.125 15.047 1.00 42.21 93 B 1 ATOM 1917 O OE1 . GLN B 2 93 ? 19.557 -17.994 14.172 1.00 39.23 93 B 1 ATOM 1918 N NE2 . GLN B 2 93 ? 20.932 -19.310 15.240 1.00 38.75 93 B 1 ATOM 1919 N N . PRO B 2 94 ? 21.697 -12.078 15.749 1.00 54.50 94 B 1 ATOM 1920 C CA . PRO B 2 94 ? 21.696 -10.862 14.970 1.00 53.22 94 B 1 ATOM 1921 C C . PRO B 2 94 ? 22.135 -11.248 13.560 1.00 54.57 94 B 1 ATOM 1922 O O . PRO B 2 94 ? 23.320 -11.461 13.292 1.00 51.80 94 B 1 ATOM 1923 C CB . PRO B 2 94 ? 22.659 -9.907 15.687 1.00 48.59 94 B 1 ATOM 1924 C CG . PRO B 2 94 ? 23.638 -10.837 16.403 1.00 47.46 94 B 1 ATOM 1925 C CD . PRO B 2 94 ? 22.792 -12.073 16.713 1.00 50.56 94 B 1 ATOM 1926 N N . SER B 2 95 ? 21.178 -11.378 12.647 1.00 55.70 95 B 1 ATOM 1927 C CA . SER B 2 95 ? 21.516 -11.374 11.234 1.00 54.72 95 B 1 ATOM 1928 C C . SER B 2 95 ? 22.267 -10.069 10.990 1.00 55.46 95 B 1 ATOM 1929 O O . SER B 2 95 ? 21.673 -8.995 11.095 1.00 51.42 95 B 1 ATOM 1930 C CB . SER B 2 95 ? 20.251 -11.481 10.373 1.00 50.06 95 B 1 ATOM 1931 O OG . SER B 2 95 ? 19.310 -10.497 10.736 1.00 46.51 95 B 1 ATOM 1932 N N . ARG B 2 96 ? 23.578 -10.142 10.733 1.00 53.33 96 B 1 ATOM 1933 C CA . ARG B 2 96 ? 24.516 -9.000 10.794 1.00 52.22 96 B 1 ATOM 1934 C C . ARG B 2 96 ? 24.044 -7.721 10.098 1.00 54.18 96 B 1 ATOM 1935 O O . ARG B 2 96 ? 24.342 -6.637 10.579 1.00 50.23 96 B 1 ATOM 1936 C CB . ARG B 2 96 ? 25.866 -9.391 10.145 1.00 46.57 96 B 1 ATOM 1937 C CG . ARG B 2 96 ? 26.778 -10.281 10.997 1.00 43.45 96 B 1 ATOM 1938 C CD . ARG B 2 96 ? 28.097 -10.473 10.240 1.00 41.39 96 B 1 ATOM 1939 N NE . ARG B 2 96 ? 29.082 -11.232 11.031 1.00 36.87 96 B 1 ATOM 1940 C CZ . ARG B 2 96 ? 30.321 -11.522 10.650 1.00 34.01 96 B 1 ATOM 1941 N NH1 . ARG B 2 96 ? 30.789 -11.182 9.479 1.00 31.27 96 B 1 ATOM 1942 N NH2 . ARG B 2 96 ? 31.121 -12.170 11.453 1.00 29.83 96 B 1 ATOM 1943 N N . GLY B 2 97 ? 23.466 -7.872 8.919 1.00 56.86 97 B 1 ATOM 1944 C CA . GLY B 2 97 ? 23.465 -6.777 7.958 1.00 54.98 97 B 1 ATOM 1945 C C . GLY B 2 97 ? 22.205 -5.925 7.919 1.00 57.23 97 B 1 ATOM 1946 O O . GLY B 2 97 ? 22.217 -4.755 8.284 1.00 53.94 97 B 1 ATOM 1947 N N . VAL B 2 98 ? 21.144 -6.479 7.364 1.00 62.29 98 B 1 ATOM 1948 C CA . VAL B 2 98 ? 20.019 -5.652 6.933 1.00 62.71 98 B 1 ATOM 1949 C C . VAL B 2 98 ? 19.055 -5.462 8.102 1.00 65.10 98 B 1 ATOM 1950 O O . VAL B 2 98 ? 18.340 -6.390 8.462 1.00 60.83 98 B 1 ATOM 1951 C CB . VAL B 2 98 ? 19.337 -6.219 5.676 1.00 57.34 98 B 1 ATOM 1952 C CG1 . VAL B 2 98 ? 18.389 -5.179 5.085 1.00 50.97 98 B 1 ATOM 1953 C CG2 . VAL B 2 98 ? 20.362 -6.567 4.579 1.00 51.70 98 B 1 ATOM 1954 N N . ALA B 2 99 ? 19.038 -4.260 8.678 1.00 65.31 99 B 1 ATOM 1955 C CA . ALA B 2 99 ? 17.986 -3.851 9.594 1.00 65.93 99 B 1 ATOM 1956 C C . ALA B 2 99 ? 16.638 -4.067 8.892 1.00 68.69 99 B 1 ATOM 1957 O O . ALA B 2 99 ? 16.405 -3.554 7.793 1.00 66.33 99 B 1 ATOM 1958 C CB . ALA B 2 99 ? 18.206 -2.391 10.003 1.00 60.64 99 B 1 ATOM 1959 N N . ILE B 2 100 ? 15.784 -4.900 9.492 1.00 73.92 100 B 1 ATOM 1960 C CA . ILE B 2 100 ? 14.441 -5.137 8.979 1.00 74.58 100 B 1 ATOM 1961 C C . ILE B 2 100 ? 13.661 -3.852 9.237 1.00 76.03 100 B 1 ATOM 1962 O O . ILE B 2 100 ? 13.511 -3.437 10.382 1.00 72.80 100 B 1 ATOM 1963 C CB . ILE B 2 100 ? 13.817 -6.390 9.618 1.00 70.59 100 B 1 ATOM 1964 C CG1 . ILE B 2 100 ? 14.676 -7.645 9.300 1.00 64.41 100 B 1 ATOM 1965 C CG2 . ILE B 2 100 ? 12.396 -6.572 9.082 1.00 63.43 100 B 1 ATOM 1966 C CD1 . ILE B 2 100 ? 14.173 -8.934 9.967 1.00 58.77 100 B 1 ATOM 1967 N N . ALA B 2 101 ? 13.209 -3.212 8.159 1.00 77.47 101 B 1 ATOM 1968 C CA . ALA B 2 101 ? 12.606 -1.882 8.207 1.00 78.19 101 B 1 ATOM 1969 C C . ALA B 2 101 ? 11.090 -1.898 8.491 1.00 82.02 101 B 1 ATOM 1970 O O . ALA B 2 101 ? 10.395 -0.948 8.135 1.00 77.39 101 B 1 ATOM 1971 C CB . ALA B 2 101 ? 12.969 -1.153 6.902 1.00 71.18 101 B 1 ATOM 1972 N N . TYR B 2 102 ? 10.569 -2.988 9.053 1.00 83.86 102 B 1 ATOM 1973 C CA . TYR B 2 102 ? 9.151 -3.141 9.367 1.00 84.99 102 B 1 ATOM 1974 C C . TYR B 2 102 ? 8.955 -3.745 10.765 1.00 86.59 102 B 1 ATOM 1975 O O . TYR B 2 102 ? 9.848 -4.406 11.303 1.00 84.31 102 B 1 ATOM 1976 C CB . TYR B 2 102 ? 8.454 -3.971 8.274 1.00 82.72 102 B 1 ATOM 1977 C CG . TYR B 2 102 ? 9.024 -5.362 8.024 1.00 84.21 102 B 1 ATOM 1978 C CD1 . TYR B 2 102 ? 9.793 -5.615 6.866 1.00 76.78 102 B 1 ATOM 1979 C CD2 . TYR B 2 102 ? 8.768 -6.418 8.920 1.00 80.52 102 B 1 ATOM 1980 C CE1 . TYR B 2 102 ? 10.303 -6.900 6.616 1.00 75.44 102 B 1 ATOM 1981 C CE2 . TYR B 2 102 ? 9.282 -7.712 8.683 1.00 77.38 102 B 1 ATOM 1982 C CZ . TYR B 2 102 ? 10.048 -7.948 7.528 1.00 80.15 102 B 1 ATOM 1983 O OH . TYR B 2 102 ? 10.546 -9.201 7.301 1.00 76.82 102 B 1 ATOM 1984 N N . ASP B 2 103 ? 7.769 -3.526 11.331 1.00 89.05 103 B 1 ATOM 1985 C CA . ASP B 2 103 ? 7.387 -4.083 12.626 1.00 90.37 103 B 1 ATOM 1986 C C . ASP B 2 103 ? 7.387 -5.616 12.584 1.00 92.79 103 B 1 ATOM 1987 O O . ASP B 2 103 ? 6.974 -6.231 11.602 1.00 91.42 103 B 1 ATOM 1988 C CB . ASP B 2 103 ? 5.997 -3.585 13.036 1.00 87.09 103 B 1 ATOM 1989 C CG . ASP B 2 103 ? 5.911 -2.066 13.167 1.00 83.36 103 B 1 ATOM 1990 O OD1 . ASP B 2 103 ? 6.854 -1.483 13.754 1.00 76.32 103 B 1 ATOM 1991 O OD2 . ASP B 2 103 ? 4.900 -1.518 12.674 1.00 77.25 103 B 1 ATOM 1992 N N . SER B 2 104 ? 7.815 -6.237 13.673 1.00 94.23 104 B 1 ATOM 1993 C CA . SER B 2 104 ? 7.787 -7.691 13.826 1.00 94.69 104 B 1 ATOM 1994 C C . SER B 2 104 ? 6.676 -8.134 14.774 1.00 95.70 104 B 1 ATOM 1995 O O . SER B 2 104 ? 6.256 -7.393 15.663 1.00 94.52 104 B 1 ATOM 1996 C CB . SER B 2 104 ? 9.158 -8.220 14.257 1.00 92.04 104 B 1 ATOM 1997 O OG . SER B 2 104 ? 9.505 -7.781 15.557 1.00 85.68 104 B 1 ATOM 1998 N N . LEU B 2 105 ? 6.216 -9.372 14.603 1.00 96.74 105 B 1 ATOM 1999 C CA . LEU B 2 105 ? 5.262 -10.016 15.498 1.00 96.92 105 B 1 ATOM 2000 C C . LEU B 2 105 ? 5.880 -11.254 16.150 1.00 97.03 105 B 1 ATOM 2001 O O . LEU B 2 105 ? 6.632 -12.003 15.527 1.00 96.31 105 B 1 ATOM 2002 C CB . LEU B 2 105 ? 3.968 -10.356 14.746 1.00 96.67 105 B 1 ATOM 2003 C CG . LEU B 2 105 ? 3.136 -9.144 14.284 1.00 95.39 105 B 1 ATOM 2004 C CD1 . LEU B 2 105 ? 1.895 -9.644 13.550 1.00 93.47 105 B 1 ATOM 2005 C CD2 . LEU B 2 105 ? 2.671 -8.272 15.453 1.00 93.67 105 B 1 ATOM 2006 N N . SER B 2 106 ? 5.521 -11.485 17.414 1.00 96.65 106 B 1 ATOM 2007 C CA . SER B 2 106 ? 5.845 -12.741 18.085 1.00 96.59 106 B 1 ATOM 2008 C C . SER B 2 106 ? 5.085 -13.906 17.449 1.00 97.07 106 B 1 ATOM 2009 O O . SER B 2 106 ? 4.010 -13.719 16.875 1.00 96.84 106 B 1 ATOM 2010 C CB . SER B 2 106 ? 5.535 -12.663 19.587 1.00 95.75 106 B 1 ATOM 2011 O OG . SER B 2 106 ? 4.151 -12.483 19.819 1.00 92.91 106 B 1 ATOM 2012 N N . ASP B 2 107 ? 5.612 -15.116 17.615 1.00 97.17 107 B 1 ATOM 2013 C CA . ASP B 2 107 ? 4.966 -16.337 17.123 1.00 97.30 107 B 1 ATOM 2014 C C . ASP B 2 107 ? 3.545 -16.483 17.687 1.00 97.58 107 B 1 ATOM 2015 O O . ASP B 2 107 ? 2.624 -16.846 16.963 1.00 97.15 107 B 1 ATOM 2016 C CB . ASP B 2 107 ? 5.817 -17.564 17.506 1.00 96.68 107 B 1 ATOM 2017 C CG . ASP B 2 107 ? 7.227 -17.560 16.914 1.00 95.93 107 B 1 ATOM 2018 O OD1 . ASP B 2 107 ? 7.533 -16.755 16.009 1.00 93.13 107 B 1 ATOM 2019 O OD2 . ASP B 2 107 ? 8.096 -18.332 17.379 1.00 92.85 107 B 1 ATOM 2020 N N . GLU B 2 108 ? 3.343 -16.115 18.946 1.00 96.93 108 B 1 ATOM 2021 C CA . GLU B 2 108 ? 2.038 -16.134 19.602 1.00 96.79 108 B 1 ATOM 2022 C C . GLU B 2 108 ? 1.028 -15.205 18.914 1.00 97.16 108 B 1 ATOM 2023 O O . GLU B 2 108 ? -0.089 -15.613 18.614 1.00 96.54 108 B 1 ATOM 2024 C CB . GLU B 2 108 ? 2.238 -15.725 21.065 1.00 96.03 108 B 1 ATOM 2025 C CG . GLU B 2 108 ? 0.955 -15.829 21.890 1.00 84.83 108 B 1 ATOM 2026 C CD . GLU B 2 108 ? 1.112 -15.252 23.306 1.00 77.40 108 B 1 ATOM 2027 O OE1 . GLU B 2 108 ? 0.114 -15.306 24.050 1.00 68.04 108 B 1 ATOM 2028 O OE2 . GLU B 2 108 ? 2.208 -14.722 23.618 1.00 69.67 108 B 1 ATOM 2029 N N . LYS B 2 109 ? 1.415 -13.968 18.596 1.00 97.57 109 B 1 ATOM 2030 C CA . LYS B 2 109 ? 0.528 -13.017 17.908 1.00 97.43 109 B 1 ATOM 2031 C C . LYS B 2 109 ? 0.143 -13.491 16.506 1.00 97.78 109 B 1 ATOM 2032 O O . LYS B 2 109 ? -0.981 -13.262 16.083 1.00 97.28 109 B 1 ATOM 2033 C CB . LYS B 2 109 ? 1.184 -11.638 17.822 1.00 97.02 109 B 1 ATOM 2034 C CG . LYS B 2 109 ? 1.168 -10.892 19.160 1.00 94.69 109 B 1 ATOM 2035 C CD . LYS B 2 109 ? 1.797 -9.510 18.970 1.00 89.62 109 B 1 ATOM 2036 C CE . LYS B 2 109 ? 1.724 -8.687 20.252 1.00 84.83 109 B 1 ATOM 2037 N NZ . LYS B 2 109 ? 2.206 -7.304 20.018 1.00 74.94 109 B 1 ATOM 2038 N N . ILE B 2 110 ? 1.060 -14.145 15.799 1.00 98.00 110 B 1 ATOM 2039 C CA . ILE B 2 110 ? 0.788 -14.734 14.486 1.00 98.12 110 B 1 ATOM 2040 C C . ILE B 2 110 ? -0.172 -15.921 14.645 1.00 98.23 110 B 1 ATOM 2041 O O . ILE B 2 110 ? -1.194 -15.968 13.969 1.00 97.96 110 B 1 ATOM 2042 C CB . ILE B 2 110 ? 2.106 -15.115 13.775 1.00 97.93 110 B 1 ATOM 2043 C CG1 . ILE B 2 110 ? 2.965 -13.853 13.506 1.00 97.05 110 B 1 ATOM 2044 C CG2 . ILE B 2 110 ? 1.821 -15.848 12.447 1.00 97.30 110 B 1 ATOM 2045 C CD1 . ILE B 2 110 ? 4.418 -14.160 13.122 1.00 94.32 110 B 1 ATOM 2046 N N . GLN B 2 111 ? 0.109 -16.828 15.574 1.00 97.95 111 B 1 ATOM 2047 C CA . GLN B 2 111 ? -0.713 -18.016 15.836 1.00 97.82 111 B 1 ATOM 2048 C C . GLN B 2 111 ? -2.140 -17.669 16.280 1.00 98.06 111 B 1 ATOM 2049 O O . GLN B 2 111 ? -3.077 -18.389 15.936 1.00 97.59 111 B 1 ATOM 2050 C CB . GLN B 2 111 ? -0.011 -18.872 16.900 1.00 96.83 111 B 1 ATOM 2051 C CG . GLN B 2 111 ? -0.754 -20.168 17.282 1.00 92.13 111 B 1 ATOM 2052 C CD . GLN B 2 111 ? -0.833 -21.145 16.109 1.00 87.02 111 B 1 ATOM 2053 O OE1 . GLN B 2 111 ? 0.076 -21.918 15.868 1.00 77.95 111 B 1 ATOM 2054 N NE2 . GLN B 2 111 ? -1.898 -21.142 15.354 1.00 73.48 111 B 1 ATOM 2055 N N . ASN B 2 112 ? -2.318 -16.564 17.008 1.00 97.71 112 B 1 ATOM 2056 C CA . ASN B 2 112 ? -3.613 -16.121 17.529 1.00 97.58 112 B 1 ATOM 2057 C C . ASN B 2 112 ? -4.559 -15.555 16.457 1.00 97.81 112 B 1 ATOM 2058 O O . ASN B 2 112 ? -5.721 -15.288 16.761 1.00 96.82 112 B 1 ATOM 2059 C CB . ASN B 2 112 ? -3.375 -15.107 18.664 1.00 96.66 112 B 1 ATOM 2060 C CG . ASN B 2 112 ? -2.857 -15.747 19.944 1.00 91.00 112 B 1 ATOM 2061 O OD1 . ASN B 2 112 ? -2.849 -16.947 20.121 1.00 82.08 112 B 1 ATOM 2062 N ND2 . ASN B 2 112 ? -2.422 -14.943 20.892 1.00 80.23 112 B 1 ATOM 2063 N N . MET B 2 113 ? -4.112 -15.373 15.207 1.00 98.03 113 B 1 ATOM 2064 C CA . MET B 2 113 ? -5.029 -15.027 14.120 1.00 98.13 113 B 1 ATOM 2065 C C . MET B 2 113 ? -6.016 -16.180 13.878 1.00 98.30 113 B 1 ATOM 2066 O O . MET B 2 113 ? -5.599 -17.339 13.813 1.00 97.89 113 B 1 ATOM 2067 C CB . MET B 2 113 ? -4.278 -14.706 12.828 1.00 97.78 113 B 1 ATOM 2068 C CG . MET B 2 113 ? -3.418 -13.440 12.941 1.00 96.71 113 B 1 ATOM 2069 S SD . MET B 2 113 ? -2.654 -12.946 11.365 1.00 96.23 113 B 1 ATOM 2070 C CE . MET B 2 113 ? -1.585 -14.363 11.042 1.00 90.29 113 B 1 ATOM 2071 N N . PRO B 2 114 ? -7.319 -15.897 13.686 1.00 98.19 114 B 1 ATOM 2072 C CA . PRO B 2 114 ? -8.346 -16.932 13.559 1.00 97.99 114 B 1 ATOM 2073 C C . PRO B 2 114 ? -8.406 -17.522 12.143 1.00 98.15 114 B 1 ATOM 2074 O O . PRO B 2 114 ? -9.469 -17.565 11.521 1.00 97.32 114 B 1 ATOM 2075 C CB . PRO B 2 114 ? -9.632 -16.232 14.004 1.00 97.32 114 B 1 ATOM 2076 C CG . PRO B 2 114 ? -9.428 -14.811 13.496 1.00 96.55 114 B 1 ATOM 2077 C CD . PRO B 2 114 ? -7.933 -14.581 13.729 1.00 97.70 114 B 1 ATOM 2078 N N . ILE B 2 115 ? -7.274 -18.005 11.616 1.00 98.41 115 B 1 ATOM 2079 C CA . ILE B 2 115 ? -7.130 -18.513 10.243 1.00 98.47 115 B 1 ATOM 2080 C C . ILE B 2 115 ? -8.117 -19.648 9.958 1.00 98.37 115 B 1 ATOM 2081 O O . ILE B 2 115 ? -8.693 -19.723 8.871 1.00 97.69 115 B 1 ATOM 2082 C CB . ILE B 2 115 ? -5.676 -18.959 9.984 1.00 98.31 115 B 1 ATOM 2083 C CG1 . ILE B 2 115 ? -4.637 -17.846 10.247 1.00 97.04 115 B 1 ATOM 2084 C CG2 . ILE B 2 115 ? -5.509 -19.510 8.560 1.00 97.48 115 B 1 ATOM 2085 C CD1 . ILE B 2 115 ? -4.853 -16.557 9.452 1.00 93.72 115 B 1 ATOM 2086 N N . GLN B 2 116 ? -8.401 -20.480 10.953 1.00 97.91 116 B 1 ATOM 2087 C CA . GLN B 2 116 ? -9.373 -21.572 10.863 1.00 97.34 116 B 1 ATOM 2088 C C . GLN B 2 116 ? -10.795 -21.112 10.500 1.00 97.40 116 B 1 ATOM 2089 O O . GLN B 2 116 ? -11.570 -21.911 9.980 1.00 95.76 116 B 1 ATOM 2090 C CB . GLN B 2 116 ? -9.375 -22.383 12.171 1.00 95.72 116 B 1 ATOM 2091 C CG . GLN B 2 116 ? -9.866 -21.659 13.450 1.00 88.65 116 B 1 ATOM 2092 C CD . GLN B 2 116 ? -8.814 -20.762 14.114 1.00 86.99 116 B 1 ATOM 2093 O OE1 . GLN B 2 116 ? -7.710 -20.578 13.631 1.00 77.20 116 B 1 ATOM 2094 N NE2 . GLN B 2 116 ? -9.128 -20.185 15.251 1.00 74.13 116 B 1 ATOM 2095 N N . SER B 2 117 ? -11.131 -19.847 10.740 1.00 97.82 117 B 1 ATOM 2096 C CA . SER B 2 117 ? -12.437 -19.265 10.411 1.00 97.49 117 B 1 ATOM 2097 C C . SER B 2 117 ? -12.474 -18.603 9.030 1.00 97.64 117 B 1 ATOM 2098 O O . SER B 2 117 ? -13.554 -18.320 8.521 1.00 96.32 117 B 1 ATOM 2099 C CB . SER B 2 117 ? -12.844 -18.247 11.483 1.00 96.50 117 B 1 ATOM 2100 O OG . SER B 2 117 ? -12.805 -18.838 12.773 1.00 89.58 117 B 1 ATOM 2101 N N . LEU B 2 118 ? -11.312 -18.369 8.408 1.00 98.25 118 B 1 ATOM 2102 C CA . LEU B 2 118 ? -11.196 -17.678 7.116 1.00 98.25 118 B 1 ATOM 2103 C C . LEU B 2 118 ? -11.293 -18.626 5.914 1.00 98.18 118 B 1 ATOM 2104 O O . LEU B 2 118 ? -11.470 -18.177 4.777 1.00 97.16 118 B 1 ATOM 2105 C CB . LEU B 2 118 ? -9.871 -16.896 7.077 1.00 98.06 118 B 1 ATOM 2106 C CG . LEU B 2 118 ? -9.726 -15.812 8.162 1.00 97.25 118 B 1 ATOM 2107 C CD1 . LEU B 2 118 ? -8.341 -15.172 8.070 1.00 95.37 118 B 1 ATOM 2108 C CD2 . LEU B 2 118 ? -10.765 -14.704 8.015 1.00 94.89 118 B 1 ATOM 2109 N N . GLN B 2 119 ? -11.176 -19.936 6.148 1.00 98.12 119 B 1 ATOM 2110 C CA . GLN B 2 119 ? -11.170 -20.942 5.092 1.00 98.03 119 B 1 ATOM 2111 C C . GLN B 2 119 ? -11.867 -22.221 5.549 1.00 97.86 119 B 1 ATOM 2112 O O . GLN B 2 119 ? -11.639 -22.707 6.664 1.00 96.77 119 B 1 ATOM 2113 C CB . GLN B 2 119 ? -9.713 -21.183 4.670 1.00 97.38 119 B 1 ATOM 2114 C CG . GLN B 2 119 ? -9.588 -22.073 3.436 1.00 96.80 119 B 1 ATOM 2115 C CD . GLN B 2 119 ? -8.143 -22.097 2.950 1.00 97.58 119 B 1 ATOM 2116 O OE1 . GLN B 2 119 ? -7.290 -22.766 3.514 1.00 93.81 119 B 1 ATOM 2117 N NE2 . GLN B 2 119 ? -7.822 -21.343 1.923 1.00 93.26 119 B 1 ATOM 2118 N N . GLN B 2 120 ? -12.716 -22.772 4.674 1.00 97.43 120 B 1 ATOM 2119 C CA . GLN B 2 120 ? -13.362 -24.071 4.866 1.00 96.87 120 B 1 ATOM 2120 C C . GLN B 2 120 ? -12.600 -25.169 4.125 1.00 97.13 120 B 1 ATOM 2121 O O . GLN B 2 120 ? -12.136 -26.125 4.747 1.00 95.11 120 B 1 ATOM 2122 C CB . GLN B 2 120 ? -14.829 -23.966 4.417 1.00 95.14 120 B 1 ATOM 2123 C CG . GLN B 2 120 ? -15.621 -25.265 4.669 1.00 84.76 120 B 1 ATOM 2124 C CD . GLN B 2 120 ? -15.738 -25.620 6.156 1.00 78.65 120 B 1 ATOM 2125 O OE1 . GLN B 2 120 ? -15.672 -24.775 7.046 1.00 70.63 120 B 1 ATOM 2126 N NE2 . GLN B 2 120 ? -15.913 -26.880 6.468 1.00 66.32 120 B 1 ATOM 2127 N N . ASP B 2 121 ? -12.425 -24.994 2.817 1.00 97.58 121 B 1 ATOM 2128 C CA . ASP B 2 121 ? -11.754 -25.908 1.896 1.00 97.42 121 B 1 ATOM 2129 C C . ASP B 2 121 ? -10.723 -25.118 1.089 1.00 97.56 121 B 1 ATOM 2130 O O . ASP B 2 121 ? -11.064 -24.105 0.473 1.00 96.09 121 B 1 ATOM 2131 C CB . ASP B 2 121 ? -12.776 -26.536 0.941 1.00 96.68 121 B 1 ATOM 2132 C CG . ASP B 2 121 ? -13.935 -27.200 1.684 1.00 96.09 121 B 1 ATOM 2133 O OD1 . ASP B 2 121 ? -13.708 -28.279 2.274 1.00 92.32 121 B 1 ATOM 2134 O OD2 . ASP B 2 121 ? -15.041 -26.615 1.685 1.00 92.21 121 B 1 ATOM 2135 N N . GLY B 2 122 ? -9.471 -25.568 1.093 1.00 97.84 122 B 1 ATOM 2136 C CA . GLY B 2 122 ? -8.428 -24.878 0.345 1.00 98.02 122 B 1 ATOM 2137 C C . GLY B 2 122 ? -7.029 -25.046 0.903 1.00 98.37 122 B 1 ATOM 2138 O O . GLY B 2 122 ? -6.743 -25.969 1.669 1.00 97.88 122 B 1 ATOM 2139 N N . PHE B 2 123 ? -6.155 -24.158 0.491 1.00 98.50 123 B 1 ATOM 2140 C CA . PHE B 2 123 ? -4.738 -24.202 0.813 1.00 98.56 123 B 1 ATOM 2141 C C . PHE B 2 123 ? -4.291 -22.969 1.594 1.00 98.67 123 B 1 ATOM 2142 O O . PHE B 2 123 ? -4.781 -21.858 1.389 1.00 98.47 123 B 1 ATOM 2143 C CB . PHE B 2 123 ? -3.911 -24.378 -0.464 1.00 98.38 123 B 1 ATOM 2144 C CG . PHE B 2 123 ? -4.189 -25.666 -1.212 1.00 98.29 123 B 1 ATOM 2145 C CD1 . PHE B 2 123 ? -3.419 -26.819 -0.955 1.00 97.20 123 B 1 ATOM 2146 C CD2 . PHE B 2 123 ? -5.222 -25.722 -2.164 1.00 97.17 123 B 1 ATOM 2147 C CE1 . PHE B 2 123 ? -3.670 -28.013 -1.653 1.00 96.69 123 B 1 ATOM 2148 C CE2 . PHE B 2 123 ? -5.480 -26.917 -2.864 1.00 96.72 123 B 1 ATOM 2149 C CZ . PHE B 2 123 ? -4.702 -28.060 -2.611 1.00 97.02 123 B 1 ATOM 2150 N N . ILE B 2 124 ? -3.304 -23.168 2.448 1.00 98.66 124 B 1 ATOM 2151 C CA . ILE B 2 124 ? -2.555 -22.094 3.090 1.00 98.73 124 B 1 ATOM 2152 C C . ILE B 2 124 ? -1.098 -22.144 2.646 1.00 98.76 124 B 1 ATOM 2153 O O . ILE B 2 124 ? -0.493 -23.210 2.598 1.00 98.52 124 B 1 ATOM 2154 C CB . ILE B 2 124 ? -2.731 -22.118 4.617 1.00 98.52 124 B 1 ATOM 2155 C CG1 . ILE B 2 124 ? -2.187 -20.814 5.232 1.00 97.78 124 B 1 ATOM 2156 C CG2 . ILE B 2 124 ? -2.084 -23.365 5.261 1.00 97.31 124 B 1 ATOM 2157 C CD1 . ILE B 2 124 ? -2.540 -20.648 6.714 1.00 95.60 124 B 1 ATOM 2158 N N . PHE B 2 125 ? -0.540 -20.995 2.332 1.00 98.79 125 B 1 ATOM 2159 C CA . PHE B 2 125 ? 0.852 -20.797 1.950 1.00 98.80 125 B 1 ATOM 2160 C C . PHE B 2 125 ? 1.515 -19.908 3.002 1.00 98.82 125 B 1 ATOM 2161 O O . PHE B 2 125 ? 1.123 -18.755 3.176 1.00 98.58 125 B 1 ATOM 2162 C CB . PHE B 2 125 ? 0.914 -20.154 0.559 1.00 98.68 125 B 1 ATOM 2163 C CG . PHE B 2 125 ? 0.556 -21.062 -0.603 1.00 98.62 125 B 1 ATOM 2164 C CD1 . PHE B 2 125 ? 1.539 -21.412 -1.550 1.00 97.49 125 B 1 ATOM 2165 C CD2 . PHE B 2 125 ? -0.754 -21.549 -0.768 1.00 97.64 125 B 1 ATOM 2166 C CE1 . PHE B 2 125 ? 1.221 -22.244 -2.639 1.00 97.09 125 B 1 ATOM 2167 C CE2 . PHE B 2 125 ? -1.076 -22.392 -1.848 1.00 97.11 125 B 1 ATOM 2168 C CZ . PHE B 2 125 ? -0.087 -22.740 -2.784 1.00 97.64 125 B 1 ATOM 2169 N N . VAL B 2 126 ? 2.522 -20.412 3.693 1.00 98.77 126 B 1 ATOM 2170 C CA . VAL B 2 126 ? 3.232 -19.652 4.729 1.00 98.77 126 B 1 ATOM 2171 C C . VAL B 2 126 ? 4.718 -19.604 4.420 1.00 98.76 126 B 1 ATOM 2172 O O . VAL B 2 126 ? 5.417 -20.617 4.473 1.00 98.48 126 B 1 ATOM 2173 C CB . VAL B 2 126 ? 2.970 -20.188 6.148 1.00 98.61 126 B 1 ATOM 2174 C CG1 . VAL B 2 126 ? 3.541 -19.217 7.192 1.00 97.86 126 B 1 ATOM 2175 C CG2 . VAL B 2 126 ? 1.473 -20.363 6.434 1.00 97.88 126 B 1 ATOM 2176 N N . TRP B 2 127 ? 5.221 -18.412 4.131 1.00 98.67 127 B 1 ATOM 2177 C CA . TRP B 2 127 ? 6.652 -18.180 3.971 1.00 98.61 127 B 1 ATOM 2178 C C . TRP B 2 127 ? 7.361 -18.273 5.322 1.00 98.37 127 B 1 ATOM 2179 O O . TRP B 2 127 ? 7.073 -17.517 6.254 1.00 97.75 127 B 1 ATOM 2180 C CB . TRP B 2 127 ? 6.890 -16.833 3.299 1.00 98.60 127 B 1 ATOM 2181 C CG . TRP B 2 127 ? 6.475 -16.788 1.858 1.00 98.61 127 B 1 ATOM 2182 C CD1 . TRP B 2 127 ? 5.289 -16.339 1.392 1.00 98.18 127 B 1 ATOM 2183 C CD2 . TRP B 2 127 ? 7.232 -17.241 0.689 1.00 98.47 127 B 1 ATOM 2184 N NE1 . TRP B 2 127 ? 5.256 -16.474 0.006 1.00 98.00 127 B 1 ATOM 2185 C CE2 . TRP B 2 127 ? 6.427 -17.025 -0.463 1.00 98.25 127 B 1 ATOM 2186 C CE3 . TRP B 2 127 ? 8.511 -17.810 0.507 1.00 98.28 127 B 1 ATOM 2187 C CZ2 . TRP B 2 127 ? 6.871 -17.365 -1.761 1.00 97.91 127 B 1 ATOM 2188 C CZ3 . TRP B 2 127 ? 8.957 -18.147 -0.792 1.00 97.57 127 B 1 ATOM 2189 C CH2 . TRP B 2 127 ? 8.143 -17.930 -1.910 1.00 97.46 127 B 1 ATOM 2190 N N . ALA B 2 128 ? 8.328 -19.169 5.417 1.00 97.75 128 B 1 ATOM 2191 C CA . ALA B 2 128 ? 9.074 -19.415 6.640 1.00 97.12 128 B 1 ATOM 2192 C C . ALA B 2 128 ? 10.575 -19.200 6.432 1.00 96.26 128 B 1 ATOM 2193 O O . ALA B 2 128 ? 11.210 -19.802 5.570 1.00 93.86 128 B 1 ATOM 2194 C CB . ALA B 2 128 ? 8.757 -20.825 7.138 1.00 96.30 128 B 1 ATOM 2195 N N . ILE B 2 129 ? 11.161 -18.378 7.286 1.00 95.65 129 B 1 ATOM 2196 C CA . ILE B 2 129 ? 12.622 -18.345 7.410 1.00 94.30 129 B 1 ATOM 2197 C C . ILE B 2 129 ? 13.113 -19.621 8.103 1.00 94.70 129 B 1 ATOM 2198 O O . ILE B 2 129 ? 12.394 -20.240 8.888 1.00 93.83 129 B 1 ATOM 2199 C CB . ILE B 2 129 ? 13.112 -17.071 8.131 1.00 92.28 129 B 1 ATOM 2200 C CG1 . ILE B 2 129 ? 12.566 -16.977 9.574 1.00 87.06 129 B 1 ATOM 2201 C CG2 . ILE B 2 129 ? 12.743 -15.832 7.296 1.00 85.60 129 B 1 ATOM 2202 C CD1 . ILE B 2 129 ? 13.194 -15.837 10.394 1.00 82.57 129 B 1 ATOM 2203 N N . ASN B 2 130 ? 14.371 -19.977 7.885 1.00 92.60 130 B 1 ATOM 2204 C CA . ASN B 2 130 ? 14.954 -21.226 8.393 1.00 92.26 130 B 1 ATOM 2205 C C . ASN B 2 130 ? 14.777 -21.414 9.919 1.00 93.37 130 B 1 ATOM 2206 O O . ASN B 2 130 ? 14.417 -22.490 10.387 1.00 92.72 130 B 1 ATOM 2207 C CB . ASN B 2 130 ? 16.442 -21.242 7.978 1.00 90.60 130 B 1 ATOM 2208 C CG . ASN B 2 130 ? 16.922 -22.604 7.510 1.00 85.99 130 B 1 ATOM 2209 O OD1 . ASN B 2 130 ? 16.183 -23.535 7.335 1.00 78.06 130 B 1 ATOM 2210 N ND2 . ASN B 2 130 ? 18.203 -22.748 7.250 1.00 76.78 130 B 1 ATOM 2211 N N . ALA B 2 131 ? 14.953 -20.342 10.693 1.00 92.36 131 B 1 ATOM 2212 C CA . ALA B 2 131 ? 14.767 -20.354 12.151 1.00 92.50 131 B 1 ATOM 2213 C C . ALA B 2 131 ? 13.305 -20.574 12.593 1.00 94.05 131 B 1 ATOM 2214 O O . ALA B 2 131 ? 13.056 -20.946 13.738 1.00 93.44 131 B 1 ATOM 2215 C CB . ALA B 2 131 ? 15.312 -19.033 12.704 1.00 90.92 131 B 1 ATOM 2216 N N . LYS B 2 132 ? 12.331 -20.341 11.702 1.00 95.04 132 B 1 ATOM 2217 C CA . LYS B 2 132 ? 10.893 -20.446 11.968 1.00 96.15 132 B 1 ATOM 2218 C C . LYS B 2 132 ? 10.236 -21.636 11.271 1.00 97.02 132 B 1 ATOM 2219 O O . LYS B 2 132 ? 9.046 -21.842 11.440 1.00 96.62 132 B 1 ATOM 2220 C CB . LYS B 2 132 ? 10.206 -19.114 11.625 1.00 95.87 132 B 1 ATOM 2221 C CG . LYS B 2 132 ? 10.674 -17.926 12.491 1.00 94.74 132 B 1 ATOM 2222 C CD . LYS B 2 132 ? 10.303 -18.098 13.968 1.00 92.69 132 B 1 ATOM 2223 C CE . LYS B 2 132 ? 10.660 -16.848 14.768 1.00 90.81 132 B 1 ATOM 2224 N NZ . LYS B 2 132 ? 10.211 -16.958 16.168 1.00 87.43 132 B 1 ATOM 2225 N N . TYR B 2 133 ? 11.000 -22.470 10.572 1.00 96.11 133 B 1 ATOM 2226 C CA . TYR B 2 133 ? 10.476 -23.604 9.809 1.00 96.67 133 B 1 ATOM 2227 C C . TYR B 2 133 ? 9.598 -24.540 10.666 1.00 97.18 133 B 1 ATOM 2228 O O . TYR B 2 133 ? 8.430 -24.775 10.359 1.00 96.90 133 B 1 ATOM 2229 C CB . TYR B 2 133 ? 11.662 -24.349 9.189 1.00 96.44 133 B 1 ATOM 2230 C CG . TYR B 2 133 ? 11.260 -25.352 8.139 1.00 96.40 133 B 1 ATOM 2231 C CD1 . TYR B 2 133 ? 10.829 -26.644 8.509 1.00 94.00 133 B 1 ATOM 2232 C CD2 . TYR B 2 133 ? 11.316 -24.992 6.779 1.00 94.25 133 B 1 ATOM 2233 C CE1 . TYR B 2 133 ? 10.453 -27.575 7.525 1.00 93.42 133 B 1 ATOM 2234 C CE2 . TYR B 2 133 ? 10.950 -25.917 5.790 1.00 93.30 133 B 1 ATOM 2235 C CZ . TYR B 2 133 ? 10.518 -27.207 6.170 1.00 94.00 133 B 1 ATOM 2236 O OH . TYR B 2 133 ? 10.165 -28.115 5.210 1.00 92.57 133 B 1 ATOM 2237 N N . ARG B 2 134 ? 10.119 -25.009 11.803 1.00 96.61 134 B 1 ATOM 2238 C CA . ARG B 2 134 ? 9.384 -25.928 12.692 1.00 96.65 134 B 1 ATOM 2239 C C . ARG B 2 134 ? 8.165 -25.285 13.354 1.00 97.30 134 B 1 ATOM 2240 O O . ARG B 2 134 ? 7.164 -25.964 13.541 1.00 96.71 134 B 1 ATOM 2241 C CB . ARG B 2 134 ? 10.310 -26.484 13.782 1.00 95.90 134 B 1 ATOM 2242 C CG . ARG B 2 134 ? 11.353 -27.463 13.234 1.00 87.09 134 B 1 ATOM 2243 C CD . ARG B 2 134 ? 12.143 -28.059 14.396 1.00 83.64 134 B 1 ATOM 2244 N NE . ARG B 2 134 ? 13.161 -29.021 13.939 1.00 72.48 134 B 1 ATOM 2245 C CZ . ARG B 2 134 ? 13.969 -29.730 14.708 1.00 63.83 134 B 1 ATOM 2246 N NH1 . ARG B 2 134 ? 13.939 -29.636 16.009 1.00 56.70 134 B 1 ATOM 2247 N NH2 . ARG B 2 134 ? 14.823 -30.552 14.176 1.00 56.43 134 B 1 ATOM 2248 N N . VAL B 2 135 ? 8.252 -24.015 13.748 1.00 97.17 135 B 1 ATOM 2249 C CA . VAL B 2 135 ? 7.104 -23.336 14.362 1.00 97.16 135 B 1 ATOM 2250 C C . VAL B 2 135 ? 6.017 -23.077 13.324 1.00 97.83 135 B 1 ATOM 2251 O O . VAL B 2 135 ? 4.848 -23.214 13.645 1.00 97.38 135 B 1 ATOM 2252 C CB . VAL B 2 135 ? 7.514 -22.076 15.154 1.00 95.44 135 B 1 ATOM 2253 C CG1 . VAL B 2 135 ? 7.906 -20.880 14.294 1.00 87.13 135 B 1 ATOM 2254 C CG2 . VAL B 2 135 ? 6.400 -21.652 16.102 1.00 86.54 135 B 1 ATOM 2255 N N . THR B 2 136 ? 6.380 -22.826 12.076 1.00 97.89 136 B 1 ATOM 2256 C CA . THR B 2 136 ? 5.433 -22.656 10.971 1.00 98.08 136 B 1 ATOM 2257 C C . THR B 2 136 ? 4.635 -23.929 10.714 1.00 98.28 136 B 1 ATOM 2258 O O . THR B 2 136 ? 3.419 -23.851 10.580 1.00 98.03 136 B 1 ATOM 2259 C CB . THR B 2 136 ? 6.150 -22.216 9.694 1.00 97.81 136 B 1 ATOM 2260 O OG1 . THR B 2 136 ? 6.843 -21.012 9.935 1.00 94.73 136 B 1 ATOM 2261 C CG2 . THR B 2 136 ? 5.175 -21.942 8.553 1.00 95.18 136 B 1 ATOM 2262 N N . ILE B 2 137 ? 5.264 -25.103 10.722 1.00 98.23 137 B 1 ATOM 2263 C CA . ILE B 2 137 ? 4.550 -26.387 10.616 1.00 98.20 137 B 1 ATOM 2264 C C . ILE B 2 137 ? 3.506 -26.498 11.731 1.00 98.30 137 B 1 ATOM 2265 O O . ILE B 2 137 ? 2.331 -26.723 11.451 1.00 97.86 137 B 1 ATOM 2266 C CB . ILE B 2 137 ? 5.528 -27.584 10.637 1.00 97.79 137 B 1 ATOM 2267 C CG1 . ILE B 2 137 ? 6.475 -27.530 9.417 1.00 96.27 137 B 1 ATOM 2268 C CG2 . ILE B 2 137 ? 4.747 -28.913 10.653 1.00 96.45 137 B 1 ATOM 2269 C CD1 . ILE B 2 137 ? 7.591 -28.583 9.435 1.00 92.89 137 B 1 ATOM 2270 N N . LYS B 2 138 ? 3.893 -26.246 12.982 1.00 98.32 138 B 1 ATOM 2271 C CA . LYS B 2 138 ? 2.966 -26.284 14.119 1.00 98.23 138 B 1 ATOM 2272 C C . LYS B 2 138 ? 1.833 -25.267 13.991 1.00 98.36 138 B 1 ATOM 2273 O O . LYS B 2 138 ? 0.705 -25.581 14.349 1.00 97.75 138 B 1 ATOM 2274 C CB . LYS B 2 138 ? 3.708 -26.046 15.435 1.00 97.74 138 B 1 ATOM 2275 C CG . LYS B 2 138 ? 4.598 -27.236 15.817 1.00 84.74 138 B 1 ATOM 2276 C CD . LYS B 2 138 ? 5.207 -26.976 17.195 1.00 77.76 138 B 1 ATOM 2277 C CE . LYS B 2 138 ? 5.993 -28.201 17.650 1.00 66.29 138 B 1 ATOM 2278 N NZ . LYS B 2 138 ? 6.403 -28.076 19.072 1.00 56.81 138 B 1 ATOM 2279 N N . MET B 2 139 ? 2.094 -24.064 13.499 1.00 98.25 139 B 1 ATOM 2280 C CA . MET B 2 139 ? 1.054 -23.054 13.261 1.00 98.16 139 B 1 ATOM 2281 C C . MET B 2 139 ? 0.036 -23.535 12.229 1.00 98.40 139 B 1 ATOM 2282 O O . MET B 2 139 ? -1.164 -23.449 12.471 1.00 98.03 139 B 1 ATOM 2283 C CB . MET B 2 139 ? 1.673 -21.739 12.780 1.00 97.42 139 B 1 ATOM 2284 C CG . MET B 2 139 ? 2.372 -20.966 13.895 1.00 92.97 139 B 1 ATOM 2285 S SD . MET B 2 139 ? 3.147 -19.442 13.293 1.00 92.50 139 B 1 ATOM 2286 C CE . MET B 2 139 ? 3.715 -18.765 14.860 1.00 84.29 139 B 1 ATOM 2287 N N . ILE B 2 140 ? 0.508 -24.079 11.108 1.00 98.40 140 B 1 ATOM 2288 C CA . ILE B 2 140 ? -0.334 -24.636 10.042 1.00 98.33 140 B 1 ATOM 2289 C C . ILE B 2 140 ? -1.216 -25.769 10.588 1.00 98.37 140 B 1 ATOM 2290 O O . ILE B 2 140 ? -2.426 -25.774 10.364 1.00 97.77 140 B 1 ATOM 2291 C CB . ILE B 2 140 ? 0.569 -25.087 8.867 1.00 97.60 140 B 1 ATOM 2292 C CG1 . ILE B 2 140 ? 1.107 -23.847 8.114 1.00 93.87 140 B 1 ATOM 2293 C CG2 . ILE B 2 140 ? -0.170 -26.021 7.895 1.00 93.80 140 B 1 ATOM 2294 C CD1 . ILE B 2 140 ? 2.181 -24.178 7.066 1.00 92.09 140 B 1 ATOM 2295 N N . GLU B 2 141 ? -0.638 -26.691 11.349 1.00 98.42 141 B 1 ATOM 2296 C CA . GLU B 2 141 ? -1.367 -27.796 11.980 1.00 98.33 141 B 1 ATOM 2297 C C . GLU B 2 141 ? -2.391 -27.296 13.015 1.00 98.29 141 B 1 ATOM 2298 O O . GLU B 2 141 ? -3.543 -27.731 13.006 1.00 97.63 141 B 1 ATOM 2299 C CB . GLU B 2 141 ? -0.363 -28.761 12.635 1.00 98.06 141 B 1 ATOM 2300 C CG . GLU B 2 141 ? 0.460 -29.549 11.604 1.00 96.33 141 B 1 ATOM 2301 C CD . GLU B 2 141 ? 1.600 -30.379 12.224 1.00 95.15 141 B 1 ATOM 2302 O OE1 . GLU B 2 141 ? 2.096 -31.291 11.525 1.00 89.03 141 B 1 ATOM 2303 O OE2 . GLU B 2 141 ? 2.009 -30.101 13.379 1.00 91.18 141 B 1 ATOM 2304 N N . ASN B 2 142 ? -2.025 -26.330 13.853 1.00 98.27 142 B 1 ATOM 2305 C CA . ASN B 2 142 ? -2.916 -25.736 14.852 1.00 98.08 142 B 1 ATOM 2306 C C . ASN B 2 142 ? -4.108 -24.998 14.224 1.00 98.11 142 B 1 ATOM 2307 O O . ASN B 2 142 ? -5.185 -24.956 14.817 1.00 97.10 142 B 1 ATOM 2308 C CB . ASN B 2 142 ? -2.120 -24.758 15.726 1.00 97.65 142 B 1 ATOM 2309 C CG . ASN B 2 142 ? -1.199 -25.424 16.730 1.00 94.99 142 B 1 ATOM 2310 O OD1 . ASN B 2 142 ? -1.268 -26.597 17.041 1.00 86.48 142 B 1 ATOM 2311 N ND2 . ASN B 2 142 ? -0.311 -24.652 17.320 1.00 86.02 142 B 1 ATOM 2312 N N . TRP B 2 143 ? -3.959 -24.435 13.024 1.00 98.22 143 B 1 ATOM 2313 C CA . TRP B 2 143 ? -5.069 -23.855 12.261 1.00 98.24 143 B 1 ATOM 2314 C C . TRP B 2 143 ? -5.943 -24.905 11.550 1.00 98.18 143 B 1 ATOM 2315 O O . TRP B 2 143 ? -6.949 -24.549 10.933 1.00 97.46 143 B 1 ATOM 2316 C CB . TRP B 2 143 ? -4.526 -22.800 11.295 1.00 98.19 143 B 1 ATOM 2317 C CG . TRP B 2 143 ? -3.975 -21.557 11.927 1.00 98.23 143 B 1 ATOM 2318 C CD1 . TRP B 2 143 ? -4.488 -20.902 12.998 1.00 97.65 143 B 1 ATOM 2319 C CD2 . TRP B 2 143 ? -2.818 -20.773 11.497 1.00 98.12 143 B 1 ATOM 2320 N NE1 . TRP B 2 143 ? -3.725 -19.766 13.262 1.00 97.51 143 B 1 ATOM 2321 C CE2 . TRP B 2 143 ? -2.697 -19.649 12.359 1.00 97.90 143 B 1 ATOM 2322 C CE3 . TRP B 2 143 ? -1.878 -20.909 10.453 1.00 97.94 143 B 1 ATOM 2323 C CZ2 . TRP B 2 143 ? -1.675 -18.688 12.193 1.00 97.40 143 B 1 ATOM 2324 C CZ3 . TRP B 2 143 ? -0.858 -19.950 10.292 1.00 97.18 143 B 1 ATOM 2325 C CH2 . TRP B 2 143 ? -0.761 -18.855 11.154 1.00 96.97 143 B 1 ATOM 2326 N N . GLY B 2 144 ? -5.605 -26.188 11.657 1.00 97.98 144 B 1 ATOM 2327 C CA . GLY B 2 144 ? -6.393 -27.301 11.122 1.00 97.68 144 B 1 ATOM 2328 C C . GLY B 2 144 ? -5.982 -27.758 9.725 1.00 97.99 144 B 1 ATOM 2329 O O . GLY B 2 144 ? -6.761 -28.447 9.063 1.00 96.78 144 B 1 ATOM 2330 N N . TYR B 2 145 ? -4.798 -27.400 9.268 1.00 98.30 145 B 1 ATOM 2331 C CA . TYR B 2 145 ? -4.258 -27.835 7.984 1.00 98.47 145 B 1 ATOM 2332 C C . TYR B 2 145 ? -3.359 -29.059 8.150 1.00 98.46 145 B 1 ATOM 2333 O O . TYR B 2 145 ? -2.653 -29.217 9.142 1.00 97.85 145 B 1 ATOM 2334 C CB . TYR B 2 145 ? -3.484 -26.708 7.294 1.00 98.41 145 B 1 ATOM 2335 C CG . TYR B 2 145 ? -4.315 -25.486 6.984 1.00 98.58 145 B 1 ATOM 2336 C CD1 . TYR B 2 145 ? -4.902 -25.321 5.716 1.00 97.96 145 B 1 ATOM 2337 C CD2 . TYR B 2 145 ? -4.519 -24.508 7.973 1.00 98.04 145 B 1 ATOM 2338 C CE1 . TYR B 2 145 ? -5.696 -24.199 5.439 1.00 97.86 145 B 1 ATOM 2339 C CE2 . TYR B 2 145 ? -5.317 -23.382 7.710 1.00 97.92 145 B 1 ATOM 2340 C CZ . TYR B 2 145 ? -5.909 -23.233 6.444 1.00 98.20 145 B 1 ATOM 2341 O OH . TYR B 2 145 ? -6.701 -22.146 6.207 1.00 97.63 145 B 1 ATOM 2342 N N . LYS B 2 146 ? -3.326 -29.893 7.101 1.00 98.34 146 B 1 ATOM 2343 C CA . LYS B 2 146 ? -2.298 -30.910 6.920 1.00 98.28 146 B 1 ATOM 2344 C C . LYS B 2 146 ? -1.200 -30.335 6.032 1.00 98.35 146 B 1 ATOM 2345 O O . LYS B 2 146 ? -1.500 -29.858 4.941 1.00 97.59 146 B 1 ATOM 2346 C CB . LYS B 2 146 ? -2.948 -32.161 6.320 1.00 97.74 146 B 1 ATOM 2347 C CG . LYS B 2 146 ? -1.938 -33.297 6.127 1.00 89.42 146 B 1 ATOM 2348 C CD . LYS B 2 146 ? -2.616 -34.499 5.468 1.00 85.30 146 B 1 ATOM 2349 C CE . LYS B 2 146 ? -1.580 -35.586 5.203 1.00 71.29 146 B 1 ATOM 2350 N NZ . LYS B 2 146 ? -2.166 -36.721 4.446 1.00 62.66 146 B 1 ATOM 2351 N N . LEU B 2 147 ? 0.056 -30.412 6.461 1.00 98.34 147 B 1 ATOM 2352 C CA . LEU B 2 147 ? 1.192 -30.071 5.604 1.00 98.13 147 B 1 ATOM 2353 C C . LEU B 2 147 ? 1.268 -31.076 4.446 1.00 98.03 147 B 1 ATOM 2354 O O . LEU B 2 147 ? 1.269 -32.285 4.681 1.00 96.74 147 B 1 ATOM 2355 C CB . LEU B 2 147 ? 2.479 -30.063 6.442 1.00 97.41 147 B 1 ATOM 2356 C CG . LEU B 2 147 ? 3.712 -29.541 5.670 1.00 93.21 147 B 1 ATOM 2357 C CD1 . LEU B 2 147 ? 3.664 -28.017 5.514 1.00 87.05 147 B 1 ATOM 2358 C CD2 . LEU B 2 147 ? 4.986 -29.893 6.433 1.00 87.15 147 B 1 ATOM 2359 N N . VAL B 2 148 ? 1.303 -30.583 3.207 1.00 97.94 148 B 1 ATOM 2360 C CA . VAL B 2 148 ? 1.275 -31.418 1.996 1.00 97.37 148 B 1 ATOM 2361 C C . VAL B 2 148 ? 2.393 -31.119 1.014 1.00 97.27 148 B 1 ATOM 2362 O O . VAL B 2 148 ? 2.759 -32.015 0.262 1.00 94.86 148 B 1 ATOM 2363 C CB . VAL B 2 148 ? -0.070 -31.342 1.253 1.00 96.01 148 B 1 ATOM 2364 C CG1 . VAL B 2 148 ? -1.155 -32.057 2.066 1.00 92.00 148 B 1 ATOM 2365 C CG2 . VAL B 2 148 ? -0.521 -29.911 0.929 1.00 92.71 148 B 1 ATOM 2366 N N . ASP B 2 149 ? 2.917 -29.914 1.010 1.00 97.48 149 B 1 ATOM 2367 C CA . ASP B 2 149 ? 3.931 -29.510 0.036 1.00 97.69 149 B 1 ATOM 2368 C C . ASP B 2 149 ? 4.784 -28.339 0.539 1.00 98.04 149 B 1 ATOM 2369 O O . ASP B 2 149 ? 4.520 -27.746 1.591 1.00 97.23 149 B 1 ATOM 2370 C CB . ASP B 2 149 ? 3.245 -29.176 -1.311 1.00 96.72 149 B 1 ATOM 2371 C CG . ASP B 2 149 ? 3.994 -29.772 -2.500 1.00 94.59 149 B 1 ATOM 2372 O OD1 . ASP B 2 149 ? 5.244 -29.860 -2.395 1.00 88.95 149 B 1 ATOM 2373 O OD2 . ASP B 2 149 ? 3.320 -30.161 -3.480 1.00 88.96 149 B 1 ATOM 2374 N N . GLU B 2 150 ? 5.829 -28.010 -0.223 1.00 97.86 150 B 1 ATOM 2375 C CA . GLU B 2 150 ? 6.703 -26.874 0.037 1.00 97.97 150 B 1 ATOM 2376 C C . GLU B 2 150 ? 7.218 -26.304 -1.284 1.00 98.26 150 B 1 ATOM 2377 O O . GLU B 2 150 ? 7.886 -26.993 -2.045 1.00 97.30 150 B 1 ATOM 2378 C CB . GLU B 2 150 ? 7.883 -27.307 0.937 1.00 96.29 150 B 1 ATOM 2379 C CG . GLU B 2 150 ? 8.896 -26.162 1.166 1.00 94.17 150 B 1 ATOM 2380 C CD . GLU B 2 150 ? 10.103 -26.544 2.043 1.00 94.45 150 B 1 ATOM 2381 O OE1 . GLU B 2 150 ? 11.131 -25.823 1.988 1.00 86.64 150 B 1 ATOM 2382 O OE2 . GLU B 2 150 ? 10.049 -27.506 2.838 1.00 89.16 150 B 1 ATOM 2383 N N . ILE B 2 151 ? 6.995 -25.024 -1.524 1.00 98.32 151 B 1 ATOM 2384 C CA . ILE B 2 151 ? 7.661 -24.313 -2.615 1.00 98.32 151 B 1 ATOM 2385 C C . ILE B 2 151 ? 8.999 -23.780 -2.116 1.00 98.37 151 B 1 ATOM 2386 O O . ILE B 2 151 ? 9.077 -23.014 -1.152 1.00 97.90 151 B 1 ATOM 2387 C CB . ILE B 2 151 ? 6.763 -23.222 -3.231 1.00 97.86 151 B 1 ATOM 2388 C CG1 . ILE B 2 151 ? 5.594 -23.883 -3.990 1.00 95.40 151 B 1 ATOM 2389 C CG2 . ILE B 2 151 ? 7.569 -22.312 -4.180 1.00 96.05 151 B 1 ATOM 2390 C CD1 . ILE B 2 151 ? 4.493 -22.905 -4.399 1.00 90.25 151 B 1 ATOM 2391 N N . THR B 2 152 ? 10.070 -24.128 -2.828 1.00 98.18 152 B 1 ATOM 2392 C CA . THR B 2 152 ? 11.399 -23.564 -2.607 1.00 98.07 152 B 1 ATOM 2393 C C . THR B 2 152 ? 11.683 -22.463 -3.620 1.00 98.23 152 B 1 ATOM 2394 O O . THR B 2 152 ? 11.867 -22.714 -4.810 1.00 97.63 152 B 1 ATOM 2395 C CB . THR B 2 152 ? 12.469 -24.661 -2.639 1.00 97.29 152 B 1 ATOM 2396 O OG1 . THR B 2 152 ? 12.289 -25.531 -1.539 1.00 93.30 152 B 1 ATOM 2397 C CG2 . THR B 2 152 ? 13.878 -24.096 -2.502 1.00 93.32 152 B 1 ATOM 2398 N N . TRP B 2 153 ? 11.794 -21.225 -3.149 1.00 98.09 153 B 1 ATOM 2399 C CA . TRP B 2 153 ? 12.304 -20.133 -3.972 1.00 98.02 153 B 1 ATOM 2400 C C . TRP B 2 153 ? 13.833 -20.131 -3.954 1.00 97.80 153 B 1 ATOM 2401 O O . TRP B 2 153 ? 14.464 -19.685 -2.990 1.00 97.05 153 B 1 ATOM 2402 C CB . TRP B 2 153 ? 11.723 -18.794 -3.525 1.00 97.78 153 B 1 ATOM 2403 C CG . TRP B 2 153 ? 12.284 -17.598 -4.246 1.00 97.75 153 B 1 ATOM 2404 C CD1 . TRP B 2 153 ? 12.723 -17.568 -5.529 1.00 96.89 153 B 1 ATOM 2405 C CD2 . TRP B 2 153 ? 12.492 -16.250 -3.718 1.00 97.41 153 B 1 ATOM 2406 N NE1 . TRP B 2 153 ? 13.182 -16.288 -5.833 1.00 96.58 153 B 1 ATOM 2407 C CE2 . TRP B 2 153 ? 13.048 -15.448 -4.755 1.00 96.87 153 B 1 ATOM 2408 C CE3 . TRP B 2 153 ? 12.242 -15.636 -2.469 1.00 96.65 153 B 1 ATOM 2409 C CZ2 . TRP B 2 153 ? 13.346 -14.081 -4.571 1.00 96.02 153 B 1 ATOM 2410 C CZ3 . TRP B 2 153 ? 12.537 -14.272 -2.284 1.00 95.63 153 B 1 ATOM 2411 C CH2 . TRP B 2 153 ? 13.083 -13.507 -3.327 1.00 95.28 153 B 1 ATOM 2412 N N . VAL B 2 154 ? 14.436 -20.582 -5.043 1.00 97.54 154 B 1 ATOM 2413 C CA . VAL B 2 154 ? 15.880 -20.504 -5.281 1.00 97.26 154 B 1 ATOM 2414 C C . VAL B 2 154 ? 16.210 -19.140 -5.883 1.00 97.24 154 B 1 ATOM 2415 O O . VAL B 2 154 ? 15.751 -18.778 -6.966 1.00 96.58 154 B 1 ATOM 2416 C CB . VAL B 2 154 ? 16.368 -21.655 -6.175 1.00 96.68 154 B 1 ATOM 2417 C CG1 . VAL B 2 154 ? 17.888 -21.586 -6.370 1.00 94.26 154 B 1 ATOM 2418 C CG2 . VAL B 2 154 ? 16.040 -23.021 -5.554 1.00 94.81 154 B 1 ATOM 2419 N N . LYS B 2 155 ? 17.030 -18.369 -5.185 1.00 96.63 155 B 1 ATOM 2420 C CA . LYS B 2 155 ? 17.387 -17.009 -5.586 1.00 96.01 155 B 1 ATOM 2421 C C . LYS B 2 155 ? 18.457 -17.029 -6.671 1.00 95.88 155 B 1 ATOM 2422 O O . LYS B 2 155 ? 19.556 -17.560 -6.470 1.00 94.70 155 B 1 ATOM 2423 C CB . LYS B 2 155 ? 17.828 -16.197 -4.365 1.00 94.85 155 B 1 ATOM 2424 C CG . LYS B 2 155 ? 16.686 -16.062 -3.349 1.00 92.44 155 B 1 ATOM 2425 C CD . LYS B 2 155 ? 17.158 -15.340 -2.085 1.00 87.75 155 B 1 ATOM 2426 C CE . LYS B 2 155 ? 15.988 -15.322 -1.104 1.00 83.51 155 B 1 ATOM 2427 N NZ . LYS B 2 155 ? 16.353 -14.770 0.213 1.00 76.96 155 B 1 ATOM 2428 N N . LYS B 2 156 ? 18.135 -16.402 -7.780 1.00 96.35 156 B 1 ATOM 2429 C CA . LYS B 2 156 ? 19.003 -16.254 -8.947 1.00 96.24 156 B 1 ATOM 2430 C C . LYS B 2 156 ? 19.770 -14.930 -8.880 1.00 96.18 156 B 1 ATOM 2431 O O . LYS B 2 156 ? 19.249 -13.913 -8.427 1.00 94.81 156 B 1 ATOM 2432 C CB . LYS B 2 156 ? 18.105 -16.371 -10.191 1.00 94.64 156 B 1 ATOM 2433 C CG . LYS B 2 156 ? 18.864 -16.469 -11.522 1.00 90.94 156 B 1 ATOM 2434 C CD . LYS B 2 156 ? 17.838 -16.583 -12.656 1.00 90.21 156 B 1 ATOM 2435 C CE . LYS B 2 156 ? 18.498 -16.630 -14.027 1.00 83.18 156 B 1 ATOM 2436 N NZ . LYS B 2 156 ? 17.474 -16.657 -15.098 1.00 78.32 156 B 1 ATOM 2437 N N . THR B 2 157 ? 21.023 -14.937 -9.328 1.00 95.16 157 B 1 ATOM 2438 C CA . THR B 2 157 ? 21.783 -13.708 -9.582 1.00 94.50 157 B 1 ATOM 2439 C C . THR B 2 157 ? 21.464 -13.166 -10.979 1.00 94.79 157 B 1 ATOM 2440 O O . THR B 2 157 ? 21.028 -13.922 -11.847 1.00 93.40 157 B 1 ATOM 2441 C CB . THR B 2 157 ? 23.298 -13.926 -9.460 1.00 92.94 157 B 1 ATOM 2442 O OG1 . THR B 2 157 ? 23.776 -14.812 -10.439 1.00 86.79 157 B 1 ATOM 2443 C CG2 . THR B 2 157 ? 23.702 -14.475 -8.091 1.00 86.11 157 B 1 ATOM 2444 N N . VAL B 2 158 ? 21.802 -11.901 -11.232 1.00 93.87 158 B 1 ATOM 2445 C CA . VAL B 2 158 ? 21.681 -11.275 -12.569 1.00 93.01 158 B 1 ATOM 2446 C C . VAL B 2 158 ? 22.367 -12.115 -13.664 1.00 93.61 158 B 1 ATOM 2447 O O . VAL B 2 158 ? 21.854 -12.268 -14.766 1.00 91.14 158 B 1 ATOM 2448 C CB . VAL B 2 158 ? 22.270 -9.850 -12.546 1.00 91.48 158 B 1 ATOM 2449 C CG1 . VAL B 2 158 ? 22.071 -9.128 -13.879 1.00 80.64 158 B 1 ATOM 2450 C CG2 . VAL B 2 158 ? 21.633 -8.987 -11.443 1.00 81.10 158 B 1 ATOM 2451 N N . ASN B 2 159 ? 23.478 -12.776 -13.324 1.00 94.10 159 B 1 ATOM 2452 C CA . ASN B 2 159 ? 24.220 -13.650 -14.245 1.00 93.78 159 B 1 ATOM 2453 C C . ASN B 2 159 ? 23.658 -15.087 -14.336 1.00 94.27 159 B 1 ATOM 2454 O O . ASN B 2 159 ? 24.367 -16.005 -14.759 1.00 90.97 159 B 1 ATOM 2455 C CB . ASN B 2 159 ? 25.706 -13.634 -13.847 1.00 92.50 159 B 1 ATOM 2456 C CG . ASN B 2 159 ? 26.342 -12.257 -13.954 1.00 88.76 159 B 1 ATOM 2457 O OD1 . ASN B 2 159 ? 25.859 -11.355 -14.596 1.00 78.45 159 B 1 ATOM 2458 N ND2 . ASN B 2 159 ? 27.475 -12.053 -13.320 1.00 78.02 159 B 1 ATOM 2459 N N . GLY B 2 160 ? 22.440 -15.324 -13.862 1.00 93.25 160 B 1 ATOM 2460 C CA . GLY B 2 160 ? 21.782 -16.635 -13.943 1.00 92.63 160 B 1 ATOM 2461 C C . GLY B 2 160 ? 22.291 -17.701 -12.971 1.00 94.01 160 B 1 ATOM 2462 O O . GLY B 2 160 ? 21.864 -18.854 -13.062 1.00 90.62 160 B 1 ATOM 2463 N N . LYS B 2 161 ? 23.182 -17.348 -12.038 1.00 93.82 161 B 1 ATOM 2464 C CA . LYS B 2 161 ? 23.743 -18.273 -11.041 1.00 94.02 161 B 1 ATOM 2465 C C . LYS B 2 161 ? 22.921 -18.272 -9.752 1.00 95.07 161 B 1 ATOM 2466 O O . LYS B 2 161 ? 22.236 -17.302 -9.443 1.00 93.29 161 B 1 ATOM 2467 C CB . LYS B 2 161 ? 25.219 -17.946 -10.767 1.00 92.55 161 B 1 ATOM 2468 C CG . LYS B 2 161 ? 26.085 -18.095 -12.027 1.00 89.19 161 B 1 ATOM 2469 C CD . LYS B 2 161 ? 27.575 -17.894 -11.717 1.00 81.58 161 B 1 ATOM 2470 C CE . LYS B 2 161 ? 28.380 -18.064 -13.008 1.00 74.16 161 B 1 ATOM 2471 N NZ . LYS B 2 161 ? 29.849 -17.949 -12.799 1.00 63.22 161 B 1 ATOM 2472 N N . ILE B 2 162 ? 23.050 -19.343 -8.967 1.00 94.06 162 B 1 ATOM 2473 C CA . ILE B 2 162 ? 22.476 -19.407 -7.618 1.00 93.81 162 B 1 ATOM 2474 C C . ILE B 2 162 ? 23.126 -18.328 -6.742 1.00 93.37 162 B 1 ATOM 2475 O O . ILE B 2 162 ? 24.356 -18.224 -6.661 1.00 90.43 162 B 1 ATOM 2476 C CB . ILE B 2 162 ? 22.613 -20.823 -7.021 1.00 92.66 162 B 1 ATOM 2477 C CG1 . ILE B 2 162 ? 21.866 -21.855 -7.900 1.00 89.21 162 B 1 ATOM 2478 C CG2 . ILE B 2 162 ? 22.069 -20.850 -5.583 1.00 89.44 162 B 1 ATOM 2479 C CD1 . ILE B 2 162 ? 22.044 -23.311 -7.451 1.00 87.04 162 B 1 ATOM 2480 N N . ALA B 2 163 ? 22.293 -17.516 -6.084 1.00 93.60 163 B 1 ATOM 2481 C CA . ALA B 2 163 ? 22.756 -16.467 -5.190 1.00 91.41 163 B 1 ATOM 2482 C C . ALA B 2 163 ? 23.491 -17.056 -3.976 1.00 91.21 163 B 1 ATOM 2483 O O . ALA B 2 163 ? 23.220 -18.165 -3.525 1.00 87.46 163 B 1 ATOM 2484 C CB . ALA B 2 163 ? 21.568 -15.592 -4.775 1.00 88.67 163 B 1 ATOM 2485 N N . LYS B 2 164 ? 24.421 -16.284 -3.414 1.00 90.60 164 B 1 ATOM 2486 C CA . LYS B 2 164 ? 25.150 -16.654 -2.198 1.00 87.95 164 B 1 ATOM 2487 C C . LYS B 2 164 ? 24.721 -15.735 -1.063 1.00 86.88 164 B 1 ATOM 2488 O O . LYS B 2 164 ? 24.940 -14.527 -1.127 1.00 78.88 164 B 1 ATOM 2489 C CB . LYS B 2 164 ? 26.665 -16.614 -2.445 1.00 83.42 164 B 1 ATOM 2490 C CG . LYS B 2 164 ? 27.111 -17.640 -3.499 1.00 77.15 164 B 1 ATOM 2491 C CD . LYS B 2 164 ? 28.639 -17.643 -3.636 1.00 71.55 164 B 1 ATOM 2492 C CE . LYS B 2 164 ? 29.080 -18.699 -4.647 1.00 64.49 164 B 1 ATOM 2493 N NZ . LYS B 2 164 ? 30.559 -18.828 -4.697 1.00 55.07 164 B 1 ATOM 2494 N N . GLY B 2 165 ? 24.094 -16.315 -0.033 1.00 88.12 165 B 1 ATOM 2495 C CA . GLY B 2 165 ? 23.725 -15.618 1.193 1.00 85.92 165 B 1 ATOM 2496 C C . GLY B 2 165 ? 24.578 -16.046 2.385 1.00 87.00 165 B 1 ATOM 2497 O O . GLY B 2 165 ? 25.383 -16.973 2.299 1.00 82.93 165 B 1 ATOM 2498 N N . HIS B 2 166 ? 24.396 -15.368 3.507 1.00 86.84 166 B 1 ATOM 2499 C CA . HIS B 2 166 ? 25.049 -15.748 4.755 1.00 86.16 166 B 1 ATOM 2500 C C . HIS B 2 166 ? 24.452 -17.032 5.336 1.00 87.43 166 B 1 ATOM 2501 O O . HIS B 2 166 ? 23.242 -17.235 5.326 1.00 83.22 166 B 1 ATOM 2502 C CB . HIS B 2 166 ? 24.995 -14.594 5.760 1.00 82.09 166 B 1 ATOM 2503 C CG . HIS B 2 166 ? 26.037 -13.544 5.476 1.00 75.03 166 B 1 ATOM 2504 N ND1 . HIS B 2 166 ? 27.399 -13.696 5.639 1.00 64.61 166 B 1 ATOM 2505 C CD2 . HIS B 2 166 ? 25.841 -12.268 5.009 1.00 64.37 166 B 1 ATOM 2506 C CE1 . HIS B 2 166 ? 27.997 -12.547 5.276 1.00 60.18 166 B 1 ATOM 2507 N NE2 . HIS B 2 166 ? 27.085 -11.656 4.890 1.00 61.88 166 B 1 ATOM 2508 N N . GLY B 2 167 ? 25.310 -17.871 5.883 1.00 86.65 167 B 1 ATOM 2509 C CA . GLY B 2 167 ? 24.952 -19.064 6.637 1.00 86.00 167 B 1 ATOM 2510 C C . GLY B 2 167 ? 26.141 -19.502 7.485 1.00 87.08 167 B 1 ATOM 2511 O O . GLY B 2 167 ? 27.280 -19.132 7.186 1.00 83.57 167 B 1 ATOM 2512 N N . PHE B 2 168 ? 25.873 -20.255 8.558 1.00 86.52 168 B 1 ATOM 2513 C CA . PHE B 2 168 ? 26.934 -20.708 9.461 1.00 86.53 168 B 1 ATOM 2514 C C . PHE B 2 168 ? 27.639 -21.959 8.922 1.00 88.31 168 B 1 ATOM 2515 O O . PHE B 2 168 ? 28.865 -21.970 8.794 1.00 85.30 168 B 1 ATOM 2516 C CB . PHE B 2 168 ? 26.351 -20.925 10.863 1.00 83.08 168 B 1 ATOM 2517 C CG . PHE B 2 168 ? 27.413 -21.180 11.910 1.00 77.86 168 B 1 ATOM 2518 C CD1 . PHE B 2 168 ? 27.713 -22.493 12.316 1.00 72.71 168 B 1 ATOM 2519 C CD2 . PHE B 2 168 ? 28.115 -20.103 12.474 1.00 72.32 168 B 1 ATOM 2520 C CE1 . PHE B 2 168 ? 28.708 -22.729 13.279 1.00 67.99 168 B 1 ATOM 2521 C CE2 . PHE B 2 168 ? 29.112 -20.335 13.440 1.00 68.63 168 B 1 ATOM 2522 C CZ . PHE B 2 168 ? 29.410 -21.647 13.840 1.00 66.94 168 B 1 ATOM 2523 N N . TYR B 2 169 ? 26.856 -22.979 8.535 1.00 89.05 169 B 1 ATOM 2524 C CA . TYR B 2 169 ? 27.379 -24.220 7.957 1.00 90.63 169 B 1 ATOM 2525 C C . TYR B 2 169 ? 27.375 -24.177 6.426 1.00 91.88 169 B 1 ATOM 2526 O O . TYR B 2 169 ? 28.412 -24.343 5.784 1.00 89.60 169 B 1 ATOM 2527 C CB . TYR B 2 169 ? 26.560 -25.407 8.477 1.00 90.05 169 B 1 ATOM 2528 C CG . TYR B 2 169 ? 26.585 -25.562 9.983 1.00 90.40 169 B 1 ATOM 2529 C CD1 . TYR B 2 169 ? 27.742 -26.053 10.619 1.00 86.35 169 B 1 ATOM 2530 C CD2 . TYR B 2 169 ? 25.460 -25.220 10.758 1.00 87.43 169 B 1 ATOM 2531 C CE1 . TYR B 2 169 ? 27.779 -26.208 12.013 1.00 86.04 169 B 1 ATOM 2532 C CE2 . TYR B 2 169 ? 25.488 -25.370 12.157 1.00 86.41 169 B 1 ATOM 2533 C CZ . TYR B 2 169 ? 26.650 -25.867 12.778 1.00 86.78 169 B 1 ATOM 2534 O OH . TYR B 2 169 ? 26.680 -26.019 14.142 1.00 84.10 169 B 1 ATOM 2535 N N . LEU B 2 170 ? 26.193 -23.922 5.833 1.00 92.95 170 B 1 ATOM 2536 C CA . LEU B 2 170 ? 26.006 -23.804 4.392 1.00 92.99 170 B 1 ATOM 2537 C C . LEU B 2 170 ? 25.609 -22.371 4.027 1.00 92.40 170 B 1 ATOM 2538 O O . LEU B 2 170 ? 24.981 -21.659 4.811 1.00 90.82 170 B 1 ATOM 2539 C CB . LEU B 2 170 ? 24.954 -24.819 3.906 1.00 92.99 170 B 1 ATOM 2540 C CG . LEU B 2 170 ? 25.303 -26.300 4.163 1.00 92.59 170 B 1 ATOM 2541 C CD1 . LEU B 2 170 ? 24.154 -27.180 3.702 1.00 89.58 170 B 1 ATOM 2542 C CD2 . LEU B 2 170 ? 26.571 -26.734 3.424 1.00 89.34 170 B 1 ATOM 2543 N N . GLN B 2 171 ? 25.947 -21.948 2.807 1.00 92.46 171 B 1 ATOM 2544 C CA . GLN B 2 171 ? 25.450 -20.686 2.273 1.00 91.88 171 B 1 ATOM 2545 C C . GLN B 2 171 ? 23.950 -20.796 1.992 1.00 92.50 171 B 1 ATOM 2546 O O . GLN B 2 171 ? 23.500 -21.770 1.399 1.00 91.18 171 B 1 ATOM 2547 C CB . GLN B 2 171 ? 26.228 -20.286 1.012 1.00 90.19 171 B 1 ATOM 2548 C CG . GLN B 2 171 ? 27.683 -19.932 1.349 1.00 85.72 171 B 1 ATOM 2549 C CD . GLN B 2 171 ? 28.490 -19.429 0.151 1.00 83.49 171 B 1 ATOM 2550 O OE1 . GLN B 2 171 ? 28.283 -19.760 -1.004 1.00 75.61 171 B 1 ATOM 2551 N NE2 . GLN B 2 171 ? 29.477 -18.595 0.394 1.00 73.72 171 B 1 ATOM 2552 N N . HIS B 2 172 ? 23.175 -19.783 2.390 1.00 93.36 172 B 1 ATOM 2553 C CA . HIS B 2 172 ? 21.739 -19.747 2.127 1.00 92.82 172 B 1 ATOM 2554 C C . HIS B 2 172 ? 21.469 -19.123 0.755 1.00 93.25 172 B 1 ATOM 2555 O O . HIS B 2 172 ? 21.952 -18.034 0.447 1.00 91.64 172 B 1 ATOM 2556 C CB . HIS B 2 172 ? 21.013 -19.000 3.254 1.00 90.99 172 B 1 ATOM 2557 C CG . HIS B 2 172 ? 21.084 -19.666 4.604 1.00 88.64 172 B 1 ATOM 2558 N ND1 . HIS B 2 172 ? 20.588 -19.131 5.775 1.00 76.52 172 B 1 ATOM 2559 C CD2 . HIS B 2 172 ? 21.604 -20.891 4.934 1.00 76.67 172 B 1 ATOM 2560 C CE1 . HIS B 2 172 ? 20.814 -20.001 6.766 1.00 78.53 172 B 1 ATOM 2561 N NE2 . HIS B 2 172 ? 21.428 -21.087 6.292 1.00 80.63 172 B 1 ATOM 2562 N N . ALA B 2 173 ? 20.689 -19.820 -0.061 1.00 94.18 173 B 1 ATOM 2563 C CA . ALA B 2 173 ? 20.327 -19.387 -1.404 1.00 94.18 173 B 1 ATOM 2564 C C . ALA B 2 173 ? 18.840 -19.580 -1.720 1.00 95.28 173 B 1 ATOM 2565 O O . ALA B 2 173 ? 18.426 -19.346 -2.852 1.00 93.91 173 B 1 ATOM 2566 C CB . ALA B 2 173 ? 21.221 -20.136 -2.395 1.00 92.09 173 B 1 ATOM 2567 N N . LYS B 2 174 ? 18.040 -20.009 -0.737 1.00 95.51 174 B 1 ATOM 2568 C CA . LYS B 2 174 ? 16.614 -20.290 -0.892 1.00 95.57 174 B 1 ATOM 2569 C C . LYS B 2 174 ? 15.782 -19.705 0.243 1.00 95.94 174 B 1 ATOM 2570 O O . LYS B 2 174 ? 16.307 -19.421 1.322 1.00 95.25 174 B 1 ATOM 2571 C CB . LYS B 2 174 ? 16.388 -21.805 -1.075 1.00 93.86 174 B 1 ATOM 2572 C CG . LYS B 2 174 ? 16.696 -22.654 0.174 1.00 91.54 174 B 1 ATOM 2573 C CD . LYS B 2 174 ? 16.273 -24.116 -0.042 1.00 89.77 174 B 1 ATOM 2574 C CE . LYS B 2 174 ? 16.296 -24.930 1.248 1.00 83.45 174 B 1 ATOM 2575 N NZ . LYS B 2 174 ? 15.433 -26.147 1.156 1.00 79.11 174 B 1 ATOM 2576 N N . GLU B 2 175 ? 14.497 -19.559 -0.004 1.00 96.40 175 B 1 ATOM 2577 C CA . GLU B 2 175 ? 13.450 -19.417 1.008 1.00 96.33 175 B 1 ATOM 2578 C C . GLU B 2 175 ? 12.382 -20.475 0.764 1.00 97.15 175 B 1 ATOM 2579 O O . GLU B 2 175 ? 12.207 -20.917 -0.366 1.00 96.64 175 B 1 ATOM 2580 C CB . GLU B 2 175 ? 12.848 -18.006 0.997 1.00 95.04 175 B 1 ATOM 2581 C CG . GLU B 2 175 ? 13.850 -16.973 1.526 1.00 91.06 175 B 1 ATOM 2582 C CD . GLU B 2 175 ? 13.340 -15.528 1.549 1.00 90.58 175 B 1 ATOM 2583 O OE1 . GLU B 2 175 ? 14.212 -14.624 1.488 1.00 82.75 175 B 1 ATOM 2584 O OE2 . GLU B 2 175 ? 12.125 -15.282 1.599 1.00 85.41 175 B 1 ATOM 2585 N N . SER B 2 176 ? 11.687 -20.879 1.828 1.00 97.60 176 B 1 ATOM 2586 C CA . SER B 2 176 ? 10.664 -21.916 1.777 1.00 97.78 176 B 1 ATOM 2587 C C . SER B 2 176 ? 9.284 -21.311 2.018 1.00 98.27 176 B 1 ATOM 2588 O O . SER B 2 176 ? 9.119 -20.475 2.909 1.00 97.86 176 B 1 ATOM 2589 C CB . SER B 2 176 ? 10.957 -23.003 2.812 1.00 96.67 176 B 1 ATOM 2590 O OG . SER B 2 176 ? 12.147 -23.708 2.496 1.00 89.82 176 B 1 ATOM 2591 N N . CYS B 2 177 ? 8.303 -21.756 1.238 1.00 98.38 177 B 1 ATOM 2592 C CA . CYS B 2 177 ? 6.888 -21.483 1.437 1.00 98.51 177 B 1 ATOM 2593 C C . CYS B 2 177 ? 6.185 -22.809 1.720 1.00 98.57 177 B 1 ATOM 2594 O O . CYS B 2 177 ? 6.041 -23.638 0.821 1.00 98.23 177 B 1 ATOM 2595 C CB . CYS B 2 177 ? 6.340 -20.777 0.194 1.00 98.39 177 B 1 ATOM 2596 S SG . CYS B 2 177 ? 4.647 -20.213 0.513 1.00 97.98 177 B 1 ATOM 2597 N N . LEU B 2 178 ? 5.787 -23.024 2.971 1.00 98.62 178 B 1 ATOM 2598 C CA . LEU B 2 178 ? 5.127 -24.254 3.397 1.00 98.67 178 B 1 ATOM 2599 C C . LEU B 2 178 ? 3.659 -24.227 2.990 1.00 98.71 178 B 1 ATOM 2600 O O . LEU B 2 178 ? 2.997 -23.201 3.164 1.00 98.38 178 B 1 ATOM 2601 C CB . LEU B 2 178 ? 5.283 -24.421 4.914 1.00 98.48 178 B 1 ATOM 2602 C CG . LEU B 2 178 ? 6.737 -24.609 5.383 1.00 96.62 178 B 1 ATOM 2603 C CD1 . LEU B 2 178 ? 6.792 -24.645 6.909 1.00 89.66 178 B 1 ATOM 2604 C CD2 . LEU B 2 178 ? 7.334 -25.918 4.874 1.00 89.79 178 B 1 ATOM 2605 N N . ILE B 2 179 ? 3.142 -25.355 2.488 1.00 98.54 179 B 1 ATOM 2606 C CA . ILE B 2 179 ? 1.780 -25.479 1.974 1.00 98.48 179 B 1 ATOM 2607 C C . ILE B 2 179 ? 0.994 -26.482 2.811 1.00 98.44 179 B 1 ATOM 2608 O O . ILE B 2 179 ? 1.344 -27.662 2.911 1.00 97.92 179 B 1 ATOM 2609 C CB . ILE B 2 179 ? 1.769 -25.832 0.473 1.00 98.16 179 B 1 ATOM 2610 C CG1 . ILE B 2 179 ? 2.632 -24.821 -0.328 1.00 96.97 179 B 1 ATOM 2611 C CG2 . ILE B 2 179 ? 0.317 -25.847 -0.045 1.00 97.20 179 B 1 ATOM 2612 C CD1 . ILE B 2 179 ? 2.743 -25.140 -1.818 1.00 92.11 179 B 1 ATOM 2613 N N . GLY B 2 180 ? -0.095 -26.008 3.402 1.00 98.52 180 B 1 ATOM 2614 C CA . GLY B 2 180 ? -1.084 -26.818 4.093 1.00 98.48 180 B 1 ATOM 2615 C C . GLY B 2 180 ? -2.378 -26.926 3.301 1.00 98.60 180 B 1 ATOM 2616 O O . GLY B 2 180 ? -2.746 -26.007 2.573 1.00 98.26 180 B 1 ATOM 2617 N N . VAL B 2 181 ? -3.096 -28.034 3.474 1.00 98.45 181 B 1 ATOM 2618 C CA . VAL B 2 181 ? -4.436 -28.260 2.916 1.00 98.41 181 B 1 ATOM 2619 C C . VAL B 2 181 ? -5.452 -28.481 4.032 1.00 98.44 181 B 1 ATOM 2620 O O . VAL B 2 181 ? -5.142 -29.076 5.071 1.00 97.77 181 B 1 ATOM 2621 C CB . VAL B 2 181 ? -4.426 -29.412 1.895 1.00 97.49 181 B 1 ATOM 2622 C CG1 . VAL B 2 181 ? -4.261 -30.795 2.538 1.00 91.63 181 B 1 ATOM 2623 C CG2 . VAL B 2 181 ? -5.696 -29.423 1.045 1.00 91.01 181 B 1 ATOM 2624 N N . LYS B 2 182 ? -6.691 -28.021 3.804 1.00 98.04 182 B 1 ATOM 2625 C CA . LYS B 2 182 ? -7.826 -28.202 4.705 1.00 97.68 182 B 1 ATOM 2626 C C . LYS B 2 182 ? -9.087 -28.517 3.910 1.00 97.92 182 B 1 ATOM 2627 O O . LYS B 2 182 ? -9.313 -27.926 2.859 1.00 96.63 182 B 1 ATOM 2628 C CB . LYS B 2 182 ? -7.985 -26.920 5.538 1.00 94.90 182 B 1 ATOM 2629 C CG . LYS B 2 182 ? -9.158 -26.969 6.529 1.00 91.09 182 B 1 ATOM 2630 C CD . LYS B 2 182 ? -9.330 -25.605 7.197 1.00 91.33 182 B 1 ATOM 2631 C CE . LYS B 2 182 ? -10.582 -25.594 8.073 1.00 86.75 182 B 1 ATOM 2632 N NZ . LYS B 2 182 ? -10.915 -24.217 8.498 1.00 84.39 182 B 1 ATOM 2633 N N . GLY B 2 183 ? -9.921 -29.411 4.446 1.00 96.74 183 B 1 ATOM 2634 C CA . GLY B 2 183 ? -11.215 -29.748 3.864 1.00 96.55 183 B 1 ATOM 2635 C C . GLY B 2 183 ? -11.111 -30.504 2.541 1.00 96.99 183 B 1 ATOM 2636 O O . GLY B 2 183 ? -10.150 -31.248 2.306 1.00 94.29 183 B 1 ATOM 2637 N N . ASP B 2 184 ? -12.135 -30.336 1.693 1.00 95.74 184 B 1 ATOM 2638 C CA . ASP B 2 184 ? -12.240 -30.978 0.387 1.00 95.69 184 B 1 ATOM 2639 C C . ASP B 2 184 ? -11.724 -30.050 -0.721 1.00 95.78 184 B 1 ATOM 2640 O O . ASP B 2 184 ? -12.357 -29.055 -1.083 1.00 93.11 184 B 1 ATOM 2641 C CB . ASP B 2 184 ? -13.689 -31.412 0.132 1.00 94.14 184 B 1 ATOM 2642 C CG . ASP B 2 184 ? -13.865 -32.064 -1.246 1.00 91.64 184 B 1 ATOM 2643 O OD1 . ASP B 2 184 ? -12.847 -32.490 -1.834 1.00 85.95 184 B 1 ATOM 2644 O OD2 . ASP B 2 184 ? -15.020 -32.115 -1.724 1.00 85.39 184 B 1 ATOM 2645 N N . VAL B 2 185 ? -10.574 -30.405 -1.291 1.00 96.02 185 B 1 ATOM 2646 C CA . VAL B 2 185 ? -9.979 -29.700 -2.436 1.00 95.62 185 B 1 ATOM 2647 C C . VAL B 2 185 ? -10.234 -30.407 -3.768 1.00 95.49 185 B 1 ATOM 2648 O O . VAL B 2 185 ? -9.763 -29.955 -4.813 1.00 91.37 185 B 1 ATOM 2649 C CB . VAL B 2 185 ? -8.484 -29.402 -2.215 1.00 93.55 185 B 1 ATOM 2650 C CG1 . VAL B 2 185 ? -8.298 -28.455 -1.016 1.00 87.66 185 B 1 ATOM 2651 C CG2 . VAL B 2 185 ? -7.660 -30.674 -1.995 1.00 89.39 185 B 1 ATOM 2652 N N . ASP B 2 186 ? -11.034 -31.481 -3.757 1.00 95.05 186 B 1 ATOM 2653 C CA . ASP B 2 186 ? -11.503 -32.200 -4.948 1.00 94.22 186 B 1 ATOM 2654 C C . ASP B 2 186 ? -12.888 -31.709 -5.408 1.00 93.95 186 B 1 ATOM 2655 O O . ASP B 2 186 ? -13.510 -32.272 -6.303 1.00 89.34 186 B 1 ATOM 2656 C CB . ASP B 2 186 ? -11.413 -33.722 -4.712 1.00 92.37 186 B 1 ATOM 2657 C CG . ASP B 2 186 ? -9.965 -34.224 -4.661 1.00 88.71 186 B 1 ATOM 2658 O OD1 . ASP B 2 186 ? -9.039 -33.455 -4.999 1.00 82.85 186 B 1 ATOM 2659 O OD2 . ASP B 2 186 ? -9.704 -35.427 -4.452 1.00 83.92 186 B 1 ATOM 2660 N N . ASN B 2 187 ? -13.343 -30.583 -4.872 1.00 93.09 187 B 1 ATOM 2661 C CA . ASN B 2 187 ? -14.622 -29.927 -5.170 1.00 91.28 187 B 1 ATOM 2662 C C . ASN B 2 187 ? -14.706 -29.251 -6.564 1.00 92.03 187 B 1 ATOM 2663 O O . ASN B 2 187 ? -15.686 -28.568 -6.873 1.00 87.33 187 B 1 ATOM 2664 C CB . ASN B 2 187 ? -14.925 -28.954 -4.017 1.00 86.16 187 B 1 ATOM 2665 C CG . ASN B 2 187 ? -13.927 -27.807 -3.897 1.00 84.04 187 B 1 ATOM 2666 O OD1 . ASN B 2 187 ? -13.300 -27.364 -4.844 1.00 76.81 187 B 1 ATOM 2667 N ND2 . ASN B 2 187 ? -13.772 -27.273 -2.700 1.00 79.35 187 B 1 ATOM 2668 N N . GLY B 2 188 ? -13.689 -29.411 -7.407 1.00 92.16 188 B 1 ATOM 2669 C CA . GLY B 2 188 ? -13.623 -28.861 -8.768 1.00 92.21 188 B 1 ATOM 2670 C C . GLY B 2 188 ? -13.111 -27.420 -8.870 1.00 93.73 188 B 1 ATOM 2671 O O . GLY B 2 188 ? -12.912 -26.935 -9.989 1.00 90.22 188 B 1 ATOM 2672 N N . ARG B 2 189 ? -12.867 -26.732 -7.752 1.00 93.94 189 B 1 ATOM 2673 C CA . ARG B 2 189 ? -12.256 -25.390 -7.744 1.00 93.78 189 B 1 ATOM 2674 C C . ARG B 2 189 ? -10.751 -25.440 -7.973 1.00 94.89 189 B 1 ATOM 2675 O O . ARG B 2 189 ? -10.202 -24.529 -8.590 1.00 93.22 189 B 1 ATOM 2676 C CB . ARG B 2 189 ? -12.532 -24.673 -6.418 1.00 91.63 189 B 1 ATOM 2677 C CG . ARG B 2 189 ? -14.017 -24.419 -6.185 1.00 86.22 189 B 1 ATOM 2678 C CD . ARG B 2 189 ? -14.204 -23.711 -4.841 1.00 81.13 189 B 1 ATOM 2679 N NE . ARG B 2 189 ? -15.615 -23.388 -4.589 1.00 75.41 189 B 1 ATOM 2680 C CZ . ARG B 2 189 ? -16.241 -22.291 -4.972 1.00 70.68 189 B 1 ATOM 2681 N NH1 . ARG B 2 189 ? -15.637 -21.342 -5.629 1.00 63.14 189 B 1 ATOM 2682 N NH2 . ARG B 2 189 ? -17.503 -22.131 -4.682 1.00 63.29 189 B 1 ATOM 2683 N N . PHE B 2 190 ? -10.109 -26.493 -7.491 1.00 95.94 190 B 1 ATOM 2684 C CA . PHE B 2 190 ? -8.661 -26.648 -7.537 1.00 95.94 190 B 1 ATOM 2685 C C . PHE B 2 190 ? -8.224 -27.545 -8.694 1.00 95.84 190 B 1 ATOM 2686 O O . PHE B 2 190 ? -8.939 -28.451 -9.128 1.00 93.61 190 B 1 ATOM 2687 C CB . PHE B 2 190 ? -8.157 -27.157 -6.184 1.00 95.45 190 B 1 ATOM 2688 C CG . PHE B 2 190 ? -8.523 -26.241 -5.032 1.00 96.60 190 B 1 ATOM 2689 C CD1 . PHE B 2 190 ? -7.722 -25.127 -4.730 1.00 95.69 190 B 1 ATOM 2690 C CD2 . PHE B 2 190 ? -9.696 -26.473 -4.290 1.00 96.04 190 B 1 ATOM 2691 C CE1 . PHE B 2 190 ? -8.082 -24.257 -3.690 1.00 95.69 190 B 1 ATOM 2692 C CE2 . PHE B 2 190 ? -10.062 -25.599 -3.248 1.00 95.95 190 B 1 ATOM 2693 C CZ . PHE B 2 190 ? -9.254 -24.491 -2.949 1.00 96.28 190 B 1 ATOM 2694 N N . LYS B 2 191 ? -7.021 -27.294 -9.200 1.00 96.16 191 B 1 ATOM 2695 C CA . LYS B 2 191 ? -6.331 -28.128 -10.180 1.00 95.85 191 B 1 ATOM 2696 C C . LYS B 2 191 ? -5.269 -28.968 -9.484 1.00 95.97 191 B 1 ATOM 2697 O O . LYS B 2 191 ? -4.779 -28.621 -8.413 1.00 93.35 191 B 1 ATOM 2698 C CB . LYS B 2 191 ? -5.746 -27.259 -11.307 1.00 94.99 191 B 1 ATOM 2699 C CG . LYS B 2 191 ? -6.785 -26.394 -12.052 1.00 91.29 191 B 1 ATOM 2700 C CD . LYS B 2 191 ? -7.897 -27.237 -12.679 1.00 83.80 191 B 1 ATOM 2701 C CE . LYS B 2 191 ? -8.879 -26.341 -13.434 1.00 77.67 191 B 1 ATOM 2702 N NZ . LYS B 2 191 ? -10.060 -27.116 -13.900 1.00 67.09 191 B 1 ATOM 2703 N N . LYS B 2 192 ? -4.917 -30.090 -10.111 1.00 95.85 192 B 1 ATOM 2704 C CA . LYS B 2 192 ? -3.859 -30.992 -9.644 1.00 95.11 192 B 1 ATOM 2705 C C . LYS B 2 192 ? -2.713 -31.015 -10.648 1.00 95.31 192 B 1 ATOM 2706 O O . LYS B 2 192 ? -2.935 -30.772 -11.837 1.00 91.04 192 B 1 ATOM 2707 C CB . LYS B 2 192 ? -4.424 -32.404 -9.397 1.00 92.08 192 B 1 ATOM 2708 C CG . LYS B 2 192 ? -5.430 -32.429 -8.240 1.00 87.45 192 B 1 ATOM 2709 C CD . LYS B 2 192 ? -5.893 -33.856 -7.919 1.00 81.13 192 B 1 ATOM 2710 C CE . LYS B 2 192 ? -6.831 -33.786 -6.716 1.00 73.97 192 B 1 ATOM 2711 N NZ . LYS B 2 192 ? -7.344 -35.105 -6.265 1.00 63.91 192 B 1 ATOM 2712 N N . ASN B 2 193 ? -1.526 -31.368 -10.166 1.00 95.09 193 B 1 ATOM 2713 C CA . ASN B 2 193 ? -0.323 -31.514 -10.990 1.00 95.04 193 B 1 ATOM 2714 C C . ASN B 2 193 ? -0.009 -30.251 -11.819 1.00 95.20 193 B 1 ATOM 2715 O O . ASN B 2 193 ? 0.131 -30.299 -13.042 1.00 91.68 193 B 1 ATOM 2716 C CB . ASN B 2 193 ? -0.456 -32.810 -11.810 1.00 93.88 193 B 1 ATOM 2717 C CG . ASN B 2 193 ? 0.853 -33.195 -12.472 1.00 92.28 193 B 1 ATOM 2718 O OD1 . ASN B 2 193 ? 1.903 -33.179 -11.876 1.00 84.54 193 B 1 ATOM 2719 N ND2 . ASN B 2 193 ? 0.825 -33.580 -13.726 1.00 84.34 193 B 1 ATOM 2720 N N . ILE B 2 194 ? 0.012 -29.108 -11.143 1.00 95.47 194 B 1 ATOM 2721 C CA . ILE B 2 194 ? 0.235 -27.787 -11.741 1.00 94.60 194 B 1 ATOM 2722 C C . ILE B 2 194 ? 1.526 -27.152 -11.224 1.00 94.91 194 B 1 ATOM 2723 O O . ILE B 2 194 ? 2.042 -27.555 -10.181 1.00 91.53 194 B 1 ATOM 2724 C CB . ILE B 2 194 ? -0.987 -26.867 -11.548 1.00 91.93 194 B 1 ATOM 2725 C CG1 . ILE B 2 194 ? -1.410 -26.632 -10.081 1.00 82.77 194 B 1 ATOM 2726 C CG2 . ILE B 2 194 ? -2.193 -27.433 -12.340 1.00 79.61 194 B 1 ATOM 2727 C CD1 . ILE B 2 194 ? -0.561 -25.620 -9.312 1.00 77.29 194 B 1 ATOM 2728 N N . ALA B 2 195 ? 2.004 -26.148 -11.945 1.00 94.92 195 B 1 ATOM 2729 C CA . ALA B 2 195 ? 3.166 -25.347 -11.561 1.00 94.32 195 B 1 ATOM 2730 C C . ALA B 2 195 ? 4.409 -26.203 -11.232 1.00 95.09 195 B 1 ATOM 2731 O O . ALA B 2 195 ? 4.725 -27.158 -11.945 1.00 91.22 195 B 1 ATOM 2732 C CB . ALA B 2 195 ? 2.730 -24.350 -10.471 1.00 91.71 195 B 1 ATOM 2733 N N . SER B 2 196 ? 5.144 -25.824 -10.199 1.00 94.42 196 B 1 ATOM 2734 C CA . SER B 2 196 ? 6.341 -26.506 -9.703 1.00 95.10 196 B 1 ATOM 2735 C C . SER B 2 196 ? 6.484 -26.226 -8.209 1.00 96.21 196 B 1 ATOM 2736 O O . SER B 2 196 ? 6.011 -25.202 -7.721 1.00 94.05 196 B 1 ATOM 2737 C CB . SER B 2 196 ? 7.567 -25.978 -10.465 1.00 93.05 196 B 1 ATOM 2738 O OG . SER B 2 196 ? 8.767 -26.570 -10.010 1.00 89.55 196 B 1 ATOM 2739 N N . ASP B 2 197 ? 7.180 -27.103 -7.502 1.00 96.99 197 B 1 ATOM 2740 C CA . ASP B 2 197 ? 7.632 -26.863 -6.126 1.00 97.28 197 B 1 ATOM 2741 C C . ASP B 2 197 ? 8.902 -25.989 -6.050 1.00 97.72 197 B 1 ATOM 2742 O O . ASP B 2 197 ? 9.417 -25.689 -4.974 1.00 96.56 197 B 1 ATOM 2743 C CB . ASP B 2 197 ? 7.825 -28.217 -5.430 1.00 96.17 197 B 1 ATOM 2744 C CG . ASP B 2 197 ? 9.005 -29.034 -5.984 1.00 96.19 197 B 1 ATOM 2745 O OD1 . ASP B 2 197 ? 9.443 -28.766 -7.132 1.00 92.37 197 B 1 ATOM 2746 O OD2 . ASP B 2 197 ? 9.496 -29.913 -5.245 1.00 92.43 197 B 1 ATOM 2747 N N . VAL B 2 198 ? 9.406 -25.536 -7.198 1.00 97.57 198 B 1 ATOM 2748 C CA . VAL B 2 198 ? 10.572 -24.658 -7.299 1.00 97.49 198 B 1 ATOM 2749 C C . VAL B 2 198 ? 10.230 -23.386 -8.067 1.00 97.62 198 B 1 ATOM 2750 O O . VAL B 2 198 ? 9.759 -23.416 -9.203 1.00 96.65 198 B 1 ATOM 2751 C CB . VAL B 2 198 ? 11.782 -25.386 -7.918 1.00 96.41 198 B 1 ATOM 2752 C CG1 . VAL B 2 198 ? 13.002 -24.462 -8.047 1.00 92.38 198 B 1 ATOM 2753 C CG2 . VAL B 2 198 ? 12.212 -26.583 -7.058 1.00 92.80 198 B 1 ATOM 2754 N N . ILE B 2 199 ? 10.571 -22.254 -7.483 1.00 97.88 199 B 1 ATOM 2755 C CA . ILE B 2 199 ? 10.662 -20.966 -8.175 1.00 97.90 199 B 1 ATOM 2756 C C . ILE B 2 199 ? 12.142 -20.604 -8.296 1.00 97.74 199 B 1 ATOM 2757 O O . ILE B 2 199 ? 12.862 -20.557 -7.295 1.00 97.13 199 B 1 ATOM 2758 C CB . ILE B 2 199 ? 9.844 -19.875 -7.451 1.00 97.89 199 B 1 ATOM 2759 C CG1 . ILE B 2 199 ? 8.336 -20.234 -7.431 1.00 97.04 199 B 1 ATOM 2760 C CG2 . ILE B 2 199 ? 10.071 -18.510 -8.125 1.00 96.96 199 B 1 ATOM 2761 C CD1 . ILE B 2 199 ? 7.486 -19.313 -6.543 1.00 96.14 199 B 1 ATOM 2762 N N . PHE B 2 200 ? 12.610 -20.333 -9.506 1.00 97.05 200 B 1 ATOM 2763 C CA . PHE B 2 200 ? 13.985 -19.895 -9.749 1.00 96.66 200 B 1 ATOM 2764 C C . PHE B 2 200 ? 13.997 -18.500 -10.368 1.00 96.58 200 B 1 ATOM 2765 O O . PHE B 2 200 ? 13.969 -18.343 -11.588 1.00 95.11 200 B 1 ATOM 2766 C CB . PHE B 2 200 ? 14.740 -20.928 -10.595 1.00 95.67 200 B 1 ATOM 2767 C CG . PHE B 2 200 ? 16.207 -20.581 -10.826 1.00 95.06 200 B 1 ATOM 2768 C CD1 . PHE B 2 200 ? 16.739 -20.559 -12.133 1.00 90.64 200 B 1 ATOM 2769 C CD2 . PHE B 2 200 ? 17.053 -20.286 -9.740 1.00 91.34 200 B 1 ATOM 2770 C CE1 . PHE B 2 200 ? 18.102 -20.268 -12.347 1.00 90.59 200 B 1 ATOM 2771 C CE2 . PHE B 2 200 ? 18.415 -19.982 -9.947 1.00 89.99 200 B 1 ATOM 2772 C CZ . PHE B 2 200 ? 18.939 -19.978 -11.250 1.00 91.17 200 B 1 ATOM 2773 N N . SER B 2 201 ? 14.054 -17.475 -9.522 1.00 97.20 201 B 1 ATOM 2774 C CA . SER B 2 201 ? 14.015 -16.086 -9.978 1.00 97.10 201 B 1 ATOM 2775 C C . SER B 2 201 ? 14.878 -15.142 -9.140 1.00 97.15 201 B 1 ATOM 2776 O O . SER B 2 201 ? 15.424 -15.490 -8.083 1.00 96.57 201 B 1 ATOM 2777 C CB . SER B 2 201 ? 12.568 -15.604 -10.095 1.00 96.23 201 B 1 ATOM 2778 O OG . SER B 2 201 ? 11.943 -15.435 -8.849 1.00 93.73 201 B 1 ATOM 2779 N N . GLU B 2 202 ? 15.072 -13.948 -9.672 1.00 96.60 202 B 1 ATOM 2780 C CA . GLU B 2 202 ? 15.906 -12.931 -9.047 1.00 96.30 202 B 1 ATOM 2781 C C . GLU B 2 202 ? 15.225 -12.313 -7.826 1.00 96.22 202 B 1 ATOM 2782 O O . GLU B 2 202 ? 14.014 -12.104 -7.772 1.00 95.15 202 B 1 ATOM 2783 C CB . GLU B 2 202 ? 16.311 -11.848 -10.057 1.00 95.43 202 B 1 ATOM 2784 C CG . GLU B 2 202 ? 17.230 -12.421 -11.145 1.00 89.84 202 B 1 ATOM 2785 C CD . GLU B 2 202 ? 17.773 -11.370 -12.122 1.00 87.89 202 B 1 ATOM 2786 O OE1 . GLU B 2 202 ? 18.280 -11.803 -13.183 1.00 80.36 202 B 1 ATOM 2787 O OE2 . GLU B 2 202 ? 17.741 -10.166 -11.791 1.00 81.63 202 B 1 ATOM 2788 N N . ARG B 2 203 ? 16.044 -11.960 -6.840 1.00 95.69 203 B 1 ATOM 2789 C CA . ARG B 2 203 ? 15.582 -11.151 -5.722 1.00 94.46 203 B 1 ATOM 2790 C C . ARG B 2 203 ? 15.281 -9.736 -6.216 1.00 94.56 203 B 1 ATOM 2791 O O . ARG B 2 203 ? 16.139 -9.089 -6.800 1.00 92.55 203 B 1 ATOM 2792 C CB . ARG B 2 203 ? 16.634 -11.169 -4.601 1.00 92.04 203 B 1 ATOM 2793 C CG . ARG B 2 203 ? 16.131 -10.426 -3.357 1.00 82.88 203 B 1 ATOM 2794 C CD . ARG B 2 203 ? 17.187 -10.430 -2.257 1.00 79.88 203 B 1 ATOM 2795 N NE . ARG B 2 203 ? 16.733 -9.636 -1.102 1.00 71.00 203 B 1 ATOM 2796 C CZ . ARG B 2 203 ? 17.451 -9.278 -0.053 1.00 64.44 203 B 1 ATOM 2797 N NH1 . ARG B 2 203 ? 18.691 -9.640 0.085 1.00 59.08 203 B 1 ATOM 2798 N NH2 . ARG B 2 203 ? 16.918 -8.540 0.876 1.00 57.17 203 B 1 ATOM 2799 N N . ARG B 2 204 ? 14.093 -9.243 -5.887 1.00 94.74 204 B 1 ATOM 2800 C CA . ARG B 2 204 ? 13.652 -7.857 -6.127 1.00 93.24 204 B 1 ATOM 2801 C C . ARG B 2 204 ? 13.892 -7.000 -4.873 1.00 92.34 204 B 1 ATOM 2802 O O . ARG B 2 204 ? 15.019 -6.961 -4.343 1.00 87.12 204 B 1 ATOM 2803 C CB . ARG B 2 204 ? 12.198 -7.881 -6.650 1.00 91.13 204 B 1 ATOM 2804 C CG . ARG B 2 204 ? 12.047 -8.635 -7.992 1.00 89.07 204 B 1 ATOM 2805 C CD . ARG B 2 204 ? 10.611 -8.562 -8.539 1.00 86.85 204 B 1 ATOM 2806 N NE . ARG B 2 204 ? 9.647 -9.340 -7.730 1.00 83.84 204 B 1 ATOM 2807 C CZ . ARG B 2 204 ? 8.326 -9.272 -7.800 1.00 82.72 204 B 1 ATOM 2808 N NH1 . ARG B 2 204 ? 7.706 -8.469 -8.619 1.00 72.16 204 B 1 ATOM 2809 N NH2 . ARG B 2 204 ? 7.582 -10.033 -7.050 1.00 75.97 204 B 1 ATOM 2810 N N . GLY B 2 205 ? 12.866 -6.329 -4.383 1.00 93.13 205 B 1 ATOM 2811 C CA . GLY B 2 205 ? 12.945 -5.511 -3.175 1.00 92.32 205 B 1 ATOM 2812 C C . GLY B 2 205 ? 13.319 -6.285 -1.901 1.00 93.58 205 B 1 ATOM 2813 O O . GLY B 2 205 ? 13.374 -7.518 -1.862 1.00 91.70 205 B 1 ATOM 2814 N N . GLN B 2 206 ? 13.562 -5.555 -0.818 1.00 90.70 206 B 1 ATOM 2815 C CA . GLN B 2 206 ? 13.834 -6.163 0.484 1.00 90.42 206 B 1 ATOM 2816 C C . GLN B 2 206 ? 12.635 -7.002 0.940 1.00 91.56 206 B 1 ATOM 2817 O O . GLN B 2 206 ? 11.512 -6.512 0.956 1.00 88.96 206 B 1 ATOM 2818 C CB . GLN B 2 206 ? 14.169 -5.071 1.501 1.00 87.44 206 B 1 ATOM 2819 C CG . GLN B 2 206 ? 14.479 -5.652 2.895 1.00 78.69 206 B 1 ATOM 2820 C CD . GLN B 2 206 ? 14.854 -4.568 3.907 1.00 71.92 206 B 1 ATOM 2821 O OE1 . GLN B 2 206 ? 15.001 -3.406 3.577 1.00 66.65 206 B 1 ATOM 2822 N NE2 . GLN B 2 206 ? 15.020 -4.912 5.163 1.00 62.64 206 B 1 ATOM 2823 N N . SER B 2 207 ? 12.899 -8.255 1.315 1.00 92.33 207 B 1 ATOM 2824 C CA . SER B 2 207 ? 11.879 -9.228 1.743 1.00 92.94 207 B 1 ATOM 2825 C C . SER B 2 207 ? 10.759 -9.484 0.724 1.00 94.52 207 B 1 ATOM 2826 O O . SER B 2 207 ? 9.820 -10.209 1.030 1.00 92.88 207 B 1 ATOM 2827 C CB . SER B 2 207 ? 11.321 -8.876 3.131 1.00 90.26 207 B 1 ATOM 2828 O OG . SER B 2 207 ? 12.385 -8.735 4.056 1.00 80.46 207 B 1 ATOM 2829 N N . GLN B 2 208 ? 10.855 -8.941 -0.491 1.00 95.30 208 B 1 ATOM 2830 C CA . GLN B 2 208 ? 9.853 -9.132 -1.535 1.00 96.24 208 B 1 ATOM 2831 C C . GLN B 2 208 ? 9.907 -10.562 -2.064 1.00 96.83 208 B 1 ATOM 2832 O O . GLN B 2 208 ? 10.958 -11.019 -2.526 1.00 96.33 208 B 1 ATOM 2833 C CB . GLN B 2 208 ? 10.058 -8.101 -2.648 1.00 95.65 208 B 1 ATOM 2834 C CG . GLN B 2 208 ? 8.918 -8.122 -3.673 1.00 93.06 208 B 1 ATOM 2835 C CD . GLN B 2 208 ? 9.054 -7.041 -4.741 1.00 91.42 208 B 1 ATOM 2836 O OE1 . GLN B 2 208 ? 10.073 -6.391 -4.897 1.00 85.50 208 B 1 ATOM 2837 N NE2 . GLN B 2 208 ? 8.026 -6.817 -5.530 1.00 83.05 208 B 1 ATOM 2838 N N . LYS B 2 209 ? 8.757 -11.246 -2.011 1.00 97.42 209 B 1 ATOM 2839 C CA . LYS B 2 209 ? 8.586 -12.593 -2.552 1.00 97.53 209 B 1 ATOM 2840 C C . LYS B 2 209 ? 8.471 -12.554 -4.079 1.00 97.57 209 B 1 ATOM 2841 O O . LYS B 2 209 ? 8.202 -11.486 -4.648 1.00 96.85 209 B 1 ATOM 2842 C CB . LYS B 2 209 ? 7.402 -13.274 -1.851 1.00 96.81 209 B 1 ATOM 2843 C CG . LYS B 2 209 ? 7.622 -13.451 -0.330 1.00 95.16 209 B 1 ATOM 2844 C CD . LYS B 2 209 ? 8.896 -14.247 0.010 1.00 92.47 209 B 1 ATOM 2845 C CE . LYS B 2 209 ? 9.041 -14.515 1.510 1.00 90.82 209 B 1 ATOM 2846 N NZ . LYS B 2 209 ? 9.466 -13.312 2.261 1.00 86.30 209 B 1 ATOM 2847 N N . PRO B 2 210 ? 8.773 -13.672 -4.758 1.00 98.16 210 B 1 ATOM 2848 C CA . PRO B 2 210 ? 8.755 -13.730 -6.214 1.00 98.12 210 B 1 ATOM 2849 C C . PRO B 2 210 ? 7.326 -13.597 -6.758 1.00 98.17 210 B 1 ATOM 2850 O O . PRO B 2 210 ? 6.376 -14.036 -6.121 1.00 97.51 210 B 1 ATOM 2851 C CB . PRO B 2 210 ? 9.400 -15.069 -6.567 1.00 97.53 210 B 1 ATOM 2852 C CG . PRO B 2 210 ? 9.043 -15.951 -5.374 1.00 96.28 210 B 1 ATOM 2853 C CD . PRO B 2 210 ? 9.115 -14.974 -4.204 1.00 97.71 210 B 1 ATOM 2854 N N . GLU B 2 211 ? 7.195 -13.011 -7.944 1.00 97.82 211 B 1 ATOM 2855 C CA . GLU B 2 211 ? 5.904 -12.816 -8.617 1.00 97.63 211 B 1 ATOM 2856 C C . GLU B 2 211 ? 5.239 -14.146 -9.000 1.00 97.92 211 B 1 ATOM 2857 O O . GLU B 2 211 ? 4.024 -14.275 -9.011 1.00 97.29 211 B 1 ATOM 2858 C CB . GLU B 2 211 ? 6.163 -11.973 -9.880 1.00 96.60 211 B 1 ATOM 2859 C CG . GLU B 2 211 ? 4.874 -11.465 -10.550 1.00 90.94 211 B 1 ATOM 2860 C CD . GLU B 2 211 ? 4.088 -10.513 -9.627 1.00 90.78 211 B 1 ATOM 2861 O OE1 . GLU B 2 211 ? 2.864 -10.429 -9.802 1.00 82.92 211 B 1 ATOM 2862 O OE2 . GLU B 2 211 ? 4.727 -9.858 -8.754 1.00 84.55 211 B 1 ATOM 2863 N N . GLU B 2 212 ? 6.057 -15.154 -9.275 1.00 97.51 212 B 1 ATOM 2864 C CA . GLU B 2 212 ? 5.640 -16.483 -9.713 1.00 97.53 212 B 1 ATOM 2865 C C . GLU B 2 212 ? 4.692 -17.149 -8.710 1.00 97.88 212 B 1 ATOM 2866 O O . GLU B 2 212 ? 3.850 -17.943 -9.114 1.00 97.36 212 B 1 ATOM 2867 C CB . GLU B 2 212 ? 6.890 -17.354 -9.942 1.00 97.08 212 B 1 ATOM 2868 C CG . GLU B 2 212 ? 7.836 -16.863 -11.063 1.00 94.37 212 B 1 ATOM 2869 C CD . GLU B 2 212 ? 8.933 -15.873 -10.607 1.00 93.94 212 B 1 ATOM 2870 O OE1 . GLU B 2 212 ? 9.992 -15.820 -11.261 1.00 86.06 212 B 1 ATOM 2871 O OE2 . GLU B 2 212 ? 8.776 -15.167 -9.584 1.00 88.25 212 B 1 ATOM 2872 N N . ILE B 2 213 ? 4.749 -16.781 -7.420 1.00 98.18 213 B 1 ATOM 2873 C CA . ILE B 2 213 ? 3.864 -17.369 -6.412 1.00 98.35 213 B 1 ATOM 2874 C C . ILE B 2 213 ? 2.387 -17.070 -6.702 1.00 98.41 213 B 1 ATOM 2875 O O . ILE B 2 213 ? 1.547 -17.958 -6.571 1.00 98.22 213 B 1 ATOM 2876 C CB . ILE B 2 213 ? 4.281 -16.935 -4.988 1.00 98.16 213 B 1 ATOM 2877 C CG1 . ILE B 2 213 ? 3.675 -17.831 -3.886 1.00 96.76 213 B 1 ATOM 2878 C CG2 . ILE B 2 213 ? 3.930 -15.469 -4.683 1.00 97.34 213 B 1 ATOM 2879 C CD1 . ILE B 2 213 ? 4.141 -19.287 -3.960 1.00 95.54 213 B 1 ATOM 2880 N N . TYR B 2 214 ? 2.072 -15.860 -7.175 1.00 98.48 214 B 1 ATOM 2881 C CA . TYR B 2 214 ? 0.708 -15.475 -7.542 1.00 98.43 214 B 1 ATOM 2882 C C . TYR B 2 214 ? 0.233 -16.241 -8.779 1.00 98.24 214 B 1 ATOM 2883 O O . TYR B 2 214 ? -0.919 -16.664 -8.858 1.00 97.63 214 B 1 ATOM 2884 C CB . TYR B 2 214 ? 0.650 -13.966 -7.799 1.00 98.36 214 B 1 ATOM 2885 C CG . TYR B 2 214 ? 1.050 -13.125 -6.605 1.00 98.49 214 B 1 ATOM 2886 C CD1 . TYR B 2 214 ? 0.149 -12.911 -5.544 1.00 97.88 214 B 1 ATOM 2887 C CD2 . TYR B 2 214 ? 2.342 -12.570 -6.539 1.00 97.92 214 B 1 ATOM 2888 C CE1 . TYR B 2 214 ? 0.533 -12.154 -4.422 1.00 97.70 214 B 1 ATOM 2889 C CE2 . TYR B 2 214 ? 2.740 -11.814 -5.420 1.00 97.71 214 B 1 ATOM 2890 C CZ . TYR B 2 214 ? 1.831 -11.610 -4.361 1.00 98.07 214 B 1 ATOM 2891 O OH . TYR B 2 214 ? 2.231 -10.893 -3.272 1.00 97.30 214 B 1 ATOM 2892 N N . GLN B 2 215 ? 1.139 -16.485 -9.735 1.00 97.99 215 B 1 ATOM 2893 C CA . GLN B 2 215 ? 0.850 -17.280 -10.929 1.00 97.53 215 B 1 ATOM 2894 C C . GLN B 2 215 ? 0.583 -18.743 -10.563 1.00 97.69 215 B 1 ATOM 2895 O O . GLN B 2 215 ? -0.347 -19.347 -11.096 1.00 97.01 215 B 1 ATOM 2896 C CB . GLN B 2 215 ? 2.020 -17.197 -11.919 1.00 96.77 215 B 1 ATOM 2897 C CG . GLN B 2 215 ? 2.308 -15.761 -12.387 1.00 91.15 215 B 1 ATOM 2898 C CD . GLN B 2 215 ? 3.526 -15.682 -13.314 1.00 85.66 215 B 1 ATOM 2899 O OE1 . GLN B 2 215 ? 4.153 -16.670 -13.666 1.00 78.17 215 B 1 ATOM 2900 N NE2 . GLN B 2 215 ? 3.904 -14.497 -13.740 1.00 74.18 215 B 1 ATOM 2901 N N . TYR B 2 216 ? 1.354 -19.307 -9.639 1.00 97.80 216 B 1 ATOM 2902 C CA . TYR B 2 216 ? 1.169 -20.679 -9.163 1.00 97.76 216 B 1 ATOM 2903 C C . TYR B 2 216 ? -0.164 -20.843 -8.429 1.00 97.81 216 B 1 ATOM 2904 O O . TYR B 2 216 ? -0.901 -21.791 -8.701 1.00 97.29 216 B 1 ATOM 2905 C CB . TYR B 2 216 ? 2.347 -21.079 -8.262 1.00 97.38 216 B 1 ATOM 2906 C CG . TYR B 2 216 ? 3.676 -21.352 -8.947 1.00 95.53 216 B 1 ATOM 2907 C CD1 . TYR B 2 216 ? 3.940 -20.980 -10.285 1.00 91.18 216 B 1 ATOM 2908 C CD2 . TYR B 2 216 ? 4.685 -22.015 -8.209 1.00 91.76 216 B 1 ATOM 2909 C CE1 . TYR B 2 216 ? 5.174 -21.275 -10.891 1.00 90.12 216 B 1 ATOM 2910 C CE2 . TYR B 2 216 ? 5.925 -22.313 -8.806 1.00 90.48 216 B 1 ATOM 2911 C CZ . TYR B 2 216 ? 6.165 -21.948 -10.149 1.00 89.41 216 B 1 ATOM 2912 O OH . TYR B 2 216 ? 7.365 -22.267 -10.731 1.00 85.03 216 B 1 ATOM 2913 N N . ILE B 2 217 ? -0.525 -19.885 -7.574 1.00 98.17 217 B 1 ATOM 2914 C CA . ILE B 2 217 ? -1.814 -19.878 -6.879 1.00 98.20 217 B 1 ATOM 2915 C C . ILE B 2 217 ? -2.974 -19.751 -7.875 1.00 97.95 217 B 1 ATOM 2916 O O . ILE B 2 217 ? -3.961 -20.477 -7.762 1.00 97.48 217 B 1 ATOM 2917 C CB . ILE B 2 217 ? -1.817 -18.779 -5.797 1.00 98.29 217 B 1 ATOM 2918 C CG1 . ILE B 2 217 ? -0.887 -19.223 -4.639 1.00 97.77 217 B 1 ATOM 2919 C CG2 . ILE B 2 217 ? -3.238 -18.500 -5.279 1.00 97.95 217 B 1 ATOM 2920 C CD1 . ILE B 2 217 ? -0.536 -18.103 -3.654 1.00 96.78 217 B 1 ATOM 2921 N N . ASN B 2 218 ? -2.846 -18.907 -8.898 1.00 97.88 218 B 1 ATOM 2922 C CA . ASN B 2 218 ? -3.855 -18.797 -9.952 1.00 97.37 218 B 1 ATOM 2923 C C . ASN B 2 218 ? -3.993 -20.092 -10.774 1.00 97.37 218 B 1 ATOM 2924 O O . ASN B 2 218 ? -5.100 -20.477 -11.153 1.00 96.69 218 B 1 ATOM 2925 C CB . ASN B 2 218 ? -3.497 -17.595 -10.838 1.00 96.34 218 B 1 ATOM 2926 C CG . ASN B 2 218 ? -4.587 -17.270 -11.847 1.00 87.73 218 B 1 ATOM 2927 O OD1 . ASN B 2 218 ? -5.761 -17.518 -11.659 1.00 77.46 218 B 1 ATOM 2928 N ND2 . ASN B 2 218 ? -4.228 -16.680 -12.964 1.00 75.03 218 B 1 ATOM 2929 N N . GLN B 2 219 ? -2.898 -20.818 -11.027 1.00 97.57 219 B 1 ATOM 2930 C CA . GLN B 2 219 ? -2.948 -22.139 -11.668 1.00 97.36 219 B 1 ATOM 2931 C C . GLN B 2 219 ? -3.588 -23.197 -10.762 1.00 97.40 219 B 1 ATOM 2932 O O . GLN B 2 219 ? -4.342 -24.041 -11.251 1.00 96.59 219 B 1 ATOM 2933 C CB . GLN B 2 219 ? -1.534 -22.588 -12.065 1.00 97.00 219 B 1 ATOM 2934 C CG . GLN B 2 219 ? -0.958 -21.799 -13.251 1.00 93.22 219 B 1 ATOM 2935 C CD . GLN B 2 219 ? 0.504 -22.181 -13.508 1.00 90.17 219 B 1 ATOM 2936 O OE1 . GLN B 2 219 ? 0.882 -23.346 -13.527 1.00 81.82 219 B 1 ATOM 2937 N NE2 . GLN B 2 219 ? 1.377 -21.225 -13.715 1.00 78.46 219 B 1 ATOM 2938 N N . LEU B 2 220 ? -3.324 -23.132 -9.455 1.00 97.61 220 B 1 ATOM 2939 C CA . LEU B 2 220 ? -3.890 -24.045 -8.459 1.00 97.52 220 B 1 ATOM 2940 C C . LEU B 2 220 ? -5.400 -23.843 -8.297 1.00 97.48 220 B 1 ATOM 2941 O O . LEU B 2 220 ? -6.152 -24.818 -8.244 1.00 96.81 220 B 1 ATOM 2942 C CB . LEU B 2 220 ? -3.144 -23.833 -7.130 1.00 97.46 220 B 1 ATOM 2943 C CG . LEU B 2 220 ? -3.636 -24.723 -5.968 1.00 97.03 220 B 1 ATOM 2944 C CD1 . LEU B 2 220 ? -3.398 -26.209 -6.239 1.00 95.69 220 B 1 ATOM 2945 C CD2 . LEU B 2 220 ? -2.899 -24.336 -4.685 1.00 95.51 220 B 1 ATOM 2946 N N . CYS B 2 221 ? -5.852 -22.593 -8.233 1.00 97.41 221 B 1 ATOM 2947 C CA . CYS B 2 221 ? -7.257 -22.239 -8.065 1.00 97.23 221 B 1 ATOM 2948 C C . CYS B 2 221 ? -7.658 -21.094 -9.012 1.00 97.14 221 B 1 ATOM 2949 O O . CYS B 2 221 ? -7.726 -19.934 -8.592 1.00 96.42 221 B 1 ATOM 2950 C CB . CYS B 2 221 ? -7.504 -21.916 -6.585 1.00 96.95 221 B 1 ATOM 2951 S SG . CYS B 2 221 ? -9.287 -21.750 -6.281 1.00 95.70 221 B 1 ATOM 2952 N N . PRO B 2 222 ? -7.939 -21.392 -10.295 1.00 96.93 222 B 1 ATOM 2953 C CA . PRO B 2 222 ? -8.368 -20.369 -11.245 1.00 96.08 222 B 1 ATOM 2954 C C . PRO B 2 222 ? -9.667 -19.693 -10.795 1.00 95.36 222 B 1 ATOM 2955 O O . PRO B 2 222 ? -10.612 -20.366 -10.392 1.00 92.42 222 B 1 ATOM 2956 C CB . PRO B 2 222 ? -8.542 -21.096 -12.585 1.00 95.01 222 B 1 ATOM 2957 C CG . PRO B 2 222 ? -7.670 -22.343 -12.442 1.00 93.80 222 B 1 ATOM 2958 C CD . PRO B 2 222 ? -7.799 -22.678 -10.963 1.00 96.31 222 B 1 ATOM 2959 N N . ASN B 2 223 ? -9.727 -18.362 -10.906 1.00 95.93 223 B 1 ATOM 2960 C CA . ASN B 2 223 ? -10.873 -17.552 -10.472 1.00 95.60 223 B 1 ATOM 2961 C C . ASN B 2 223 ? -11.248 -17.762 -8.991 1.00 96.12 223 B 1 ATOM 2962 O O . ASN B 2 223 ? -12.416 -17.645 -8.613 1.00 94.08 223 B 1 ATOM 2963 C CB . ASN B 2 223 ? -12.064 -17.763 -11.423 1.00 93.78 223 B 1 ATOM 2964 C CG . ASN B 2 223 ? -11.713 -17.538 -12.882 1.00 90.33 223 B 1 ATOM 2965 O OD1 . ASN B 2 223 ? -11.047 -16.595 -13.261 1.00 80.67 223 B 1 ATOM 2966 N ND2 . ASN B 2 223 ? -12.155 -18.416 -13.760 1.00 78.61 223 B 1 ATOM 2967 N N . GLY B 2 224 ? -10.264 -18.103 -8.159 1.00 96.16 224 B 1 ATOM 2968 C CA . GLY B 2 224 ? -10.444 -18.273 -6.727 1.00 96.62 224 B 1 ATOM 2969 C C . GLY B 2 224 ? -10.590 -16.958 -5.966 1.00 97.25 224 B 1 ATOM 2970 O O . GLY B 2 224 ? -10.331 -15.867 -6.482 1.00 96.41 224 B 1 ATOM 2971 N N . ASN B 2 225 ? -10.987 -17.086 -4.709 1.00 97.45 225 B 1 ATOM 2972 C CA . ASN B 2 225 ? -10.898 -16.004 -3.735 1.00 97.92 225 B 1 ATOM 2973 C C . ASN B 2 225 ? -9.597 -16.147 -2.944 1.00 98.28 225 B 1 ATOM 2974 O O . ASN B 2 225 ? -9.392 -17.161 -2.269 1.00 97.79 225 B 1 ATOM 2975 C CB . ASN B 2 225 ? -12.123 -16.027 -2.817 1.00 97.54 225 B 1 ATOM 2976 C CG . ASN B 2 225 ? -13.378 -15.587 -3.547 1.00 96.85 225 B 1 ATOM 2977 O OD1 . ASN B 2 225 ? -14.158 -16.382 -4.027 1.00 87.51 225 B 1 ATOM 2978 N ND2 . ASN B 2 225 ? -13.619 -14.297 -3.642 1.00 87.14 225 B 1 ATOM 2979 N N . TYR B 2 226 ? -8.745 -15.139 -3.015 1.00 98.41 226 B 1 ATOM 2980 C CA . TYR B 2 226 ? -7.411 -15.170 -2.427 1.00 98.55 226 B 1 ATOM 2981 C C . TYR B 2 226 ? -7.287 -14.134 -1.309 1.00 98.66 226 B 1 ATOM 2982 O O . TYR B 2 226 ? -7.755 -13.002 -1.437 1.00 98.31 226 B 1 ATOM 2983 C CB . TYR B 2 226 ? -6.355 -14.940 -3.513 1.00 98.31 226 B 1 ATOM 2984 C CG . TYR B 2 226 ? -6.572 -15.660 -4.830 1.00 98.24 226 B 1 ATOM 2985 C CD1 . TYR B 2 226 ? -6.690 -17.065 -4.883 1.00 96.95 226 B 1 ATOM 2986 C CD2 . TYR B 2 226 ? -6.652 -14.916 -6.025 1.00 96.85 226 B 1 ATOM 2987 C CE1 . TYR B 2 226 ? -6.874 -17.721 -6.115 1.00 96.19 226 B 1 ATOM 2988 C CE2 . TYR B 2 226 ? -6.830 -15.563 -7.260 1.00 96.26 226 B 1 ATOM 2989 C CZ . TYR B 2 226 ? -6.937 -16.967 -7.304 1.00 96.71 226 B 1 ATOM 2990 O OH . TYR B 2 226 ? -7.099 -17.589 -8.512 1.00 95.26 226 B 1 ATOM 2991 N N . LEU B 2 227 ? -6.627 -14.512 -0.230 1.00 98.72 227 B 1 ATOM 2992 C CA . LEU B 2 227 ? -6.296 -13.627 0.883 1.00 98.83 227 B 1 ATOM 2993 C C . LEU B 2 227 ? -4.788 -13.634 1.115 1.00 98.88 227 B 1 ATOM 2994 O O . LEU B 2 227 ? -4.204 -14.689 1.351 1.00 98.76 227 B 1 ATOM 2995 C CB . LEU B 2 227 ? -7.074 -14.086 2.128 1.00 98.71 227 B 1 ATOM 2996 C CG . LEU B 2 227 ? -6.726 -13.327 3.428 1.00 98.37 227 B 1 ATOM 2997 C CD1 . LEU B 2 227 ? -7.148 -11.860 3.371 1.00 97.58 227 B 1 ATOM 2998 C CD2 . LEU B 2 227 ? -7.447 -13.974 4.609 1.00 97.41 227 B 1 ATOM 2999 N N . GLU B 2 228 ? -4.169 -12.467 1.135 1.00 98.86 228 B 1 ATOM 3000 C CA . GLU B 2 228 ? -2.787 -12.303 1.573 1.00 98.86 228 B 1 ATOM 3001 C C . GLU B 2 228 ? -2.733 -11.536 2.894 1.00 98.86 228 B 1 ATOM 3002 O O . GLU B 2 228 ? -3.287 -10.445 3.033 1.00 98.59 228 B 1 ATOM 3003 C CB . GLU B 2 228 ? -1.941 -11.644 0.474 1.00 98.71 228 B 1 ATOM 3004 C CG . GLU B 2 228 ? -0.459 -11.572 0.882 1.00 98.17 228 B 1 ATOM 3005 C CD . GLU B 2 228 ? 0.483 -11.147 -0.251 1.00 98.04 228 B 1 ATOM 3006 O OE1 . GLU B 2 228 ? 1.717 -11.199 -0.032 1.00 95.12 228 B 1 ATOM 3007 O OE2 . GLU B 2 228 ? 0.012 -10.768 -1.346 1.00 96.15 228 B 1 ATOM 3008 N N . ILE B 2 229 ? -2.034 -12.090 3.866 1.00 98.80 229 B 1 ATOM 3009 C CA . ILE B 2 229 ? -1.791 -11.460 5.163 1.00 98.78 229 B 1 ATOM 3010 C C . ILE B 2 229 ? -0.325 -11.030 5.236 1.00 98.72 229 B 1 ATOM 3011 O O . ILE B 2 229 ? 0.570 -11.765 4.823 1.00 98.32 229 B 1 ATOM 3012 C CB . ILE B 2 229 ? -2.215 -12.381 6.329 1.00 98.65 229 B 1 ATOM 3013 C CG1 . ILE B 2 229 ? -3.648 -12.927 6.117 1.00 98.00 229 B 1 ATOM 3014 C CG2 . ILE B 2 229 ? -2.120 -11.605 7.655 1.00 98.15 229 B 1 ATOM 3015 C CD1 . ILE B 2 229 ? -4.132 -13.875 7.220 1.00 96.42 229 B 1 ATOM 3016 N N . PHE B 2 230 ? -0.081 -9.843 5.785 1.00 98.58 230 B 1 ATOM 3017 C CA . PHE B 2 230 ? 1.223 -9.175 5.810 1.00 98.42 230 B 1 ATOM 3018 C C . PHE B 2 230 ? 1.677 -8.660 4.439 1.00 98.07 230 B 1 ATOM 3019 O O . PHE B 2 230 ? 2.874 -8.596 4.138 1.00 97.05 230 B 1 ATOM 3020 C CB . PHE B 2 230 ? 2.271 -10.036 6.531 1.00 98.30 230 B 1 ATOM 3021 C CG . PHE B 2 230 ? 1.819 -10.587 7.866 1.00 98.40 230 B 1 ATOM 3022 C CD1 . PHE B 2 230 ? 1.547 -9.708 8.929 1.00 97.98 230 B 1 ATOM 3023 C CD2 . PHE B 2 230 ? 1.655 -11.972 8.048 1.00 98.01 230 B 1 ATOM 3024 C CE1 . PHE B 2 230 ? 1.132 -10.209 10.172 1.00 97.77 230 B 1 ATOM 3025 C CE2 . PHE B 2 230 ? 1.246 -12.478 9.296 1.00 97.72 230 B 1 ATOM 3026 C CZ . PHE B 2 230 ? 0.986 -11.596 10.357 1.00 97.84 230 B 1 ATOM 3027 N N . ALA B 2 231 ? 0.710 -8.253 3.631 1.00 98.28 231 B 1 ATOM 3028 C CA . ALA B 2 231 ? 0.962 -7.644 2.338 1.00 98.11 231 B 1 ATOM 3029 C C . ALA B 2 231 ? 1.552 -6.230 2.466 1.00 97.62 231 B 1 ATOM 3030 O O . ALA B 2 231 ? 1.261 -5.462 3.389 1.00 96.33 231 B 1 ATOM 3031 C CB . ALA B 2 231 ? -0.341 -7.629 1.538 1.00 97.89 231 B 1 ATOM 3032 N N . ARG B 2 232 ? 2.332 -5.871 1.456 1.00 97.42 232 B 1 ATOM 3033 C CA . ARG B 2 232 ? 2.759 -4.503 1.161 1.00 97.08 232 B 1 ATOM 3034 C C . ARG B 2 232 ? 2.157 -4.066 -0.171 1.00 97.34 232 B 1 ATOM 3035 O O . ARG B 2 232 ? 1.607 -4.885 -0.902 1.00 96.78 232 B 1 ATOM 3036 C CB . ARG B 2 232 ? 4.291 -4.436 1.141 1.00 95.74 232 B 1 ATOM 3037 C CG . ARG B 2 232 ? 4.919 -4.872 2.479 1.00 93.30 232 B 1 ATOM 3038 C CD . ARG B 2 232 ? 6.440 -4.708 2.455 1.00 90.98 232 B 1 ATOM 3039 N NE . ARG B 2 232 ? 7.039 -5.504 1.375 1.00 86.72 232 B 1 ATOM 3040 C CZ . ARG B 2 232 ? 8.317 -5.816 1.233 1.00 85.98 232 B 1 ATOM 3041 N NH1 . ARG B 2 232 ? 9.216 -5.448 2.101 1.00 78.27 232 B 1 ATOM 3042 N NH2 . ARG B 2 232 ? 8.699 -6.508 0.207 1.00 79.19 232 B 1 ATOM 3043 N N . ARG B 2 233 ? 2.330 -2.806 -0.533 1.00 97.00 233 B 1 ATOM 3044 C CA . ARG B 2 233 ? 1.790 -2.269 -1.800 1.00 96.77 233 B 1 ATOM 3045 C C . ARG B 2 233 ? 2.221 -3.059 -3.047 1.00 97.03 233 B 1 ATOM 3046 O O . ARG B 2 233 ? 1.451 -3.179 -3.983 1.00 95.91 233 B 1 ATOM 3047 C CB . ARG B 2 233 ? 2.185 -0.799 -1.961 1.00 95.80 233 B 1 ATOM 3048 C CG . ARG B 2 233 ? 1.480 0.094 -0.928 1.00 94.42 233 B 1 ATOM 3049 C CD . ARG B 2 233 ? 1.807 1.558 -1.200 1.00 92.92 233 B 1 ATOM 3050 N NE . ARG B 2 233 ? 1.060 2.431 -0.273 1.00 91.81 233 B 1 ATOM 3051 C CZ . ARG B 2 233 ? 0.946 3.740 -0.365 1.00 91.44 233 B 1 ATOM 3052 N NH1 . ARG B 2 233 ? 1.569 4.441 -1.272 1.00 87.93 233 B 1 ATOM 3053 N NH2 . ARG B 2 233 ? 0.176 4.373 0.464 1.00 87.63 233 B 1 ATOM 3054 N N . ASN B 2 234 ? 3.435 -3.611 -3.057 1.00 96.90 234 B 1 ATOM 3055 C CA . ASN B 2 234 ? 3.921 -4.442 -4.164 1.00 96.77 234 B 1 ATOM 3056 C C . ASN B 2 234 ? 3.302 -5.853 -4.211 1.00 97.50 234 B 1 ATOM 3057 O O . ASN B 2 234 ? 3.584 -6.584 -5.157 1.00 97.05 234 B 1 ATOM 3058 C CB . ASN B 2 234 ? 5.460 -4.520 -4.097 1.00 95.72 234 B 1 ATOM 3059 C CG . ASN B 2 234 ? 5.936 -5.228 -2.836 1.00 94.08 234 B 1 ATOM 3060 O OD1 . ASN B 2 234 ? 6.287 -4.600 -1.843 1.00 87.02 234 B 1 ATOM 3061 N ND2 . ASN B 2 234 ? 5.971 -6.541 -2.823 1.00 86.98 234 B 1 ATOM 3062 N N . ASN B 2 235 ? 2.531 -6.242 -3.198 1.00 97.77 235 B 1 ATOM 3063 C CA . ASN B 2 235 ? 1.811 -7.510 -3.150 1.00 98.10 235 B 1 ATOM 3064 C C . ASN B 2 235 ? 0.356 -7.372 -3.612 1.00 98.36 235 B 1 ATOM 3065 O O . ASN B 2 235 ? -0.338 -8.373 -3.723 1.00 97.97 235 B 1 ATOM 3066 C CB . ASN B 2 235 ? 1.861 -8.074 -1.720 1.00 97.87 235 B 1 ATOM 3067 C CG . ASN B 2 235 ? 3.273 -8.332 -1.223 1.00 97.49 235 B 1 ATOM 3068 O OD1 . ASN B 2 235 ? 3.791 -7.665 -0.334 1.00 90.34 235 B 1 ATOM 3069 N ND2 . ASN B 2 235 ? 3.937 -9.315 -1.780 1.00 90.17 235 B 1 ATOM 3070 N N . LEU B 2 236 ? -0.118 -6.155 -3.854 1.00 98.28 236 B 1 ATOM 3071 C CA . LEU B 2 236 ? -1.489 -5.935 -4.294 1.00 98.32 236 B 1 ATOM 3072 C C . LEU B 2 236 ? -1.667 -6.487 -5.713 1.00 98.30 236 B 1 ATOM 3073 O O . LEU B 2 236 ? -0.981 -6.056 -6.636 1.00 97.66 236 B 1 ATOM 3074 C CB . LEU B 2 236 ? -1.845 -4.443 -4.199 1.00 98.08 236 B 1 ATOM 3075 C CG . LEU B 2 236 ? -1.760 -3.862 -2.773 1.00 97.55 236 B 1 ATOM 3076 C CD1 . LEU B 2 236 ? -2.069 -2.368 -2.793 1.00 96.94 236 B 1 ATOM 3077 C CD2 . LEU B 2 236 ? -2.737 -4.534 -1.808 1.00 96.57 236 B 1 ATOM 3078 N N . HIS B 2 237 ? -2.597 -7.437 -5.859 1.00 98.54 237 B 1 ATOM 3079 C CA . HIS B 2 237 ? -2.937 -8.095 -7.118 1.00 98.55 237 B 1 ATOM 3080 C C . HIS B 2 237 ? -4.455 -8.102 -7.306 1.00 98.56 237 B 1 ATOM 3081 O O . HIS B 2 237 ? -5.215 -8.023 -6.332 1.00 98.09 237 B 1 ATOM 3082 C CB . HIS B 2 237 ? -2.378 -9.526 -7.142 1.00 98.30 237 B 1 ATOM 3083 C CG . HIS B 2 237 ? -0.884 -9.587 -7.292 1.00 97.93 237 B 1 ATOM 3084 N ND1 . HIS B 2 237 ? 0.042 -9.313 -6.295 1.00 87.38 237 B 1 ATOM 3085 C CD2 . HIS B 2 237 ? -0.188 -9.879 -8.432 1.00 89.88 237 B 1 ATOM 3086 C CE1 . HIS B 2 237 ? 1.259 -9.426 -6.834 1.00 91.11 237 B 1 ATOM 3087 N NE2 . HIS B 2 237 ? 1.164 -9.779 -8.120 1.00 93.49 237 B 1 ATOM 3088 N N . ASP B 2 238 ? -4.887 -8.209 -8.557 1.00 97.92 238 B 1 ATOM 3089 C CA . ASP B 2 238 ? -6.304 -8.354 -8.863 1.00 97.65 238 B 1 ATOM 3090 C C . ASP B 2 238 ? -6.895 -9.595 -8.184 1.00 97.58 238 B 1 ATOM 3091 O O . ASP B 2 238 ? -6.295 -10.672 -8.157 1.00 96.48 238 B 1 ATOM 3092 C CB . ASP B 2 238 ? -6.530 -8.408 -10.380 1.00 97.04 238 B 1 ATOM 3093 C CG . ASP B 2 238 ? -6.505 -7.021 -11.034 1.00 96.37 238 B 1 ATOM 3094 O OD1 . ASP B 2 238 ? -6.942 -6.047 -10.377 1.00 93.83 238 B 1 ATOM 3095 O OD2 . ASP B 2 238 ? -6.082 -6.931 -12.205 1.00 93.67 238 B 1 ATOM 3096 N N . ASN B 2 239 ? -8.093 -9.425 -7.636 1.00 97.42 239 B 1 ATOM 3097 C CA . ASN B 2 239 ? -8.875 -10.445 -6.930 1.00 97.19 239 B 1 ATOM 3098 C C . ASN B 2 239 ? -8.297 -10.886 -5.574 1.00 97.67 239 B 1 ATOM 3099 O O . ASN B 2 239 ? -8.874 -11.760 -4.927 1.00 96.63 239 B 1 ATOM 3100 C CB . ASN B 2 239 ? -9.173 -11.630 -7.865 1.00 95.75 239 B 1 ATOM 3101 C CG . ASN B 2 239 ? -9.579 -11.210 -9.273 1.00 93.85 239 B 1 ATOM 3102 O OD1 . ASN B 2 239 ? -10.232 -10.201 -9.502 1.00 86.04 239 B 1 ATOM 3103 N ND2 . ASN B 2 239 ? -9.192 -11.972 -10.269 1.00 84.78 239 B 1 ATOM 3104 N N . TRP B 2 240 ? -7.216 -10.267 -5.113 1.00 98.49 240 B 1 ATOM 3105 C CA . TRP B 2 240 ? -6.636 -10.511 -3.794 1.00 98.69 240 B 1 ATOM 3106 C C . TRP B 2 240 ? -7.171 -9.520 -2.762 1.00 98.70 240 B 1 ATOM 3107 O O . TRP B 2 240 ? -7.055 -8.301 -2.931 1.00 98.37 240 B 1 ATOM 3108 C CB . TRP B 2 240 ? -5.110 -10.472 -3.860 1.00 98.66 240 B 1 ATOM 3109 C CG . TRP B 2 240 ? -4.482 -11.692 -4.465 1.00 98.66 240 B 1 ATOM 3110 C CD1 . TRP B 2 240 ? -4.427 -11.986 -5.784 1.00 98.29 240 B 1 ATOM 3111 C CD2 . TRP B 2 240 ? -3.834 -12.806 -3.771 1.00 98.55 240 B 1 ATOM 3112 N NE1 . TRP B 2 240 ? -3.788 -13.214 -5.959 1.00 98.20 240 B 1 ATOM 3113 C CE2 . TRP B 2 240 ? -3.413 -13.749 -4.746 1.00 98.37 240 B 1 ATOM 3114 C CE3 . TRP B 2 240 ? -3.572 -13.097 -2.415 1.00 98.41 240 B 1 ATOM 3115 C CZ2 . TRP B 2 240 ? -2.757 -14.951 -4.391 1.00 98.04 240 B 1 ATOM 3116 C CZ3 . TRP B 2 240 ? -2.915 -14.291 -2.063 1.00 97.87 240 B 1 ATOM 3117 C CH2 . TRP B 2 240 ? -2.517 -15.205 -3.043 1.00 97.72 240 B 1 ATOM 3118 N N . VAL B 2 241 ? -7.669 -10.045 -1.653 1.00 98.76 241 B 1 ATOM 3119 C CA . VAL B 2 241 ? -7.805 -9.284 -0.409 1.00 98.77 241 B 1 ATOM 3120 C C . VAL B 2 241 ? -6.442 -9.277 0.271 1.00 98.81 241 B 1 ATOM 3121 O O . VAL B 2 241 ? -5.889 -10.335 0.551 1.00 98.64 241 B 1 ATOM 3122 C CB . VAL B 2 241 ? -8.877 -9.879 0.511 1.00 98.60 241 B 1 ATOM 3123 C CG1 . VAL B 2 241 ? -9.020 -9.057 1.796 1.00 97.89 241 B 1 ATOM 3124 C CG2 . VAL B 2 241 ? -10.244 -9.908 -0.180 1.00 97.97 241 B 1 ATOM 3125 N N . SER B 2 242 ? -5.891 -8.108 0.529 1.00 98.76 242 B 1 ATOM 3126 C CA . SER B 2 242 ? -4.525 -7.964 1.030 1.00 98.70 242 B 1 ATOM 3127 C C . SER B 2 242 ? -4.504 -7.138 2.309 1.00 98.63 242 B 1 ATOM 3128 O O . SER B 2 242 ? -4.896 -5.973 2.307 1.00 98.10 242 B 1 ATOM 3129 C CB . SER B 2 242 ? -3.643 -7.325 -0.040 1.00 98.48 242 B 1 ATOM 3130 O OG . SER B 2 242 ? -3.594 -8.122 -1.208 1.00 96.36 242 B 1 ATOM 3131 N N . ILE B 2 243 ? -4.037 -7.722 3.400 1.00 98.64 243 B 1 ATOM 3132 C CA . ILE B 2 243 ? -3.987 -7.089 4.721 1.00 98.64 243 B 1 ATOM 3133 C C . ILE B 2 243 ? -2.538 -6.770 5.073 1.00 98.56 243 B 1 ATOM 3134 O O . ILE B 2 243 ? -1.682 -7.654 5.087 1.00 98.12 243 B 1 ATOM 3135 C CB . ILE B 2 243 ? -4.648 -7.972 5.796 1.00 98.57 243 B 1 ATOM 3136 C CG1 . ILE B 2 243 ? -6.090 -8.380 5.403 1.00 97.99 243 B 1 ATOM 3137 C CG2 . ILE B 2 243 ? -4.642 -7.235 7.149 1.00 98.03 243 B 1 ATOM 3138 C CD1 . ILE B 2 243 ? -6.675 -9.487 6.286 1.00 96.74 243 B 1 ATOM 3139 N N . GLY B 2 244 ? -2.262 -5.529 5.424 1.00 97.82 244 B 1 ATOM 3140 C CA . GLY B 2 244 ? -0.944 -5.133 5.909 1.00 97.56 244 B 1 ATOM 3141 C C . GLY B 2 244 ? -0.976 -3.792 6.628 1.00 97.22 244 B 1 ATOM 3142 O O . GLY B 2 244 ? -1.766 -2.914 6.290 1.00 96.07 244 B 1 ATOM 3143 N N . ASN B 2 245 ? -0.103 -3.612 7.619 1.00 96.69 245 B 1 ATOM 3144 C CA . ASN B 2 245 ? -0.042 -2.358 8.380 1.00 95.85 245 B 1 ATOM 3145 C C . ASN B 2 245 ? 0.671 -1.215 7.636 1.00 95.28 245 B 1 ATOM 3146 O O . ASN B 2 245 ? 0.691 -0.089 8.126 1.00 92.58 245 B 1 ATOM 3147 C CB . ASN B 2 245 ? 0.578 -2.618 9.770 1.00 94.76 245 B 1 ATOM 3148 C CG . ASN B 2 245 ? 2.077 -2.883 9.743 1.00 95.15 245 B 1 ATOM 3149 O OD1 . ASN B 2 245 ? 2.646 -3.294 8.747 1.00 89.90 245 B 1 ATOM 3150 N ND2 . ASN B 2 245 ? 2.767 -2.644 10.842 1.00 89.35 245 B 1 ATOM 3151 N N . GLU B 2 246 ? 1.257 -1.491 6.470 1.00 95.05 246 B 1 ATOM 3152 C CA . GLU B 2 246 ? 2.013 -0.530 5.643 1.00 94.26 246 B 1 ATOM 3153 C C . GLU B 2 246 ? 1.332 -0.169 4.313 1.00 95.26 246 B 1 ATOM 3154 O O . GLU B 2 246 ? 1.931 0.531 3.493 1.00 93.18 246 B 1 ATOM 3155 C CB . GLU B 2 246 ? 3.437 -1.061 5.382 1.00 91.31 246 B 1 ATOM 3156 C CG . GLU B 2 246 ? 4.286 -1.190 6.650 1.00 86.76 246 B 1 ATOM 3157 C CD . GLU B 2 246 ? 5.752 -1.519 6.336 1.00 81.22 246 B 1 ATOM 3158 O OE1 . GLU B 2 246 ? 6.614 -1.147 7.160 1.00 72.61 246 B 1 ATOM 3159 O OE2 . GLU B 2 246 ? 6.037 -2.108 5.259 1.00 72.42 246 B 1 ATOM 3160 N N . LEU B 2 247 ? 0.096 -0.629 4.095 1.00 96.26 247 B 1 ATOM 3161 C CA . LEU B 2 247 ? -0.664 -0.356 2.880 1.00 96.47 247 B 1 ATOM 3162 C C . LEU B 2 247 ? -1.088 1.115 2.766 1.00 95.04 247 B 1 ATOM 3163 O O . LEU B 2 247 ? -1.295 1.795 3.793 1.00 89.99 247 B 1 ATOM 3164 C CB . LEU B 2 247 ? -1.836 -1.348 2.739 1.00 96.16 247 B 1 ATOM 3165 C CG . LEU B 2 247 ? -1.394 -2.804 2.455 1.00 96.88 247 B 1 ATOM 3166 C CD1 . LEU B 2 247 ? -2.614 -3.722 2.415 1.00 95.25 247 B 1 ATOM 3167 C CD2 . LEU B 2 247 ? -0.665 -2.938 1.106 1.00 94.66 247 B 1 ATOM 3168 O OXT . LEU B 2 247 ? -1.181 1.587 1.596 1.00 93.25 247 B 1 HETATM 3169 N N . SAM C 3 . ? 5.543 -10.504 1.222 1.00 95.90 1 C 1 HETATM 3170 C CA . SAM C 3 . ? 6.012 -9.115 1.204 1.00 96.75 1 C 1 HETATM 3171 C C . SAM C 3 . ? 6.686 -8.812 -0.108 1.00 96.57 1 C 1 HETATM 3172 O O . SAM C 3 . ? 6.761 -9.692 -0.969 1.00 94.27 1 C 1 HETATM 3173 O OXT . SAM C 3 . ? 7.099 -7.658 -0.326 1.00 92.27 1 C 1 HETATM 3174 C CB . SAM C 3 . ? 6.928 -8.822 2.382 1.00 95.98 1 C 1 HETATM 3175 C CG . SAM C 3 . ? 6.191 -8.860 3.700 1.00 95.70 1 C 1 HETATM 3176 S SD . SAM C 3 . ? 7.245 -8.373 5.081 1.00 95.80 1 C 1 HETATM 3177 C CE . SAM C 3 . ? 8.170 -9.868 5.367 1.00 94.67 1 C 1 HETATM 3178 C "C5'" . SAM C 3 . ? 6.108 -8.420 6.456 1.00 96.18 1 C 1 HETATM 3179 C "C4'" . SAM C 3 . ? 5.103 -7.284 6.429 1.00 97.06 1 C 1 HETATM 3180 O "O4'" . SAM C 3 . ? 4.252 -7.405 7.570 1.00 97.09 1 C 1 HETATM 3181 C "C3'" . SAM C 3 . ? 5.702 -5.885 6.500 1.00 96.12 1 C 1 HETATM 3182 O "O3'" . SAM C 3 . ? 5.183 -5.117 5.421 1.00 95.15 1 C 1 HETATM 3183 C "C2'" . SAM C 3 . ? 5.217 -5.320 7.824 1.00 96.09 1 C 1 HETATM 3184 O "O2'" . SAM C 3 . ? 4.987 -3.930 7.779 1.00 94.97 1 C 1 HETATM 3185 C "C1'" . SAM C 3 . ? 3.933 -6.089 8.012 1.00 97.10 1 C 1 HETATM 3186 N N9 . SAM C 3 . ? 3.481 -6.138 9.397 1.00 97.30 1 C 1 HETATM 3187 C C8 . SAM C 3 . ? 4.239 -6.150 10.510 1.00 96.88 1 C 1 HETATM 3188 N N7 . SAM C 3 . ? 3.482 -6.194 11.603 1.00 97.03 1 C 1 HETATM 3189 C C5 . SAM C 3 . ? 2.191 -6.196 11.180 1.00 97.52 1 C 1 HETATM 3190 C C6 . SAM C 3 . ? 0.925 -6.210 11.826 1.00 97.61 1 C 1 HETATM 3191 N N6 . SAM C 3 . ? 0.839 -6.233 13.160 1.00 97.09 1 C 1 HETATM 3192 N N1 . SAM C 3 . ? -0.203 -6.197 11.078 1.00 97.40 1 C 1 HETATM 3193 C C2 . SAM C 3 . ? -0.116 -6.166 9.727 1.00 97.46 1 C 1 HETATM 3194 N N3 . SAM C 3 . ? 1.048 -6.140 9.057 1.00 97.50 1 C 1 HETATM 3195 C C4 . SAM C 3 . ? 2.186 -6.161 9.764 1.00 97.50 1 C 1 #