# 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 89.13 _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 37.30 1 1 A LYS 2 2 34.40 1 2 A LYS 3 2 33.03 1 3 A ASN 4 2 34.11 1 4 A GLY 5 2 39.46 1 5 A LYS 6 2 35.40 1 6 A SER 7 2 47.50 1 7 A GLN 8 2 42.53 1 8 A ASN 9 2 55.00 1 9 A GLN 10 2 59.37 1 10 A PRO 11 2 80.59 1 11 A LEU 12 2 91.19 1 12 A ASP 13 2 94.13 1 13 A PHE 14 2 93.44 1 14 A THR 15 2 94.84 1 15 A GLN 16 2 92.14 1 16 A TYR 17 2 97.96 1 17 A ALA 18 2 98.25 1 18 A LYS 19 2 93.89 1 19 A ASN 20 2 96.47 1 20 A MET 21 2 97.56 1 21 A ARG 22 2 95.78 1 22 A LYS 23 2 92.14 1 23 A ASP 24 2 96.15 1 24 A LEU 25 2 96.89 1 25 A SER 26 2 93.80 1 26 A ASN 27 2 83.12 1 27 A GLN 28 2 77.19 1 28 A ASP 29 2 91.28 1 29 A ILE 30 2 95.59 1 30 A CYS 31 2 95.29 1 31 A LEU 32 2 92.51 1 32 A GLU 33 2 83.00 1 33 A ASP 34 2 91.96 1 34 A GLY 35 2 96.36 1 35 A ALA 36 2 96.06 1 36 A LEU 37 2 94.69 1 37 A ASN 38 2 95.08 1 38 A HIS 39 2 94.05 1 39 A SER 40 2 92.51 1 40 A TYR 41 2 95.67 1 41 A PHE 42 2 95.73 1 42 A LEU 43 2 92.77 1 43 A THR 44 2 87.92 1 44 A LYS 45 2 79.12 1 45 A LYS 46 2 77.61 1 46 A GLY 47 2 85.28 1 47 A GLN 48 2 82.05 1 48 A TYR 49 2 92.93 1 49 A TRP 50 2 95.74 1 50 A THR 51 2 93.81 1 51 A PRO 52 2 93.70 1 52 A LEU 53 2 91.14 1 53 A ASN 54 2 95.02 1 54 A GLN 55 2 95.82 1 55 A LYS 56 2 88.42 1 56 A ALA 57 2 98.50 1 57 A LEU 58 2 98.50 1 58 A GLN 59 2 96.42 1 59 A ARG 60 2 88.33 1 60 A GLY 61 2 98.66 1 61 A ILE 62 2 98.13 1 62 A GLU 63 2 95.83 1 63 A LEU 64 2 96.25 1 64 A PHE 65 2 97.72 1 65 A GLY 66 2 98.28 1 66 A VAL 67 2 97.86 1 67 A GLY 68 2 97.24 1 68 A ASN 69 2 95.51 1 69 A TRP 70 2 96.74 1 70 A LYS 71 2 87.61 1 71 A GLU 72 2 91.31 1 72 A ILE 73 2 98.28 1 73 A ASN 74 2 97.14 1 74 A TYR 75 2 85.28 1 75 A ASP 76 2 93.47 1 76 A GLU 77 2 95.02 1 77 A PHE 78 2 97.40 1 78 A SER 79 2 95.52 1 79 A GLY 80 2 96.28 1 80 A LYS 81 2 86.91 1 81 A ALA 82 2 94.77 1 82 A ASN 83 2 90.58 1 83 A ILE 84 2 89.20 1 84 A VAL 85 2 91.81 1 85 A GLU 86 2 93.25 1 86 A LEU 87 2 97.02 1 87 A GLU 88 2 89.26 1 88 A LEU 89 2 94.23 1 89 A ARG 90 2 94.03 1 90 A THR 91 2 97.83 1 91 A CYS 92 2 97.33 1 92 A MET 93 2 93.28 1 93 A ILE 94 2 98.07 1 94 A LEU 95 2 98.09 1 95 A GLY 96 2 97.70 1 96 A ILE 97 2 95.59 1 97 A ASN 98 2 91.98 1 98 A ASP 99 2 91.65 1 99 A ILE 100 2 94.91 1 100 A THR 101 2 91.00 1 101 A GLU 102 2 88.76 1 102 A TYR 103 2 97.47 1 103 A TYR 104 2 89.84 1 104 A GLY 105 2 97.26 1 105 A LYS 106 2 92.11 1 106 A LYS 107 2 96.85 1 107 A ILE 108 2 98.05 1 108 A SER 109 2 98.11 1 109 A GLU 110 2 90.76 1 110 A GLU 111 2 87.94 1 111 A GLU 112 2 87.30 1 112 A GLN 113 2 97.61 1 113 A GLU 114 2 85.29 1 114 A GLU 115 2 88.21 1 115 A ILE 116 2 98.00 1 116 A LYS 117 2 95.38 1 117 A LYS 118 2 91.23 1 118 A SER 119 2 95.83 1 119 A ASN 120 2 97.24 1 120 A ILE 121 2 96.10 1 121 A ALA 122 2 98.00 1 122 A LYS 123 2 88.97 1 123 A GLY 124 2 97.18 1 124 A LYS 125 2 89.62 1 125 A LYS 126 2 88.23 1 126 A GLU 127 2 93.00 1 127 A ASN 128 2 90.51 1 128 A LYS 129 2 90.46 1 129 A LEU 130 2 93.80 1 130 A LYS 131 2 86.50 1 131 A ASP 132 2 93.71 1 132 A ASN 133 2 89.61 1 133 A ILE 134 2 93.85 1 134 A TYR 135 2 95.39 1 135 A GLN 136 2 88.03 1 136 A LYS 137 2 78.38 1 137 A LEU 138 2 66.65 1 138 A GLN 139 2 54.95 1 139 A GLN 140 2 41.90 1 140 A MET 141 2 40.28 1 141 A GLN 142 2 28.19 1 142 B ASP 1 2 53.24 1 143 B ASP 2 2 61.77 1 144 B TYR 3 2 65.30 1 145 B LEU 4 2 77.12 1 146 B ASP 5 2 74.24 1 147 B ARG 6 2 68.72 1 148 B LEU 7 2 82.50 1 149 B PRO 8 2 82.48 1 150 B LYS 9 2 74.48 1 151 B SER 10 2 84.80 1 152 B LYS 11 2 81.13 1 153 B LYS 12 2 79.99 1 154 B GLY 13 2 91.45 1 155 B LEU 14 2 88.53 1 156 B GLN 15 2 84.39 1 157 B GLY 16 2 91.25 1 158 B LEU 17 2 90.11 1 159 B LEU 18 2 86.91 1 160 B GLN 19 2 85.39 1 161 B ASP 20 2 87.16 1 162 B ILE 21 2 89.28 1 163 B GLU 22 2 84.75 1 164 B LYS 23 2 83.53 1 165 B ARG 24 2 78.00 1 166 B ILE 25 2 86.20 1 167 B LEU 26 2 84.03 1 168 B HIS 27 2 86.03 1 169 B TYR 28 2 80.06 1 170 B LYS 29 2 88.38 1 171 B GLN 30 2 85.10 1 172 B LEU 31 2 90.37 1 173 B PHE 32 2 94.02 1 174 B PHE 33 2 95.14 1 175 B LYS 34 2 90.31 1 176 B GLU 35 2 85.79 1 177 B GLN 36 2 91.98 1 178 B ASN 37 2 91.90 1 179 B GLU 38 2 92.09 1 180 B ILE 39 2 91.30 1 181 B ALA 40 2 92.13 1 182 B ASN 41 2 89.54 1 183 B GLY 42 2 92.71 1 184 B LYS 43 2 90.81 1 185 B ARG 44 2 82.64 1 186 B SER 45 2 95.23 1 187 B MET 46 2 87.94 1 188 B VAL 47 2 96.54 1 189 B PRO 48 2 97.48 1 190 B ASP 49 2 93.79 1 191 B ASN 50 2 95.24 1 192 B SER 51 2 97.48 1 193 B ILE 52 2 97.93 1 194 B PRO 53 2 97.85 1 195 B ILE 54 2 97.61 1 196 B CYS 55 2 96.00 1 197 B SER 56 2 95.67 1 198 B ASP 57 2 96.02 1 199 B VAL 58 2 96.48 1 200 B THR 59 2 94.66 1 201 B LYS 60 2 90.07 1 202 B LEU 61 2 96.28 1 203 B ASN 62 2 95.05 1 204 B PHE 63 2 97.52 1 205 B GLN 64 2 94.22 1 206 B ALA 65 2 97.93 1 207 B LEU 66 2 97.77 1 208 B ILE 67 2 97.18 1 209 B ASP 68 2 96.81 1 210 B ALA 69 2 98.17 1 211 B GLN 70 2 96.86 1 212 B MET 71 2 94.18 1 213 B ARG 72 2 87.46 1 214 B HIS 73 2 94.91 1 215 B ALA 74 2 96.32 1 216 B GLY 75 2 95.59 1 217 B LYS 76 2 90.75 1 218 B MET 77 2 93.52 1 219 B PHE 78 2 98.11 1 220 B ASP 79 2 96.93 1 221 B VAL 80 2 98.14 1 222 B ILE 81 2 98.46 1 223 B MET 82 2 96.92 1 224 B MET 83 2 94.11 1 225 B ASP 84 2 97.01 1 226 B PRO 85 2 97.65 1 227 B PRO 86 2 96.47 1 228 B TRP 87 2 95.96 1 229 B GLN 88 2 87.11 1 230 B LEU 89 2 80.48 1 231 B SER 90 2 69.78 1 232 B SER 91 2 60.24 1 233 B SER 92 2 50.72 1 234 B GLN 93 2 43.01 1 235 B PRO 94 2 50.47 1 236 B SER 95 2 49.17 1 237 B ARG 96 2 39.49 1 238 B GLY 97 2 55.19 1 239 B VAL 98 2 57.21 1 240 B ALA 99 2 64.04 1 241 B ILE 100 2 68.12 1 242 B ALA 101 2 76.77 1 243 B TYR 102 2 80.61 1 244 B ASP 103 2 85.57 1 245 B SER 104 2 92.46 1 246 B LEU 105 2 95.60 1 247 B SER 106 2 95.81 1 248 B ASP 107 2 95.76 1 249 B GLU 108 2 86.88 1 250 B LYS 109 2 92.19 1 251 B ILE 110 2 97.25 1 252 B GLN 111 2 90.66 1 253 B ASN 112 2 92.31 1 254 B MET 113 2 96.53 1 255 B PRO 114 2 97.50 1 256 B ILE 115 2 97.33 1 257 B GLN 116 2 89.93 1 258 B SER 117 2 95.76 1 259 B LEU 118 2 97.06 1 260 B GLN 119 2 96.49 1 261 B GLN 120 2 86.84 1 262 B ASP 121 2 95.67 1 263 B GLY 122 2 97.98 1 264 B PHE 123 2 97.71 1 265 B ILE 124 2 97.82 1 266 B PHE 125 2 98.00 1 267 B VAL 126 2 98.37 1 268 B TRP 127 2 98.13 1 269 B ALA 128 2 96.19 1 270 B ILE 129 2 90.62 1 271 B ASN 130 2 88.01 1 272 B ALA 131 2 92.69 1 273 B LYS 132 2 93.96 1 274 B TYR 133 2 95.06 1 275 B ARG 134 2 82.11 1 276 B VAL 135 2 93.91 1 277 B THR 136 2 97.06 1 278 B ILE 137 2 96.96 1 279 B LYS 138 2 86.23 1 280 B MET 139 2 94.80 1 281 B ILE 140 2 96.14 1 282 B GLU 141 2 95.73 1 283 B ASN 142 2 94.46 1 284 B TRP 143 2 97.72 1 285 B GLY 144 2 97.56 1 286 B TYR 145 2 98.07 1 287 B LYS 146 2 88.72 1 288 B LEU 147 2 94.35 1 289 B VAL 148 2 95.42 1 290 B ASP 149 2 94.83 1 291 B GLU 150 2 94.41 1 292 B ILE 151 2 96.39 1 293 B THR 152 2 96.32 1 294 B TRP 153 2 96.85 1 295 B VAL 154 2 96.03 1 296 B LYS 155 2 90.66 1 297 B LYS 156 2 91.00 1 298 B THR 157 2 91.67 1 299 B VAL 158 2 89.12 1 300 B ASN 159 2 88.69 1 301 B GLY 160 2 92.47 1 302 B LYS 161 2 85.93 1 303 B ILE 162 2 90.72 1 304 B ALA 163 2 89.69 1 305 B LYS 164 2 76.67 1 306 B GLY 165 2 85.69 1 307 B HIS 166 2 74.86 1 308 B GLY 167 2 85.47 1 309 B PHE 168 2 77.59 1 310 B TYR 169 2 87.64 1 311 B LEU 170 2 91.18 1 312 B GLN 171 2 85.70 1 313 B HIS 172 2 85.95 1 314 B ALA 173 2 93.61 1 315 B LYS 174 2 90.82 1 316 B GLU 175 2 92.38 1 317 B SER 176 2 96.16 1 318 B CYS 177 2 98.24 1 319 B LEU 178 2 96.02 1 320 B ILE 179 2 97.09 1 321 B GLY 180 2 98.40 1 322 B VAL 181 2 96.07 1 323 B LYS 182 2 93.18 1 324 B GLY 183 2 96.09 1 325 B ASP 184 2 92.10 1 326 B VAL 185 2 92.70 1 327 B ASP 186 2 90.03 1 328 B ASN 187 2 86.12 1 329 B GLY 188 2 91.82 1 330 B ARG 189 2 82.31 1 331 B PHE 190 2 95.61 1 332 B LYS 191 2 88.24 1 333 B LYS 192 2 86.00 1 334 B ASN 193 2 91.70 1 335 B ILE 194 2 88.57 1 336 B ALA 195 2 93.40 1 337 B SER 196 2 93.77 1 338 B ASP 197 2 95.54 1 339 B VAL 198 2 95.55 1 340 B ILE 199 2 97.11 1 341 B PHE 200 2 93.37 1 342 B SER 201 2 96.17 1 343 B GLU 202 2 90.93 1 344 B ARG 203 2 80.18 1 345 B ARG 204 2 86.11 1 346 B GLY 205 2 92.27 1 347 B GLN 206 2 80.21 1 348 B SER 207 2 90.26 1 349 B GLN 208 2 92.19 1 350 B LYS 209 2 93.99 1 351 B PRO 210 2 97.46 1 352 B GLU 211 2 92.77 1 353 B GLU 212 2 94.17 1 354 B ILE 213 2 97.42 1 355 B TYR 214 2 97.91 1 356 B GLN 215 2 90.45 1 357 B TYR 216 2 93.28 1 358 B ILE 217 2 97.67 1 359 B ASN 218 2 90.52 1 360 B GLN 219 2 92.10 1 361 B LEU 220 2 96.73 1 362 B CYS 221 2 96.58 1 363 B PRO 222 2 95.03 1 364 B ASN 223 2 90.47 1 365 B GLY 224 2 96.49 1 366 B ASN 225 2 94.96 1 367 B TYR 226 2 97.28 1 368 B LEU 227 2 98.35 1 369 B GLU 228 2 97.83 1 370 B ILE 229 2 98.16 1 371 B PHE 230 2 97.96 1 372 B ALA 231 2 97.49 1 373 B ARG 232 2 90.50 1 374 B ARG 233 2 93.25 1 375 B ASN 234 2 93.84 1 376 B ASN 235 2 95.89 1 377 B LEU 236 2 97.57 1 378 B HIS 237 2 95.09 1 379 B ASP 238 2 96.15 1 380 B ASN 239 2 93.54 1 381 B TRP 240 2 98.32 1 382 B VAL 241 2 98.43 1 383 B SER 242 2 98.08 1 384 B ILE 243 2 98.09 1 385 B GLY 244 2 97.03 1 386 B ASN 245 2 93.53 1 387 B GLU 246 2 86.24 1 388 B LEU 247 2 94.65 1 389 C SAM . 2 96.25 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 ? 35.171 40.467 12.879 1.00 30.76 1 A 1 ATOM 2 C CA . MET A 1 1 ? 34.891 39.546 11.755 1.00 39.45 1 A 1 ATOM 3 C C . MET A 1 1 ? 33.433 39.099 11.845 1.00 44.98 1 A 1 ATOM 4 O O . MET A 1 1 ? 33.115 38.269 12.681 1.00 43.96 1 A 1 ATOM 5 C CB . MET A 1 1 ? 35.817 38.328 11.818 1.00 38.34 1 A 1 ATOM 6 C CG . MET A 1 1 ? 37.233 38.656 11.333 1.00 36.78 1 A 1 ATOM 7 S SD . MET A 1 1 ? 38.420 37.367 11.748 1.00 34.57 1 A 1 ATOM 8 C CE . MET A 1 1 ? 39.582 37.491 10.354 1.00 29.56 1 A 1 ATOM 9 N N . LYS A 1 2 ? 32.513 39.703 11.062 1.00 36.26 2 A 1 ATOM 10 C CA . LYS A 1 2 ? 31.093 39.320 11.050 1.00 38.69 2 A 1 ATOM 11 C C . LYS A 1 2 ? 30.995 37.955 10.365 1.00 38.05 2 A 1 ATOM 12 O O . LYS A 1 2 ? 31.228 37.869 9.165 1.00 36.07 2 A 1 ATOM 13 C CB . LYS A 1 2 ? 30.234 40.379 10.328 1.00 38.05 2 A 1 ATOM 14 C CG . LYS A 1 2 ? 29.992 41.653 11.163 1.00 35.08 2 A 1 ATOM 15 C CD . LYS A 1 2 ? 29.094 42.656 10.410 1.00 33.17 2 A 1 ATOM 16 C CE . LYS A 1 2 ? 28.797 43.895 11.275 1.00 28.47 2 A 1 ATOM 17 N NZ . LYS A 1 2 ? 27.946 44.895 10.577 1.00 25.77 2 A 1 ATOM 18 N N . LYS A 1 3 ? 30.703 36.899 11.116 1.00 35.38 3 A 1 ATOM 19 C CA . LYS A 1 3 ? 30.335 35.606 10.531 1.00 36.78 3 A 1 ATOM 20 C C . LYS A 1 3 ? 29.015 35.823 9.784 1.00 35.70 3 A 1 ATOM 21 O O . LYS A 1 3 ? 27.955 35.817 10.398 1.00 32.70 3 A 1 ATOM 22 C CB . LYS A 1 3 ? 30.212 34.507 11.609 1.00 35.81 3 A 1 ATOM 23 C CG . LYS A 1 3 ? 31.572 33.968 12.098 1.00 33.84 3 A 1 ATOM 24 C CD . LYS A 1 3 ? 31.370 32.811 13.095 1.00 32.38 3 A 1 ATOM 25 C CE . LYS A 1 3 ? 32.708 32.196 13.541 1.00 28.46 3 A 1 ATOM 26 N NZ . LYS A 1 3 ? 32.528 31.065 14.492 1.00 26.23 3 A 1 ATOM 27 N N . ASN A 1 4 ? 29.083 36.084 8.481 1.00 38.31 4 A 1 ATOM 28 C CA . ASN A 1 4 ? 27.930 36.076 7.589 1.00 38.16 4 A 1 ATOM 29 C C . ASN A 1 4 ? 27.438 34.627 7.484 1.00 37.79 4 A 1 ATOM 30 O O . ASN A 1 4 ? 27.735 33.927 6.523 1.00 34.36 4 A 1 ATOM 31 C CB . ASN A 1 4 ? 28.308 36.680 6.219 1.00 35.40 4 A 1 ATOM 32 C CG . ASN A 1 4 ? 28.163 38.192 6.141 1.00 30.84 4 A 1 ATOM 33 O OD1 . ASN A 1 4 ? 27.573 38.836 6.983 1.00 29.76 4 A 1 ATOM 34 N ND2 . ASN A 1 4 ? 28.677 38.802 5.095 1.00 28.27 4 A 1 ATOM 35 N N . GLY A 1 5 ? 26.711 34.181 8.495 1.00 39.61 5 A 1 ATOM 36 C CA . GLY A 1 5 ? 25.947 32.942 8.468 1.00 39.83 5 A 1 ATOM 37 C C . GLY A 1 5 ? 24.742 33.085 7.544 1.00 40.75 5 A 1 ATOM 38 O O . GLY A 1 5 ? 23.616 32.953 7.995 1.00 37.64 5 A 1 ATOM 39 N N . LYS A 1 6 ? 24.968 33.405 6.257 1.00 39.17 6 A 1 ATOM 40 C CA . LYS A 1 6 ? 23.977 33.122 5.224 1.00 39.88 6 A 1 ATOM 41 C C . LYS A 1 6 ? 23.856 31.602 5.203 1.00 40.34 6 A 1 ATOM 42 O O . LYS A 1 6 ? 24.657 30.938 4.546 1.00 37.89 6 A 1 ATOM 43 C CB . LYS A 1 6 ? 24.391 33.680 3.850 1.00 38.46 6 A 1 ATOM 44 C CG . LYS A 1 6 ? 24.179 35.199 3.716 1.00 35.36 6 A 1 ATOM 45 C CD . LYS A 1 6 ? 24.485 35.640 2.276 1.00 32.97 6 A 1 ATOM 46 C CE . LYS A 1 6 ? 24.212 37.138 2.087 1.00 28.59 6 A 1 ATOM 47 N NZ . LYS A 1 6 ? 24.437 37.566 0.678 1.00 25.92 6 A 1 ATOM 48 N N . SER A 1 7 ? 22.890 31.058 5.942 1.00 48.51 7 A 1 ATOM 49 C CA . SER A 1 7 ? 22.365 29.726 5.678 1.00 49.56 7 A 1 ATOM 50 C C . SER A 1 7 ? 21.913 29.747 4.219 1.00 50.74 7 A 1 ATOM 51 O O . SER A 1 7 ? 20.896 30.360 3.889 1.00 47.84 7 A 1 ATOM 52 C CB . SER A 1 7 ? 21.199 29.409 6.629 1.00 46.27 7 A 1 ATOM 53 O OG . SER A 1 7 ? 20.258 30.464 6.646 1.00 42.06 7 A 1 ATOM 54 N N . GLN A 1 8 ? 22.746 29.211 3.316 1.00 47.01 8 A 1 ATOM 55 C CA . GLN A 1 8 ? 22.345 29.000 1.941 1.00 49.06 8 A 1 ATOM 56 C C . GLN A 1 8 ? 21.208 27.986 2.019 1.00 53.01 8 A 1 ATOM 57 O O . GLN A 1 8 ? 21.460 26.805 2.240 1.00 49.79 8 A 1 ATOM 58 C CB . GLN A 1 8 ? 23.525 28.492 1.102 1.00 44.04 8 A 1 ATOM 59 C CG . GLN A 1 8 ? 24.535 29.606 0.754 1.00 39.42 8 A 1 ATOM 60 C CD . GLN A 1 8 ? 25.703 29.096 -0.099 1.00 35.05 8 A 1 ATOM 61 O OE1 . GLN A 1 8 ? 25.988 27.919 -0.183 1.00 32.58 8 A 1 ATOM 62 N NE2 . GLN A 1 8 ? 26.437 29.964 -0.756 1.00 32.78 8 A 1 ATOM 63 N N . ASN A 1 9 ? 19.957 28.469 1.889 1.00 61.22 9 A 1 ATOM 64 C CA . ASN A 1 9 ? 18.781 27.625 1.700 1.00 61.76 9 A 1 ATOM 65 C C . ASN A 1 9 ? 18.929 26.934 0.340 1.00 64.14 9 A 1 ATOM 66 O O . ASN A 1 9 ? 18.333 27.354 -0.648 1.00 60.10 9 A 1 ATOM 67 C CB . ASN A 1 9 ? 17.488 28.472 1.785 1.00 55.55 9 A 1 ATOM 68 C CG . ASN A 1 9 ? 16.940 28.660 3.194 1.00 49.00 9 A 1 ATOM 69 O OD1 . ASN A 1 9 ? 17.353 28.043 4.151 1.00 45.54 9 A 1 ATOM 70 N ND2 . ASN A 1 9 ? 15.952 29.519 3.349 1.00 42.70 9 A 1 ATOM 71 N N . GLN A 1 10 ? 19.802 25.927 0.259 1.00 67.58 10 A 1 ATOM 72 C CA . GLN A 1 10 ? 19.801 25.032 -0.878 1.00 71.29 10 A 1 ATOM 73 C C . GLN A 1 10 ? 18.433 24.352 -0.913 1.00 75.18 10 A 1 ATOM 74 O O . GLN A 1 10 ? 17.929 23.947 0.144 1.00 70.39 10 A 1 ATOM 75 C CB . GLN A 1 10 ? 20.950 24.025 -0.808 1.00 63.54 10 A 1 ATOM 76 C CG . GLN A 1 10 ? 22.274 24.687 -1.233 1.00 54.41 10 A 1 ATOM 77 C CD . GLN A 1 10 ? 23.425 23.688 -1.358 1.00 47.56 10 A 1 ATOM 78 O OE1 . GLN A 1 10 ? 23.433 22.612 -0.794 1.00 43.54 10 A 1 ATOM 79 N NE2 . GLN A 1 10 ? 24.454 24.014 -2.106 1.00 40.85 10 A 1 ATOM 80 N N . PRO A 1 11 ? 17.799 24.274 -2.092 1.00 82.01 11 A 1 ATOM 81 C CA . PRO A 1 11 ? 16.539 23.563 -2.226 1.00 84.64 11 A 1 ATOM 82 C C . PRO A 1 11 ? 16.724 22.119 -1.746 1.00 88.23 11 A 1 ATOM 83 O O . PRO A 1 11 ? 17.759 21.494 -2.005 1.00 84.77 11 A 1 ATOM 84 C CB . PRO A 1 11 ? 16.169 23.664 -3.710 1.00 77.54 11 A 1 ATOM 85 C CG . PRO A 1 11 ? 17.512 23.884 -4.406 1.00 71.99 11 A 1 ATOM 86 C CD . PRO A 1 11 ? 18.315 24.680 -3.387 1.00 74.96 11 A 1 ATOM 87 N N . LEU A 1 12 ? 15.735 21.598 -1.041 1.00 89.06 12 A 1 ATOM 88 C CA . LEU A 1 12 ? 15.753 20.223 -0.545 1.00 92.85 12 A 1 ATOM 89 C C . LEU A 1 12 ? 15.849 19.250 -1.731 1.00 94.79 12 A 1 ATOM 90 O O . LEU A 1 12 ? 14.995 19.264 -2.617 1.00 93.34 12 A 1 ATOM 91 C CB . LEU A 1 12 ? 14.487 19.994 0.305 1.00 90.85 12 A 1 ATOM 92 C CG . LEU A 1 12 ? 14.384 18.591 0.939 1.00 91.33 12 A 1 ATOM 93 C CD1 . LEU A 1 12 ? 15.492 18.344 1.965 1.00 88.60 12 A 1 ATOM 94 C CD2 . LEU A 1 12 ? 13.043 18.456 1.664 1.00 88.72 12 A 1 ATOM 95 N N . ASP A 1 13 ? 16.866 18.396 -1.729 1.00 95.25 13 A 1 ATOM 96 C CA . ASP A 1 13 ? 16.907 17.254 -2.644 1.00 96.20 13 A 1 ATOM 97 C C . ASP A 1 13 ? 15.906 16.199 -2.161 1.00 96.94 13 A 1 ATOM 98 O O . ASP A 1 13 ? 16.182 15.411 -1.252 1.00 96.38 13 A 1 ATOM 99 C CB . ASP A 1 13 ? 18.332 16.694 -2.764 1.00 94.85 13 A 1 ATOM 100 C CG . ASP A 1 13 ? 18.432 15.459 -3.681 1.00 93.93 13 A 1 ATOM 101 O OD1 . ASP A 1 13 ? 17.389 14.931 -4.134 1.00 90.37 13 A 1 ATOM 102 O OD2 . ASP A 1 13 ? 19.573 15.001 -3.905 1.00 89.14 13 A 1 ATOM 103 N N . PHE A 1 14 ? 14.721 16.197 -2.760 1.00 96.94 14 A 1 ATOM 104 C CA . PHE A 1 14 ? 13.646 15.283 -2.383 1.00 97.03 14 A 1 ATOM 105 C C . PHE A 1 14 ? 13.982 13.810 -2.642 1.00 97.51 14 A 1 ATOM 106 O O . PHE A 1 14 ? 13.474 12.946 -1.932 1.00 97.01 14 A 1 ATOM 107 C CB . PHE A 1 14 ? 12.357 15.680 -3.108 1.00 95.93 14 A 1 ATOM 108 C CG . PHE A 1 14 ? 11.662 16.874 -2.490 1.00 93.82 14 A 1 ATOM 109 C CD1 . PHE A 1 14 ? 10.918 16.713 -1.309 1.00 91.02 14 A 1 ATOM 110 C CD2 . PHE A 1 14 ? 11.750 18.142 -3.087 1.00 91.01 14 A 1 ATOM 111 C CE1 . PHE A 1 14 ? 10.250 17.805 -0.732 1.00 89.57 14 A 1 ATOM 112 C CE2 . PHE A 1 14 ? 11.083 19.239 -2.516 1.00 89.29 14 A 1 ATOM 113 C CZ . PHE A 1 14 ? 10.330 19.070 -1.340 1.00 88.75 14 A 1 ATOM 114 N N . THR A 1 15 ? 14.853 13.498 -3.604 1.00 97.31 15 A 1 ATOM 115 C CA . THR A 1 15 ? 15.271 12.114 -3.851 1.00 97.13 15 A 1 ATOM 116 C C . THR A 1 15 ? 16.150 11.610 -2.710 1.00 97.56 15 A 1 ATOM 117 O O . THR A 1 15 ? 15.907 10.531 -2.164 1.00 97.05 15 A 1 ATOM 118 C CB . THR A 1 15 ? 16.002 11.985 -5.192 1.00 96.06 15 A 1 ATOM 119 O OG1 . THR A 1 15 ? 15.144 12.393 -6.235 1.00 89.96 15 A 1 ATOM 120 C CG2 . THR A 1 15 ? 16.412 10.547 -5.496 1.00 88.81 15 A 1 ATOM 121 N N . GLN A 1 16 ? 17.137 12.406 -2.299 1.00 97.14 16 A 1 ATOM 122 C CA . GLN A 1 16 ? 17.989 12.059 -1.164 1.00 97.29 16 A 1 ATOM 123 C C . GLN A 1 16 ? 17.223 12.112 0.161 1.00 97.76 16 A 1 ATOM 124 O O . GLN A 1 16 ? 17.383 11.225 0.999 1.00 97.66 16 A 1 ATOM 125 C CB . GLN A 1 16 ? 19.225 12.971 -1.149 1.00 96.70 16 A 1 ATOM 126 C CG . GLN A 1 16 ? 20.268 12.497 -0.124 1.00 91.36 16 A 1 ATOM 127 C CD . GLN A 1 16 ? 20.733 11.058 -0.405 1.00 89.85 16 A 1 ATOM 128 O OE1 . GLN A 1 16 ? 21.117 10.706 -1.507 1.00 82.04 16 A 1 ATOM 129 N NE2 . GLN A 1 16 ? 20.681 10.172 0.564 1.00 79.46 16 A 1 ATOM 130 N N . TYR A 1 17 ? 16.344 13.103 0.322 1.00 97.76 17 A 1 ATOM 131 C CA . TYR A 1 17 ? 15.428 13.199 1.459 1.00 98.06 17 A 1 ATOM 132 C C . TYR A 1 17 ? 14.580 11.929 1.599 1.00 98.35 17 A 1 ATOM 133 O O . TYR A 1 17 ? 14.573 11.315 2.660 1.00 98.21 17 A 1 ATOM 134 C CB . TYR A 1 17 ? 14.541 14.443 1.296 1.00 97.93 17 A 1 ATOM 135 C CG . TYR A 1 17 ? 13.363 14.491 2.246 1.00 98.28 17 A 1 ATOM 136 C CD1 . TYR A 1 17 ? 12.063 14.188 1.787 1.00 97.84 17 A 1 ATOM 137 C CD2 . TYR A 1 17 ? 13.558 14.830 3.598 1.00 98.01 17 A 1 ATOM 138 C CE1 . TYR A 1 17 ? 10.972 14.235 2.665 1.00 97.85 17 A 1 ATOM 139 C CE2 . TYR A 1 17 ? 12.469 14.880 4.485 1.00 97.80 17 A 1 ATOM 140 C CZ . TYR A 1 17 ? 11.176 14.584 4.012 1.00 98.03 17 A 1 ATOM 141 O OH . TYR A 1 17 ? 10.108 14.643 4.871 1.00 97.45 17 A 1 ATOM 142 N N . ALA A 1 18 ? 13.938 11.478 0.526 1.00 98.39 18 A 1 ATOM 143 C CA . ALA A 1 18 ? 13.112 10.275 0.551 1.00 98.33 18 A 1 ATOM 144 C C . ALA A 1 18 ? 13.928 9.022 0.912 1.00 98.40 18 A 1 ATOM 145 O O . ALA A 1 18 ? 13.475 8.211 1.723 1.00 98.14 18 A 1 ATOM 146 C CB . ALA A 1 18 ? 12.402 10.129 -0.799 1.00 97.99 18 A 1 ATOM 147 N N . LYS A 1 19 ? 15.138 8.874 0.378 1.00 98.19 19 A 1 ATOM 148 C CA . LYS A 1 19 ? 16.045 7.776 0.756 1.00 98.13 19 A 1 ATOM 149 C C . LYS A 1 19 ? 16.405 7.820 2.240 1.00 98.15 19 A 1 ATOM 150 O O . LYS A 1 19 ? 16.285 6.806 2.921 1.00 97.75 19 A 1 ATOM 151 C CB . LYS A 1 19 ? 17.318 7.794 -0.099 1.00 97.75 19 A 1 ATOM 152 C CG . LYS A 1 19 ? 17.082 7.287 -1.529 1.00 95.20 19 A 1 ATOM 153 C CD . LYS A 1 19 ? 18.421 7.152 -2.259 1.00 93.54 19 A 1 ATOM 154 C CE . LYS A 1 19 ? 18.229 6.505 -3.634 1.00 86.76 19 A 1 ATOM 155 N NZ . LYS A 1 19 ? 19.475 5.832 -4.090 1.00 79.53 19 A 1 ATOM 156 N N . ASN A 1 20 ? 16.796 8.980 2.740 1.00 98.16 20 A 1 ATOM 157 C CA . ASN A 1 20 ? 17.186 9.155 4.140 1.00 98.10 20 A 1 ATOM 158 C C . ASN A 1 20 ? 16.017 8.876 5.096 1.00 98.17 20 A 1 ATOM 159 O O . ASN A 1 20 ? 16.161 8.099 6.035 1.00 97.75 20 A 1 ATOM 160 C CB . ASN A 1 20 ? 17.720 10.578 4.330 1.00 97.89 20 A 1 ATOM 161 C CG . ASN A 1 20 ? 19.052 10.839 3.647 1.00 97.16 20 A 1 ATOM 162 O OD1 . ASN A 1 20 ? 19.754 9.961 3.174 1.00 92.62 20 A 1 ATOM 163 N ND2 . ASN A 1 20 ? 19.457 12.094 3.604 1.00 91.90 20 A 1 ATOM 164 N N . MET A 1 21 ? 14.844 9.437 4.809 1.00 98.43 21 A 1 ATOM 165 C CA . MET A 1 21 ? 13.637 9.226 5.616 1.00 98.41 21 A 1 ATOM 166 C C . MET A 1 21 ? 13.220 7.753 5.638 1.00 98.35 21 A 1 ATOM 167 O O . MET A 1 21 ? 12.891 7.229 6.699 1.00 97.97 21 A 1 ATOM 168 C CB . MET A 1 21 ? 12.495 10.093 5.075 1.00 98.31 21 A 1 ATOM 169 C CG . MET A 1 21 ? 12.714 11.590 5.332 1.00 97.50 21 A 1 ATOM 170 S SD . MET A 1 21 ? 12.677 12.090 7.079 1.00 97.47 21 A 1 ATOM 171 C CE . MET A 1 21 ? 10.896 12.009 7.407 1.00 94.04 21 A 1 ATOM 172 N N . ARG A 1 22 ? 13.284 7.059 4.494 1.00 98.48 22 A 1 ATOM 173 C CA . ARG A 1 22 ? 12.989 5.619 4.442 1.00 98.36 22 A 1 ATOM 174 C C . ARG A 1 22 ? 13.983 4.799 5.259 1.00 98.18 22 A 1 ATOM 175 O O . ARG A 1 22 ? 13.549 3.904 5.977 1.00 97.61 22 A 1 ATOM 176 C CB . ARG A 1 22 ? 12.951 5.115 2.998 1.00 98.05 22 A 1 ATOM 177 C CG . ARG A 1 22 ? 11.644 5.498 2.281 1.00 96.96 22 A 1 ATOM 178 C CD . ARG A 1 22 ? 11.526 4.781 0.946 1.00 96.48 22 A 1 ATOM 179 N NE . ARG A 1 22 ? 12.608 5.152 0.017 1.00 94.60 22 A 1 ATOM 180 C CZ . ARG A 1 22 ? 12.525 5.951 -1.033 1.00 96.20 22 A 1 ATOM 181 N NH1 . ARG A 1 22 ? 11.417 6.536 -1.388 1.00 88.62 22 A 1 ATOM 182 N NH2 . ARG A 1 22 ? 13.571 6.169 -1.776 1.00 90.02 22 A 1 ATOM 183 N N . LYS A 1 23 ? 15.274 5.105 5.203 1.00 97.96 23 A 1 ATOM 184 C CA . LYS A 1 23 ? 16.284 4.407 6.012 1.00 97.54 23 A 1 ATOM 185 C C . LYS A 1 23 ? 16.032 4.552 7.512 1.00 97.38 23 A 1 ATOM 186 O O . LYS A 1 23 ? 16.247 3.599 8.250 1.00 96.37 23 A 1 ATOM 187 C CB . LYS A 1 23 ? 17.691 4.911 5.672 1.00 97.02 23 A 1 ATOM 188 C CG . LYS A 1 23 ? 18.156 4.390 4.303 1.00 93.44 23 A 1 ATOM 189 C CD . LYS A 1 23 ? 19.564 4.871 3.954 1.00 90.60 23 A 1 ATOM 190 C CE . LYS A 1 23 ? 20.589 4.202 4.887 1.00 82.53 23 A 1 ATOM 191 N NZ . LYS A 1 23 ? 21.956 4.271 4.326 1.00 76.41 23 A 1 ATOM 192 N N . ASP A 1 24 ? 15.565 5.722 7.942 1.00 97.79 24 A 1 ATOM 193 C CA . ASP A 1 24 ? 15.336 6.005 9.360 1.00 97.42 24 A 1 ATOM 194 C C . ASP A 1 24 ? 13.986 5.483 9.876 1.00 97.32 24 A 1 ATOM 195 O O . ASP A 1 24 ? 13.871 5.146 11.056 1.00 95.80 24 A 1 ATOM 196 C CB . ASP A 1 24 ? 15.419 7.519 9.588 1.00 96.88 24 A 1 ATOM 197 C CG . ASP A 1 24 ? 16.833 8.103 9.517 1.00 96.22 24 A 1 ATOM 198 O OD1 . ASP A 1 24 ? 17.836 7.366 9.427 1.00 94.00 24 A 1 ATOM 199 O OD2 . ASP A 1 24 ? 16.937 9.342 9.668 1.00 93.76 24 A 1 ATOM 200 N N . LEU A 1 25 ? 12.951 5.444 9.023 1.00 97.76 25 A 1 ATOM 201 C CA . LEU A 1 25 ? 11.558 5.287 9.462 1.00 97.56 25 A 1 ATOM 202 C C . LEU A 1 25 ? 10.803 4.115 8.829 1.00 97.17 25 A 1 ATOM 203 O O . LEU A 1 25 ? 9.832 3.625 9.416 1.00 95.54 25 A 1 ATOM 204 C CB . LEU A 1 25 ? 10.798 6.585 9.149 1.00 97.46 25 A 1 ATOM 205 C CG . LEU A 1 25 ? 11.383 7.866 9.772 1.00 97.29 25 A 1 ATOM 206 C CD1 . LEU A 1 25 ? 10.613 9.064 9.228 1.00 96.31 25 A 1 ATOM 207 C CD2 . LEU A 1 25 ? 11.269 7.857 11.297 1.00 96.00 25 A 1 ATOM 208 N N . SER A 1 26 ? 11.178 3.695 7.629 1.00 97.00 26 A 1 ATOM 209 C CA . SER A 1 26 ? 10.521 2.583 6.951 1.00 95.90 26 A 1 ATOM 210 C C . SER A 1 26 ? 11.080 1.258 7.461 1.00 93.87 26 A 1 ATOM 211 O O . SER A 1 26 ? 12.230 1.170 7.877 1.00 88.98 26 A 1 ATOM 212 C CB . SER A 1 26 ? 10.661 2.669 5.431 1.00 95.38 26 A 1 ATOM 213 O OG . SER A 1 26 ? 10.175 3.907 4.944 1.00 91.64 26 A 1 ATOM 214 N N . ASN A 1 27 ? 10.276 0.207 7.403 1.00 92.91 27 A 1 ATOM 215 C CA . ASN A 1 27 ? 10.772 -1.128 7.728 1.00 90.04 27 A 1 ATOM 216 C C . ASN A 1 27 ? 11.737 -1.647 6.639 1.00 90.13 27 A 1 ATOM 217 O O . ASN A 1 27 ? 11.810 -1.111 5.531 1.00 86.44 27 A 1 ATOM 218 C CB . ASN A 1 27 ? 9.581 -2.060 8.043 1.00 85.92 27 A 1 ATOM 219 C CG . ASN A 1 27 ? 8.749 -2.441 6.827 1.00 77.91 27 A 1 ATOM 220 O OD1 . ASN A 1 27 ? 9.184 -2.406 5.701 1.00 70.56 27 A 1 ATOM 221 N ND2 . ASN A 1 27 ? 7.517 -2.848 7.024 1.00 71.09 27 A 1 ATOM 222 N N . GLN A 1 28 ? 12.465 -2.726 6.967 1.00 88.85 28 A 1 ATOM 223 C CA . GLN A 1 28 ? 13.482 -3.319 6.085 1.00 86.92 28 A 1 ATOM 224 C C . GLN A 1 28 ? 12.912 -3.874 4.767 1.00 88.87 28 A 1 ATOM 225 O O . GLN A 1 28 ? 13.643 -4.005 3.795 1.00 85.04 28 A 1 ATOM 226 C CB . GLN A 1 28 ? 14.206 -4.443 6.836 1.00 82.44 28 A 1 ATOM 227 C CG . GLN A 1 28 ? 15.064 -3.917 7.995 1.00 74.18 28 A 1 ATOM 228 C CD . GLN A 1 28 ? 15.773 -5.040 8.758 1.00 67.97 28 A 1 ATOM 229 O OE1 . GLN A 1 28 ? 15.484 -6.215 8.625 1.00 61.21 28 A 1 ATOM 230 N NE2 . GLN A 1 28 ? 16.715 -4.712 9.609 1.00 59.26 28 A 1 ATOM 231 N N . ASP A 1 29 ? 11.618 -4.176 4.712 1.00 92.82 29 A 1 ATOM 232 C CA . ASP A 1 29 ? 10.986 -4.685 3.493 1.00 93.98 29 A 1 ATOM 233 C C . ASP A 1 29 ? 10.642 -3.552 2.511 1.00 95.41 29 A 1 ATOM 234 O O . ASP A 1 29 ? 10.622 -3.764 1.297 1.00 94.43 29 A 1 ATOM 235 C CB . ASP A 1 29 ? 9.719 -5.474 3.856 1.00 92.28 29 A 1 ATOM 236 C CG . ASP A 1 29 ? 9.965 -6.726 4.699 1.00 89.99 29 A 1 ATOM 237 O OD1 . ASP A 1 29 ? 11.039 -7.354 4.547 1.00 86.06 29 A 1 ATOM 238 O OD2 . ASP A 1 29 ? 9.040 -7.083 5.468 1.00 85.23 29 A 1 ATOM 239 N N . ILE A 1 30 ? 10.371 -2.342 3.016 1.00 96.75 30 A 1 ATOM 240 C CA . ILE A 1 30 ? 9.931 -1.184 2.221 1.00 96.89 30 A 1 ATOM 241 C C . ILE A 1 30 ? 11.078 -0.537 1.437 1.00 96.78 30 A 1 ATOM 242 O O . ILE A 1 30 ? 10.851 -0.013 0.341 1.00 95.54 30 A 1 ATOM 243 C CB . ILE A 1 30 ? 9.204 -0.170 3.135 1.00 96.56 30 A 1 ATOM 244 C CG1 . ILE A 1 30 ? 7.796 -0.712 3.457 1.00 95.01 30 A 1 ATOM 245 C CG2 . ILE A 1 30 ? 9.105 1.238 2.509 1.00 94.60 30 A 1 ATOM 246 C CD1 . ILE A 1 30 ? 7.010 0.104 4.486 1.00 92.57 30 A 1 ATOM 247 N N . CYS A 1 31 ? 12.292 -0.530 1.985 1.00 96.44 31 A 1 ATOM 248 C CA . CYS A 1 31 ? 13.448 0.071 1.335 1.00 96.12 31 A 1 ATOM 249 C C . CYS A 1 31 ? 14.642 -0.884 1.290 1.00 95.56 31 A 1 ATOM 250 O O . CYS A 1 31 ? 14.776 -1.794 2.106 1.00 94.29 31 A 1 ATOM 251 C CB . CYS A 1 31 ? 13.782 1.425 1.982 1.00 94.99 31 A 1 ATOM 252 S SG . CYS A 1 31 ? 14.403 1.225 3.685 1.00 94.34 31 A 1 ATOM 253 N N . LEU A 1 32 ? 15.519 -0.648 0.312 1.00 95.50 32 A 1 ATOM 254 C CA . LEU A 1 32 ? 16.805 -1.327 0.194 1.00 94.74 32 A 1 ATOM 255 C C . LEU A 1 32 ? 17.835 -0.689 1.143 1.00 94.84 32 A 1 ATOM 256 O O . LEU A 1 32 ? 17.584 0.351 1.749 1.00 93.11 32 A 1 ATOM 257 C CB . LEU A 1 32 ? 17.252 -1.286 -1.280 1.00 93.52 32 A 1 ATOM 258 C CG . LEU A 1 32 ? 16.225 -1.813 -2.302 1.00 92.54 32 A 1 ATOM 259 C CD1 . LEU A 1 32 ? 16.808 -1.739 -3.712 1.00 88.34 32 A 1 ATOM 260 C CD2 . LEU A 1 32 ? 15.820 -3.266 -2.028 1.00 87.46 32 A 1 ATOM 261 N N . GLU A 1 33 ? 19.035 -1.281 1.246 1.00 93.61 33 A 1 ATOM 262 C CA . GLU A 1 33 ? 20.087 -0.784 2.151 1.00 93.50 33 A 1 ATOM 263 C C . GLU A 1 33 ? 20.509 0.671 1.879 1.00 94.79 33 A 1 ATOM 264 O O . GLU A 1 33 ? 20.855 1.413 2.802 1.00 93.68 33 A 1 ATOM 265 C CB . GLU A 1 33 ? 21.334 -1.667 2.033 1.00 91.71 33 A 1 ATOM 266 C CG . GLU A 1 33 ? 21.133 -3.074 2.611 1.00 80.41 33 A 1 ATOM 267 C CD . GLU A 1 33 ? 22.439 -3.878 2.639 1.00 71.63 33 A 1 ATOM 268 O OE1 . GLU A 1 33 ? 22.485 -4.870 3.400 1.00 63.93 33 A 1 ATOM 269 O OE2 . GLU A 1 33 ? 23.383 -3.493 1.917 1.00 63.73 33 A 1 ATOM 270 N N . ASP A 1 34 ? 20.458 1.108 0.615 1.00 94.80 34 A 1 ATOM 271 C CA . ASP A 1 34 ? 20.758 2.490 0.222 1.00 95.13 34 A 1 ATOM 272 C C . ASP A 1 34 ? 19.575 3.457 0.447 1.00 96.40 34 A 1 ATOM 273 O O . ASP A 1 34 ? 19.692 4.656 0.186 1.00 95.47 34 A 1 ATOM 274 C CB . ASP A 1 34 ? 21.260 2.521 -1.231 1.00 93.20 34 A 1 ATOM 275 C CG . ASP A 1 34 ? 20.134 2.454 -2.263 1.00 89.99 34 A 1 ATOM 276 O OD1 . ASP A 1 34 ? 19.152 1.728 -2.008 1.00 85.46 34 A 1 ATOM 277 O OD2 . ASP A 1 34 ? 20.208 3.209 -3.265 1.00 85.26 34 A 1 ATOM 278 N N . GLY A 1 35 ? 18.439 2.955 0.924 1.00 95.43 35 A 1 ATOM 279 C CA . GLY A 1 35 ? 17.195 3.696 1.102 1.00 96.36 35 A 1 ATOM 280 C C . GLY A 1 35 ? 16.335 3.792 -0.160 1.00 97.19 35 A 1 ATOM 281 O O . GLY A 1 35 ? 15.279 4.426 -0.118 1.00 96.46 35 A 1 ATOM 282 N N . ALA A 1 36 ? 16.733 3.190 -1.289 1.00 96.69 36 A 1 ATOM 283 C CA . ALA A 1 36 ? 15.872 3.116 -2.467 1.00 96.26 36 A 1 ATOM 284 C C . ALA A 1 36 ? 14.579 2.350 -2.148 1.00 96.52 36 A 1 ATOM 285 O O . ALA A 1 36 ? 14.556 1.455 -1.302 1.00 95.66 36 A 1 ATOM 286 C CB . ALA A 1 36 ? 16.627 2.482 -3.639 1.00 95.16 36 A 1 ATOM 287 N N . LEU A 1 37 ? 13.490 2.703 -2.832 1.00 96.51 37 A 1 ATOM 288 C CA . LEU A 1 37 ? 12.205 2.037 -2.629 1.00 96.80 37 A 1 ATOM 289 C C . LEU A 1 37 ? 12.264 0.585 -3.124 1.00 96.76 37 A 1 ATOM 290 O O . LEU A 1 37 ? 12.630 0.320 -4.267 1.00 95.67 37 A 1 ATOM 291 C CB . LEU A 1 37 ? 11.113 2.844 -3.349 1.00 95.99 37 A 1 ATOM 292 C CG . LEU A 1 37 ? 9.685 2.387 -2.988 1.00 93.63 37 A 1 ATOM 293 C CD1 . LEU A 1 37 ? 9.278 2.869 -1.597 1.00 91.33 37 A 1 ATOM 294 C CD2 . LEU A 1 37 ? 8.697 2.963 -4.000 1.00 90.79 37 A 1 ATOM 295 N N . ASN A 1 38 ? 11.852 -0.358 -2.290 1.00 96.34 38 A 1 ATOM 296 C CA . ASN A 1 38 ? 11.730 -1.758 -2.677 1.00 96.23 38 A 1 ATOM 297 C C . ASN A 1 38 ? 10.395 -1.988 -3.408 1.00 96.48 38 A 1 ATOM 298 O O . ASN A 1 38 ? 9.372 -2.336 -2.809 1.00 96.00 38 A 1 ATOM 299 C CB . ASN A 1 38 ? 11.899 -2.650 -1.441 1.00 95.53 38 A 1 ATOM 300 C CG . ASN A 1 38 ? 11.815 -4.127 -1.784 1.00 95.18 38 A 1 ATOM 301 O OD1 . ASN A 1 38 ? 11.775 -4.538 -2.939 1.00 92.63 38 A 1 ATOM 302 N ND2 . ASN A 1 38 ? 11.771 -4.969 -0.778 1.00 92.22 38 A 1 ATOM 303 N N . HIS A 1 39 ? 10.397 -1.827 -4.724 1.00 96.21 39 A 1 ATOM 304 C CA . HIS A 1 39 ? 9.203 -2.040 -5.545 1.00 96.04 39 A 1 ATOM 305 C C . HIS A 1 39 ? 8.617 -3.453 -5.411 1.00 95.96 39 A 1 ATOM 306 O O . HIS A 1 39 ? 7.396 -3.618 -5.479 1.00 94.88 39 A 1 ATOM 307 C CB . HIS A 1 39 ? 9.523 -1.723 -7.003 1.00 95.76 39 A 1 ATOM 308 C CG . HIS A 1 39 ? 9.615 -0.248 -7.263 1.00 96.10 39 A 1 ATOM 309 N ND1 . HIS A 1 39 ? 8.537 0.618 -7.389 1.00 90.64 39 A 1 ATOM 310 C CD2 . HIS A 1 39 ? 10.762 0.489 -7.410 1.00 90.81 39 A 1 ATOM 311 C CE1 . HIS A 1 39 ? 9.030 1.842 -7.616 1.00 91.84 39 A 1 ATOM 312 N NE2 . HIS A 1 39 ? 10.374 1.800 -7.632 1.00 92.29 39 A 1 ATOM 313 N N . SER A 1 40 ? 9.445 -4.464 -5.154 1.00 95.68 40 A 1 ATOM 314 C CA . SER A 1 40 ? 9.001 -5.854 -4.988 1.00 94.93 40 A 1 ATOM 315 C C . SER A 1 40 ? 8.040 -6.023 -3.805 1.00 95.45 40 A 1 ATOM 316 O O . SER A 1 40 ? 7.069 -6.770 -3.902 1.00 94.40 40 A 1 ATOM 317 C CB . SER A 1 40 ? 10.201 -6.786 -4.795 1.00 93.04 40 A 1 ATOM 318 O OG . SER A 1 40 ? 11.146 -6.612 -5.834 1.00 81.58 40 A 1 ATOM 319 N N . TYR A 1 41 ? 8.254 -5.272 -2.726 1.00 95.72 41 A 1 ATOM 320 C CA . TYR A 1 41 ? 7.343 -5.255 -1.576 1.00 96.10 41 A 1 ATOM 321 C C . TYR A 1 41 ? 5.939 -4.757 -1.969 1.00 96.18 41 A 1 ATOM 322 O O . TYR A 1 41 ? 4.922 -5.314 -1.554 1.00 95.19 41 A 1 ATOM 323 C CB . TYR A 1 41 ? 7.945 -4.375 -0.477 1.00 96.10 41 A 1 ATOM 324 C CG . TYR A 1 41 ? 7.048 -4.201 0.728 1.00 96.49 41 A 1 ATOM 325 C CD1 . TYR A 1 41 ? 6.195 -3.082 0.834 1.00 95.66 41 A 1 ATOM 326 C CD2 . TYR A 1 41 ? 7.056 -5.164 1.756 1.00 95.86 41 A 1 ATOM 327 C CE1 . TYR A 1 41 ? 5.375 -2.918 1.960 1.00 95.42 41 A 1 ATOM 328 C CE2 . TYR A 1 41 ? 6.240 -5.005 2.887 1.00 95.34 41 A 1 ATOM 329 C CZ . TYR A 1 41 ? 5.401 -3.878 2.990 1.00 95.57 41 A 1 ATOM 330 O OH . TYR A 1 41 ? 4.613 -3.714 4.102 1.00 94.40 41 A 1 ATOM 331 N N . PHE A 1 42 ? 5.864 -3.743 -2.821 1.00 96.39 42 A 1 ATOM 332 C CA . PHE A 1 42 ? 4.596 -3.149 -3.254 1.00 96.15 42 A 1 ATOM 333 C C . PHE A 1 42 ? 3.915 -3.900 -4.404 1.00 95.50 42 A 1 ATOM 334 O O . PHE A 1 42 ? 2.705 -3.748 -4.589 1.00 93.68 42 A 1 ATOM 335 C CB . PHE A 1 42 ? 4.811 -1.671 -3.578 1.00 96.27 42 A 1 ATOM 336 C CG . PHE A 1 42 ? 5.174 -0.860 -2.351 1.00 96.68 42 A 1 ATOM 337 C CD1 . PHE A 1 42 ? 4.193 -0.550 -1.389 1.00 95.83 42 A 1 ATOM 338 C CD2 . PHE A 1 42 ? 6.501 -0.451 -2.144 1.00 95.90 42 A 1 ATOM 339 C CE1 . PHE A 1 42 ? 4.529 0.166 -0.236 1.00 95.40 42 A 1 ATOM 340 C CE2 . PHE A 1 42 ? 6.844 0.268 -0.989 1.00 95.43 42 A 1 ATOM 341 C CZ . PHE A 1 42 ? 5.857 0.576 -0.033 1.00 95.75 42 A 1 ATOM 342 N N . LEU A 1 43 ? 4.638 -4.743 -5.123 1.00 95.03 43 A 1 ATOM 343 C CA . LEU A 1 43 ? 4.068 -5.684 -6.097 1.00 93.94 43 A 1 ATOM 344 C C . LEU A 1 43 ? 3.389 -6.881 -5.419 1.00 92.95 43 A 1 ATOM 345 O O . LEU A 1 43 ? 2.537 -7.535 -6.019 1.00 90.63 43 A 1 ATOM 346 C CB . LEU A 1 43 ? 5.179 -6.151 -7.050 1.00 93.56 43 A 1 ATOM 347 C CG . LEU A 1 43 ? 5.675 -5.056 -8.014 1.00 93.19 43 A 1 ATOM 348 C CD1 . LEU A 1 43 ? 6.919 -5.541 -8.753 1.00 91.54 43 A 1 ATOM 349 C CD2 . LEU A 1 43 ? 4.609 -4.680 -9.050 1.00 91.33 43 A 1 ATOM 350 N N . THR A 1 44 ? 3.725 -7.149 -4.161 1.00 93.16 44 A 1 ATOM 351 C CA . THR A 1 44 ? 3.165 -8.257 -3.383 1.00 91.98 44 A 1 ATOM 352 C C . THR A 1 44 ? 2.130 -7.740 -2.380 1.00 92.16 44 A 1 ATOM 353 O O . THR A 1 44 ? 2.244 -6.638 -1.860 1.00 90.17 44 A 1 ATOM 354 C CB . THR A 1 44 ? 4.286 -9.032 -2.677 1.00 89.63 44 A 1 ATOM 355 O OG1 . THR A 1 44 ? 5.345 -9.301 -3.562 1.00 79.59 44 A 1 ATOM 356 C CG2 . THR A 1 44 ? 3.800 -10.389 -2.187 1.00 78.73 44 A 1 ATOM 357 N N . LYS A 1 45 ? 1.098 -8.532 -2.083 1.00 90.62 45 A 1 ATOM 358 C CA . LYS A 1 45 ? 0.137 -8.166 -1.037 1.00 89.44 45 A 1 ATOM 359 C C . LYS A 1 45 ? 0.829 -8.090 0.326 1.00 90.05 45 A 1 ATOM 360 O O . LYS A 1 45 ? 1.769 -8.837 0.603 1.00 88.10 45 A 1 ATOM 361 C CB . LYS A 1 45 ? -1.034 -9.152 -0.991 1.00 86.70 45 A 1 ATOM 362 C CG . LYS A 1 45 ? -1.923 -9.048 -2.238 1.00 77.06 45 A 1 ATOM 363 C CD . LYS A 1 45 ? -3.085 -10.037 -2.127 1.00 72.26 45 A 1 ATOM 364 C CE . LYS A 1 45 ? -3.963 -9.976 -3.376 1.00 62.92 45 A 1 ATOM 365 N NZ . LYS A 1 45 ? -5.033 -11.002 -3.333 1.00 54.94 45 A 1 ATOM 366 N N . LYS A 1 46 ? 0.313 -7.242 1.197 1.00 88.08 46 A 1 ATOM 367 C CA . LYS A 1 46 ? 0.807 -7.142 2.567 1.00 86.78 46 A 1 ATOM 368 C C . LYS A 1 46 ? 0.817 -8.512 3.253 1.00 87.29 46 A 1 ATOM 369 O O . LYS A 1 46 ? -0.156 -9.258 3.166 1.00 81.63 46 A 1 ATOM 370 C CB . LYS A 1 46 ? -0.041 -6.121 3.343 1.00 83.06 46 A 1 ATOM 371 C CG . LYS A 1 46 ? 0.551 -5.945 4.741 1.00 77.46 46 A 1 ATOM 372 C CD . LYS A 1 46 ? -0.128 -4.852 5.539 1.00 71.79 46 A 1 ATOM 373 C CE . LYS A 1 46 ? 0.605 -4.815 6.881 1.00 65.20 46 A 1 ATOM 374 N NZ . LYS A 1 46 ? 0.224 -3.655 7.674 1.00 57.16 46 A 1 ATOM 375 N N . GLY A 1 47 ? 1.916 -8.830 3.922 1.00 86.17 47 A 1 ATOM 376 C CA . GLY A 1 47 ? 2.119 -10.116 4.600 1.00 84.78 47 A 1 ATOM 377 C C . GLY A 1 47 ? 2.471 -11.294 3.688 1.00 86.79 47 A 1 ATOM 378 O O . GLY A 1 47 ? 2.708 -12.384 4.195 1.00 83.36 47 A 1 ATOM 379 N N . GLN A 1 48 ? 2.525 -11.094 2.371 1.00 88.52 48 A 1 ATOM 380 C CA . GLN A 1 48 ? 2.894 -12.128 1.393 1.00 89.28 48 A 1 ATOM 381 C C . GLN A 1 48 ? 4.252 -11.862 0.723 1.00 91.92 48 A 1 ATOM 382 O O . GLN A 1 48 ? 4.654 -12.607 -0.166 1.00 90.44 48 A 1 ATOM 383 C CB . GLN A 1 48 ? 1.786 -12.275 0.333 1.00 86.33 48 A 1 ATOM 384 C CG . GLN A 1 48 ? 0.447 -12.709 0.942 1.00 81.41 48 A 1 ATOM 385 C CD . GLN A 1 48 ? -0.640 -12.962 -0.103 1.00 75.24 48 A 1 ATOM 386 O OE1 . GLN A 1 48 ? -0.603 -12.535 -1.249 1.00 69.34 48 A 1 ATOM 387 N NE2 . GLN A 1 48 ? -1.687 -13.664 0.273 1.00 65.98 48 A 1 ATOM 388 N N . TYR A 1 49 ? 4.951 -10.808 1.126 1.00 91.30 49 A 1 ATOM 389 C CA . TYR A 1 49 ? 6.270 -10.502 0.582 1.00 93.34 49 A 1 ATOM 390 C C . TYR A 1 49 ? 7.282 -11.577 0.999 1.00 94.61 49 A 1 ATOM 391 O O . TYR A 1 49 ? 7.449 -11.874 2.183 1.00 94.03 49 A 1 ATOM 392 C CB . TYR A 1 49 ? 6.716 -9.108 1.034 1.00 93.12 49 A 1 ATOM 393 C CG . TYR A 1 49 ? 8.101 -8.746 0.536 1.00 94.04 49 A 1 ATOM 394 C CD1 . TYR A 1 49 ? 9.172 -8.609 1.440 1.00 92.51 49 A 1 ATOM 395 C CD2 . TYR A 1 49 ? 8.338 -8.589 -0.844 1.00 92.75 49 A 1 ATOM 396 C CE1 . TYR A 1 49 ? 10.462 -8.315 0.977 1.00 92.52 49 A 1 ATOM 397 C CE2 . TYR A 1 49 ? 9.629 -8.301 -1.320 1.00 92.40 49 A 1 ATOM 398 C CZ . TYR A 1 49 ? 10.688 -8.164 -0.403 1.00 93.04 49 A 1 ATOM 399 O OH . TYR A 1 49 ? 11.951 -7.887 -0.864 1.00 91.55 49 A 1 ATOM 400 N N . TRP A 1 50 ? 7.958 -12.150 0.001 1.00 94.48 50 A 1 ATOM 401 C CA . TRP A 1 50 ? 9.008 -13.140 0.214 1.00 95.35 50 A 1 ATOM 402 C C . TRP A 1 50 ? 10.338 -12.431 0.430 1.00 95.43 50 A 1 ATOM 403 O O . TRP A 1 50 ? 10.950 -11.927 -0.516 1.00 94.25 50 A 1 ATOM 404 C CB . TRP A 1 50 ? 9.058 -14.100 -0.966 1.00 95.66 50 A 1 ATOM 405 C CG . TRP A 1 50 ? 9.967 -15.271 -0.729 1.00 96.21 50 A 1 ATOM 406 C CD1 . TRP A 1 50 ? 11.234 -15.405 -1.175 1.00 95.30 50 A 1 ATOM 407 C CD2 . TRP A 1 50 ? 9.665 -16.485 0.023 1.00 96.38 50 A 1 ATOM 408 N NE1 . TRP A 1 50 ? 11.738 -16.638 -0.778 1.00 95.68 50 A 1 ATOM 409 C CE2 . TRP A 1 50 ? 10.807 -17.334 -0.047 1.00 96.33 50 A 1 ATOM 410 C CE3 . TRP A 1 50 ? 8.533 -16.950 0.729 1.00 96.55 50 A 1 ATOM 411 C CZ2 . TRP A 1 50 ? 10.827 -18.607 0.567 1.00 96.49 50 A 1 ATOM 412 C CZ3 . TRP A 1 50 ? 8.554 -18.216 1.338 1.00 96.05 50 A 1 ATOM 413 C CH2 . TRP A 1 50 ? 9.690 -19.036 1.256 1.00 96.15 50 A 1 ATOM 414 N N . THR A 1 51 ? 10.779 -12.398 1.686 1.00 95.17 51 A 1 ATOM 415 C CA . THR A 1 51 ? 12.006 -11.697 2.072 1.00 95.06 51 A 1 ATOM 416 C C . THR A 1 51 ? 13.263 -12.489 1.678 1.00 95.60 51 A 1 ATOM 417 O O . THR A 1 51 ? 13.202 -13.717 1.532 1.00 95.54 51 A 1 ATOM 418 C CB . THR A 1 51 ? 12.029 -11.396 3.579 1.00 94.29 51 A 1 ATOM 419 O OG1 . THR A 1 51 ? 12.175 -12.581 4.325 1.00 90.61 51 A 1 ATOM 420 C CG2 . THR A 1 51 ? 10.768 -10.687 4.072 1.00 90.40 51 A 1 ATOM 421 N N . PRO A 1 52 ? 14.434 -11.837 1.582 1.00 94.62 52 A 1 ATOM 422 C CA . PRO A 1 52 ? 15.712 -12.550 1.448 1.00 94.48 52 A 1 ATOM 423 C C . PRO A 1 52 ? 15.956 -13.569 2.572 1.00 96.00 52 A 1 ATOM 424 O O . PRO A 1 52 ? 16.517 -14.636 2.326 1.00 95.87 52 A 1 ATOM 425 C CB . PRO A 1 52 ? 16.783 -11.455 1.449 1.00 92.64 52 A 1 ATOM 426 C CG . PRO A 1 52 ? 16.037 -10.225 0.929 1.00 89.76 52 A 1 ATOM 427 C CD . PRO A 1 52 ? 14.640 -10.397 1.519 1.00 92.53 52 A 1 ATOM 428 N N . LEU A 1 53 ? 15.481 -13.281 3.778 1.00 94.54 53 A 1 ATOM 429 C CA . LEU A 1 53 ? 15.553 -14.205 4.911 1.00 95.29 53 A 1 ATOM 430 C C . LEU A 1 53 ? 14.711 -15.463 4.661 1.00 96.89 53 A 1 ATOM 431 O O . LEU A 1 53 ? 15.191 -16.571 4.891 1.00 97.05 53 A 1 ATOM 432 C CB . LEU A 1 53 ? 15.111 -13.468 6.187 1.00 94.08 53 A 1 ATOM 433 C CG . LEU A 1 53 ? 15.277 -14.303 7.472 1.00 87.00 53 A 1 ATOM 434 C CD1 . LEU A 1 53 ? 16.752 -14.559 7.796 1.00 82.13 53 A 1 ATOM 435 C CD2 . LEU A 1 53 ? 14.645 -13.552 8.647 1.00 82.11 53 A 1 ATOM 436 N N . ASN A 1 54 ? 13.497 -15.309 4.127 1.00 96.87 54 A 1 ATOM 437 C CA . ASN A 1 54 ? 12.644 -16.439 3.754 1.00 97.37 54 A 1 ATOM 438 C C . ASN A 1 54 ? 13.294 -17.287 2.652 1.00 98.02 54 A 1 ATOM 439 O O . ASN A 1 54 ? 13.214 -18.511 2.690 1.00 98.09 54 A 1 ATOM 440 C CB . ASN A 1 54 ? 11.281 -15.923 3.270 1.00 96.93 54 A 1 ATOM 441 C CG . ASN A 1 54 ? 10.422 -15.268 4.338 1.00 95.88 54 A 1 ATOM 442 O OD1 . ASN A 1 54 ? 10.716 -15.236 5.515 1.00 89.35 54 A 1 ATOM 443 N ND2 . ASN A 1 54 ? 9.299 -14.706 3.936 1.00 87.63 54 A 1 ATOM 444 N N . GLN A 1 55 ? 13.951 -16.646 1.688 1.00 97.40 55 A 1 ATOM 445 C CA . GLN A 1 55 ? 14.670 -17.357 0.629 1.00 97.77 55 A 1 ATOM 446 C C . GLN A 1 55 ? 15.786 -18.231 1.212 1.00 98.31 55 A 1 ATOM 447 O O . GLN A 1 55 ? 15.841 -19.422 0.908 1.00 98.32 55 A 1 ATOM 448 C CB . GLN A 1 55 ? 15.215 -16.343 -0.386 1.00 97.11 55 A 1 ATOM 449 C CG . GLN A 1 55 ? 15.923 -17.004 -1.583 1.00 95.47 55 A 1 ATOM 450 C CD . GLN A 1 55 ? 14.992 -17.778 -2.513 1.00 96.12 55 A 1 ATOM 451 O OE1 . GLN A 1 55 ? 13.775 -17.700 -2.456 1.00 91.66 55 A 1 ATOM 452 N NE2 . GLN A 1 55 ? 15.545 -18.529 -3.433 1.00 90.22 55 A 1 ATOM 453 N N . LYS A 1 56 ? 16.619 -17.670 2.083 1.00 97.97 56 A 1 ATOM 454 C CA . LYS A 1 56 ? 17.685 -18.409 2.771 1.00 98.21 56 A 1 ATOM 455 C C . LYS A 1 56 ? 17.141 -19.533 3.654 1.00 98.55 56 A 1 ATOM 456 O O . LYS A 1 56 ? 17.672 -20.637 3.621 1.00 98.43 56 A 1 ATOM 457 C CB . LYS A 1 56 ? 18.540 -17.431 3.596 1.00 97.80 56 A 1 ATOM 458 C CG . LYS A 1 56 ? 19.514 -16.591 2.752 1.00 88.12 56 A 1 ATOM 459 C CD . LYS A 1 56 ? 20.627 -17.480 2.183 1.00 80.88 56 A 1 ATOM 460 C CE . LYS A 1 56 ? 21.722 -16.695 1.465 1.00 73.60 56 A 1 ATOM 461 N NZ . LYS A 1 56 ? 22.815 -17.619 1.049 1.00 62.22 56 A 1 ATOM 462 N N . ALA A 1 57 ? 16.061 -19.286 4.374 1.00 98.51 57 A 1 ATOM 463 C CA . ALA A 1 57 ? 15.398 -20.294 5.193 1.00 98.53 57 A 1 ATOM 464 C C . ALA A 1 57 ? 14.902 -21.479 4.348 1.00 98.68 57 A 1 ATOM 465 O O . ALA A 1 57 ? 15.131 -22.629 4.711 1.00 98.54 57 A 1 ATOM 466 C CB . ALA A 1 57 ? 14.261 -19.617 5.965 1.00 98.23 57 A 1 ATOM 467 N N . LEU A 1 58 ? 14.294 -21.221 3.184 1.00 98.73 58 A 1 ATOM 468 C CA . LEU A 1 58 ? 13.863 -22.290 2.277 1.00 98.79 58 A 1 ATOM 469 C C . LEU A 1 58 ? 15.054 -23.080 1.719 1.00 98.84 58 A 1 ATOM 470 O O . LEU A 1 58 ? 15.005 -24.307 1.691 1.00 98.74 58 A 1 ATOM 471 C CB . LEU A 1 58 ? 12.996 -21.698 1.159 1.00 98.67 58 A 1 ATOM 472 C CG . LEU A 1 58 ? 12.518 -22.734 0.124 1.00 98.35 58 A 1 ATOM 473 C CD1 . LEU A 1 58 ? 11.731 -23.891 0.741 1.00 97.96 58 A 1 ATOM 474 C CD2 . LEU A 1 58 ? 11.605 -22.042 -0.895 1.00 97.94 58 A 1 ATOM 475 N N . GLN A 1 59 ? 16.114 -22.400 1.295 1.00 98.77 59 A 1 ATOM 476 C CA . GLN A 1 59 ? 17.316 -23.058 0.769 1.00 98.77 59 A 1 ATOM 477 C C . GLN A 1 59 ? 17.962 -23.968 1.820 1.00 98.79 59 A 1 ATOM 478 O O . GLN A 1 59 ? 18.260 -25.125 1.518 1.00 98.59 59 A 1 ATOM 479 C CB . GLN A 1 59 ? 18.304 -22.000 0.265 1.00 98.63 59 A 1 ATOM 480 C CG . GLN A 1 59 ? 17.823 -21.350 -1.042 1.00 98.01 59 A 1 ATOM 481 C CD . GLN A 1 59 ? 18.818 -20.304 -1.533 1.00 97.03 59 A 1 ATOM 482 O OE1 . GLN A 1 59 ? 18.840 -19.175 -1.086 1.00 90.65 59 A 1 ATOM 483 N NE2 . GLN A 1 59 ? 19.686 -20.652 -2.457 1.00 88.55 59 A 1 ATOM 484 N N . ARG A 1 60 ? 18.074 -23.507 3.060 1.00 98.73 60 A 1 ATOM 485 C CA . ARG A 1 60 ? 18.553 -24.307 4.190 1.00 98.63 60 A 1 ATOM 486 C C . ARG A 1 60 ? 17.610 -25.467 4.512 1.00 98.71 60 A 1 ATOM 487 O O . ARG A 1 60 ? 18.067 -26.586 4.720 1.00 98.41 60 A 1 ATOM 488 C CB . ARG A 1 60 ? 18.758 -23.379 5.394 1.00 98.01 60 A 1 ATOM 489 C CG . ARG A 1 60 ? 19.355 -24.135 6.594 1.00 89.93 60 A 1 ATOM 490 C CD . ARG A 1 60 ? 19.699 -23.179 7.736 1.00 89.99 60 A 1 ATOM 491 N NE . ARG A 1 60 ? 18.498 -22.510 8.260 1.00 82.45 60 A 1 ATOM 492 C CZ . ARG A 1 60 ? 18.452 -21.435 9.023 1.00 78.53 60 A 1 ATOM 493 N NH1 . ARG A 1 60 ? 19.531 -20.841 9.440 1.00 68.24 60 A 1 ATOM 494 N NH2 . ARG A 1 60 ? 17.306 -20.950 9.381 1.00 70.04 60 A 1 ATOM 495 N N . GLY A 1 61 ? 16.310 -25.234 4.493 1.00 98.67 61 A 1 ATOM 496 C CA . GLY A 1 61 ? 15.315 -26.284 4.715 1.00 98.66 61 A 1 ATOM 497 C C . GLY A 1 61 ? 15.392 -27.412 3.683 1.00 98.74 61 A 1 ATOM 498 O O . GLY A 1 61 ? 15.283 -28.585 4.038 1.00 98.57 61 A 1 ATOM 499 N N . ILE A 1 62 ? 15.639 -27.086 2.408 1.00 98.81 62 A 1 ATOM 500 C CA . ILE A 1 62 ? 15.859 -28.083 1.343 1.00 98.81 62 A 1 ATOM 501 C C . ILE A 1 62 ? 17.108 -28.925 1.634 1.00 98.80 62 A 1 ATOM 502 O O . ILE A 1 62 ? 17.068 -30.144 1.454 1.00 98.57 62 A 1 ATOM 503 C CB . ILE A 1 62 ? 15.948 -27.391 -0.035 1.00 98.62 62 A 1 ATOM 504 C CG1 . ILE A 1 62 ? 14.566 -26.842 -0.453 1.00 97.61 62 A 1 ATOM 505 C CG2 . ILE A 1 62 ? 16.472 -28.349 -1.127 1.00 97.79 62 A 1 ATOM 506 C CD1 . ILE A 1 62 ? 14.657 -25.786 -1.563 1.00 96.00 62 A 1 ATOM 507 N N . GLU A 1 63 ? 18.184 -28.303 2.102 1.00 98.77 63 A 1 ATOM 508 C CA . GLU A 1 63 ? 19.421 -29.006 2.458 1.00 98.68 63 A 1 ATOM 509 C C . GLU A 1 63 ? 19.238 -29.934 3.672 1.00 98.65 63 A 1 ATOM 510 O O . GLU A 1 63 ? 19.696 -31.080 3.668 1.00 98.15 63 A 1 ATOM 511 C CB . GLU A 1 63 ? 20.511 -27.956 2.702 1.00 98.32 63 A 1 ATOM 512 C CG . GLU A 1 63 ? 21.868 -28.578 3.041 1.00 95.67 63 A 1 ATOM 513 C CD . GLU A 1 63 ? 23.005 -27.548 3.069 1.00 94.98 63 A 1 ATOM 514 O OE1 . GLU A 1 63 ? 24.166 -27.988 3.226 1.00 88.74 63 A 1 ATOM 515 O OE2 . GLU A 1 63 ? 22.737 -26.338 2.898 1.00 90.48 63 A 1 ATOM 516 N N . LEU A 1 64 ? 18.513 -29.479 4.693 1.00 98.65 64 A 1 ATOM 517 C CA . LEU A 1 64 ? 18.327 -30.215 5.943 1.00 98.53 64 A 1 ATOM 518 C C . LEU A 1 64 ? 17.321 -31.363 5.832 1.00 98.60 64 A 1 ATOM 519 O O . LEU A 1 64 ? 17.564 -32.453 6.365 1.00 98.06 64 A 1 ATOM 520 C CB . LEU A 1 64 ? 17.904 -29.232 7.048 1.00 98.11 64 A 1 ATOM 521 C CG . LEU A 1 64 ? 19.000 -28.240 7.478 1.00 95.62 64 A 1 ATOM 522 C CD1 . LEU A 1 64 ? 18.410 -27.258 8.489 1.00 91.37 64 A 1 ATOM 523 C CD2 . LEU A 1 64 ? 20.195 -28.941 8.125 1.00 91.08 64 A 1 ATOM 524 N N . PHE A 1 65 ? 16.194 -31.133 5.145 1.00 98.63 65 A 1 ATOM 525 C CA . PHE A 1 65 ? 15.047 -32.051 5.136 1.00 98.58 65 A 1 ATOM 526 C C . PHE A 1 65 ? 14.795 -32.705 3.780 1.00 98.56 65 A 1 ATOM 527 O O . PHE A 1 65 ? 14.237 -33.800 3.723 1.00 97.65 65 A 1 ATOM 528 C CB . PHE A 1 65 ? 13.810 -31.315 5.657 1.00 98.39 65 A 1 ATOM 529 C CG . PHE A 1 65 ? 13.986 -30.770 7.059 1.00 98.32 65 A 1 ATOM 530 C CD1 . PHE A 1 65 ? 13.912 -31.635 8.167 1.00 97.15 65 A 1 ATOM 531 C CD2 . PHE A 1 65 ? 14.275 -29.408 7.261 1.00 97.31 65 A 1 ATOM 532 C CE1 . PHE A 1 65 ? 14.131 -31.150 9.463 1.00 96.57 65 A 1 ATOM 533 C CE2 . PHE A 1 65 ? 14.498 -28.917 8.557 1.00 96.77 65 A 1 ATOM 534 C CZ . PHE A 1 65 ? 14.431 -29.789 9.658 1.00 96.98 65 A 1 ATOM 535 N N . GLY A 1 66 ? 15.242 -32.097 2.703 1.00 98.37 66 A 1 ATOM 536 C CA . GLY A 1 66 ? 15.040 -32.565 1.336 1.00 98.38 66 A 1 ATOM 537 C C . GLY A 1 66 ? 13.826 -31.945 0.645 1.00 98.52 66 A 1 ATOM 538 O O . GLY A 1 66 ? 12.838 -31.539 1.262 1.00 97.86 66 A 1 ATOM 539 N N . VAL A 1 67 ? 13.896 -31.896 -0.687 1.00 98.52 67 A 1 ATOM 540 C CA . VAL A 1 67 ? 12.820 -31.396 -1.547 1.00 98.48 67 A 1 ATOM 541 C C . VAL A 1 67 ? 11.549 -32.225 -1.332 1.00 98.36 67 A 1 ATOM 542 O O . VAL A 1 67 ? 11.597 -33.452 -1.287 1.00 97.61 67 A 1 ATOM 543 C CB . VAL A 1 67 ? 13.240 -31.430 -3.026 1.00 98.07 67 A 1 ATOM 544 C CG1 . VAL A 1 67 ? 12.127 -30.946 -3.956 1.00 96.89 67 A 1 ATOM 545 C CG2 . VAL A 1 67 ? 14.466 -30.546 -3.281 1.00 97.06 67 A 1 ATOM 546 N N . GLY A 1 68 ? 10.403 -31.544 -1.211 1.00 97.73 68 A 1 ATOM 547 C CA . GLY A 1 68 ? 9.097 -32.181 -1.008 1.00 97.29 68 A 1 ATOM 548 C C . GLY A 1 68 ? 8.710 -32.379 0.457 1.00 97.62 68 A 1 ATOM 549 O O . GLY A 1 68 ? 7.518 -32.495 0.750 1.00 96.33 68 A 1 ATOM 550 N N . ASN A 1 69 ? 9.664 -32.325 1.386 1.00 98.23 69 A 1 ATOM 551 C CA . ASN A 1 69 ? 9.410 -32.424 2.828 1.00 98.32 69 A 1 ATOM 552 C C . ASN A 1 69 ? 8.940 -31.077 3.410 1.00 98.41 69 A 1 ATOM 553 O O . ASN A 1 69 ? 9.502 -30.515 4.351 1.00 97.75 69 A 1 ATOM 554 C CB . ASN A 1 69 ? 10.638 -33.029 3.519 1.00 98.09 69 A 1 ATOM 555 C CG . ASN A 1 69 ? 10.880 -34.464 3.091 1.00 97.09 69 A 1 ATOM 556 O OD1 . ASN A 1 69 ? 9.972 -35.245 2.839 1.00 88.65 69 A 1 ATOM 557 N ND2 . ASN A 1 69 ? 12.123 -34.869 2.985 1.00 87.57 69 A 1 ATOM 558 N N . TRP A 1 70 ? 7.881 -30.530 2.808 1.00 98.26 70 A 1 ATOM 559 C CA . TRP A 1 70 ? 7.414 -29.171 3.084 1.00 98.09 70 A 1 ATOM 560 C C . TRP A 1 70 ? 6.914 -28.966 4.507 1.00 98.23 70 A 1 ATOM 561 O O . TRP A 1 70 ? 7.000 -27.853 5.021 1.00 97.80 70 A 1 ATOM 562 C CB . TRP A 1 70 ? 6.296 -28.805 2.107 1.00 97.50 70 A 1 ATOM 563 C CG . TRP A 1 70 ? 6.609 -29.020 0.661 1.00 97.36 70 A 1 ATOM 564 C CD1 . TRP A 1 70 ? 5.846 -29.707 -0.209 1.00 96.28 70 A 1 ATOM 565 C CD2 . TRP A 1 70 ? 7.784 -28.581 -0.083 1.00 97.15 70 A 1 ATOM 566 N NE1 . TRP A 1 70 ? 6.458 -29.734 -1.449 1.00 95.82 70 A 1 ATOM 567 C CE2 . TRP A 1 70 ? 7.661 -29.062 -1.414 1.00 96.49 70 A 1 ATOM 568 C CE3 . TRP A 1 70 ? 8.948 -27.842 0.242 1.00 96.27 70 A 1 ATOM 569 C CZ2 . TRP A 1 70 ? 8.653 -28.832 -2.385 1.00 95.17 70 A 1 ATOM 570 C CZ3 . TRP A 1 70 ? 9.941 -27.616 -0.727 1.00 95.07 70 A 1 ATOM 571 C CH2 . TRP A 1 70 ? 9.794 -28.112 -2.025 1.00 94.88 70 A 1 ATOM 572 N N . LYS A 1 71 ? 6.350 -29.995 5.149 1.00 98.14 71 A 1 ATOM 573 C CA . LYS A 1 71 ? 5.856 -29.880 6.524 1.00 97.97 71 A 1 ATOM 574 C C . LYS A 1 71 ? 7.008 -29.677 7.500 1.00 98.19 71 A 1 ATOM 575 O O . LYS A 1 71 ? 6.931 -28.787 8.338 1.00 97.65 71 A 1 ATOM 576 C CB . LYS A 1 71 ? 5.034 -31.107 6.921 1.00 97.22 71 A 1 ATOM 577 C CG . LYS A 1 71 ? 3.665 -31.141 6.226 1.00 85.86 71 A 1 ATOM 578 C CD . LYS A 1 71 ? 2.886 -32.353 6.738 1.00 82.71 71 A 1 ATOM 579 C CE . LYS A 1 71 ? 1.503 -32.425 6.097 1.00 70.23 71 A 1 ATOM 580 N NZ . LYS A 1 71 ? 0.766 -33.624 6.578 1.00 60.49 71 A 1 ATOM 581 N N . GLU A 1 72 ? 8.058 -30.464 7.348 1.00 98.27 72 A 1 ATOM 582 C CA . GLU A 1 72 ? 9.280 -30.410 8.143 1.00 98.29 72 A 1 ATOM 583 C C . GLU A 1 72 ? 9.987 -29.064 7.938 1.00 98.43 72 A 1 ATOM 584 O O . GLU A 1 72 ? 10.225 -28.345 8.905 1.00 97.91 72 A 1 ATOM 585 C CB . GLU A 1 72 ? 10.187 -31.592 7.761 1.00 97.83 72 A 1 ATOM 586 C CG . GLU A 1 72 ? 9.633 -32.993 8.097 1.00 92.53 72 A 1 ATOM 587 C CD . GLU A 1 72 ? 8.518 -33.540 7.181 1.00 86.50 72 A 1 ATOM 588 O OE1 . GLU A 1 72 ? 7.996 -34.628 7.505 1.00 75.91 72 A 1 ATOM 589 O OE2 . GLU A 1 72 ? 8.133 -32.884 6.181 1.00 76.11 72 A 1 ATOM 590 N N . ILE A 1 73 ? 10.187 -28.664 6.679 1.00 98.58 73 A 1 ATOM 591 C CA . ILE A 1 73 ? 10.770 -27.359 6.328 1.00 98.62 73 A 1 ATOM 592 C C . ILE A 1 73 ? 9.939 -26.218 6.920 1.00 98.59 73 A 1 ATOM 593 O O . ILE A 1 73 ? 10.475 -25.292 7.523 1.00 98.30 73 A 1 ATOM 594 C CB . ILE A 1 73 ? 10.895 -27.215 4.793 1.00 98.55 73 A 1 ATOM 595 C CG1 . ILE A 1 73 ? 11.902 -28.247 4.228 1.00 98.17 73 A 1 ATOM 596 C CG2 . ILE A 1 73 ? 11.322 -25.787 4.398 1.00 98.18 73 A 1 ATOM 597 C CD1 . ILE A 1 73 ? 11.935 -28.334 2.697 1.00 97.29 73 A 1 ATOM 598 N N . ASN A 1 74 ? 8.611 -26.276 6.774 1.00 98.52 74 A 1 ATOM 599 C CA . ASN A 1 74 ? 7.735 -25.225 7.290 1.00 98.37 74 A 1 ATOM 600 C C . ASN A 1 74 ? 7.805 -25.118 8.819 1.00 98.24 74 A 1 ATOM 601 O O . ASN A 1 74 ? 7.802 -24.014 9.361 1.00 97.65 74 A 1 ATOM 602 C CB . ASN A 1 74 ? 6.302 -25.503 6.812 1.00 97.91 74 A 1 ATOM 603 C CG . ASN A 1 74 ? 5.330 -24.371 7.116 1.00 97.60 74 A 1 ATOM 604 O OD1 . ASN A 1 74 ? 5.667 -23.254 7.448 1.00 94.84 74 A 1 ATOM 605 N ND2 . ASN A 1 74 ? 4.047 -24.627 6.979 1.00 94.03 74 A 1 ATOM 606 N N . TYR A 1 75 ? 7.854 -26.257 9.517 1.00 98.33 75 A 1 ATOM 607 C CA . TYR A 1 75 ? 7.878 -26.266 10.977 1.00 98.08 75 A 1 ATOM 608 C C . TYR A 1 75 ? 9.213 -25.764 11.534 1.00 98.13 75 A 1 ATOM 609 O O . TYR A 1 75 ? 9.211 -24.924 12.437 1.00 97.05 75 A 1 ATOM 610 C CB . TYR A 1 75 ? 7.533 -27.671 11.480 1.00 97.38 75 A 1 ATOM 611 C CG . TYR A 1 75 ? 6.970 -27.658 12.880 1.00 88.15 75 A 1 ATOM 612 C CD1 . TYR A 1 75 ? 7.818 -27.785 13.998 1.00 81.43 75 A 1 ATOM 613 C CD2 . TYR A 1 75 ? 5.580 -27.500 13.075 1.00 80.03 75 A 1 ATOM 614 C CE1 . TYR A 1 75 ? 7.287 -27.757 15.295 1.00 73.19 75 A 1 ATOM 615 C CE2 . TYR A 1 75 ? 5.040 -27.471 14.368 1.00 71.53 75 A 1 ATOM 616 C CZ . TYR A 1 75 ? 5.900 -27.602 15.475 1.00 70.25 75 A 1 ATOM 617 O OH . TYR A 1 75 ? 5.378 -27.579 16.744 1.00 69.86 75 A 1 ATOM 618 N N . ASP A 1 76 ? 10.324 -26.221 10.960 1.00 98.04 76 A 1 ATOM 619 C CA . ASP A 1 76 ? 11.670 -25.869 11.415 1.00 97.82 76 A 1 ATOM 620 C C . ASP A 1 76 ? 12.065 -24.443 11.006 1.00 97.88 76 A 1 ATOM 621 O O . ASP A 1 76 ? 12.382 -23.598 11.845 1.00 96.69 76 A 1 ATOM 622 C CB . ASP A 1 76 ? 12.646 -26.915 10.867 1.00 97.25 76 A 1 ATOM 623 C CG . ASP A 1 76 ? 14.022 -26.803 11.510 1.00 92.42 76 A 1 ATOM 624 O OD1 . ASP A 1 76 ? 14.121 -27.186 12.698 1.00 84.26 76 A 1 ATOM 625 O OD2 . ASP A 1 76 ? 14.967 -26.384 10.812 1.00 83.42 76 A 1 ATOM 626 N N . GLU A 1 77 ? 11.952 -24.131 9.716 1.00 98.07 77 A 1 ATOM 627 C CA . GLU A 1 77 ? 12.477 -22.893 9.140 1.00 97.95 77 A 1 ATOM 628 C C . GLU A 1 77 ? 11.495 -21.719 9.170 1.00 97.83 77 A 1 ATOM 629 O O . GLU A 1 77 ? 11.903 -20.556 9.155 1.00 96.29 77 A 1 ATOM 630 C CB . GLU A 1 77 ? 12.922 -23.177 7.698 1.00 97.51 77 A 1 ATOM 631 C CG . GLU A 1 77 ? 14.112 -24.147 7.612 1.00 95.39 77 A 1 ATOM 632 C CD . GLU A 1 77 ? 15.377 -23.523 8.213 1.00 94.90 77 A 1 ATOM 633 O OE1 . GLU A 1 77 ? 16.338 -24.234 8.541 1.00 87.56 77 A 1 ATOM 634 O OE2 . GLU A 1 77 ? 15.448 -22.276 8.312 1.00 89.72 77 A 1 ATOM 635 N N . PHE A 1 78 ? 10.182 -21.993 9.201 1.00 97.85 78 A 1 ATOM 636 C CA . PHE A 1 78 ? 9.140 -20.965 9.104 1.00 97.72 78 A 1 ATOM 637 C C . PHE A 1 78 ? 8.177 -20.954 10.297 1.00 97.29 78 A 1 ATOM 638 O O . PHE A 1 78 ? 7.156 -20.249 10.266 1.00 95.11 78 A 1 ATOM 639 C CB . PHE A 1 78 ? 8.400 -21.087 7.767 1.00 97.65 78 A 1 ATOM 640 C CG . PHE A 1 78 ? 9.281 -20.908 6.550 1.00 98.05 78 A 1 ATOM 641 C CD1 . PHE A 1 78 ? 9.473 -19.626 5.995 1.00 97.56 78 A 1 ATOM 642 C CD2 . PHE A 1 78 ? 9.935 -22.011 5.974 1.00 97.62 78 A 1 ATOM 643 C CE1 . PHE A 1 78 ? 10.297 -19.453 4.876 1.00 97.34 78 A 1 ATOM 644 C CE2 . PHE A 1 78 ? 10.768 -21.844 4.855 1.00 97.44 78 A 1 ATOM 645 C CZ . PHE A 1 78 ? 10.948 -20.565 4.306 1.00 97.74 78 A 1 ATOM 646 N N . SER A 1 79 ? 8.455 -21.712 11.345 1.00 97.80 79 A 1 ATOM 647 C CA . SER A 1 79 ? 7.582 -21.852 12.521 1.00 97.35 79 A 1 ATOM 648 C C . SER A 1 79 ? 6.141 -22.265 12.162 1.00 97.48 79 A 1 ATOM 649 O O . SER A 1 79 ? 5.178 -21.806 12.785 1.00 95.04 79 A 1 ATOM 650 C CB . SER A 1 79 ? 7.604 -20.581 13.380 1.00 96.16 79 A 1 ATOM 651 O OG . SER A 1 79 ? 8.913 -20.180 13.723 1.00 89.26 79 A 1 ATOM 652 N N . GLY A 1 80 ? 5.974 -23.052 11.109 1.00 97.05 80 A 1 ATOM 653 C CA . GLY A 1 80 ? 4.679 -23.517 10.598 1.00 96.80 80 A 1 ATOM 654 C C . GLY A 1 80 ? 3.820 -22.452 9.903 1.00 96.70 80 A 1 ATOM 655 O O . GLY A 1 80 ? 2.656 -22.720 9.593 1.00 94.58 80 A 1 ATOM 656 N N . LYS A 1 81 ? 4.352 -21.253 9.660 1.00 96.44 81 A 1 ATOM 657 C CA . LYS A 1 81 ? 3.582 -20.107 9.131 1.00 95.08 81 A 1 ATOM 658 C C . LYS A 1 81 ? 3.614 -19.984 7.608 1.00 95.00 81 A 1 ATOM 659 O O . LYS A 1 81 ? 2.823 -19.220 7.049 1.00 92.78 81 A 1 ATOM 660 C CB . LYS A 1 81 ? 4.080 -18.807 9.772 1.00 93.58 81 A 1 ATOM 661 C CG . LYS A 1 81 ? 3.852 -18.779 11.290 1.00 89.61 81 A 1 ATOM 662 C CD . LYS A 1 81 ? 4.401 -17.481 11.880 1.00 81.36 81 A 1 ATOM 663 C CE . LYS A 1 81 ? 4.239 -17.507 13.400 1.00 74.06 81 A 1 ATOM 664 N NZ . LYS A 1 81 ? 4.912 -16.353 14.040 1.00 64.31 81 A 1 ATOM 665 N N . ALA A 1 82 ? 4.514 -20.688 6.929 1.00 95.23 82 A 1 ATOM 666 C CA . ALA A 1 82 ? 4.631 -20.616 5.480 1.00 95.25 82 A 1 ATOM 667 C C . ALA A 1 82 ? 3.479 -21.356 4.782 1.00 94.95 82 A 1 ATOM 668 O O . ALA A 1 82 ? 2.918 -22.333 5.281 1.00 93.43 82 A 1 ATOM 669 C CB . ALA A 1 82 ? 6.000 -21.134 5.037 1.00 94.97 82 A 1 ATOM 670 N N . ASN A 1 83 ? 3.148 -20.893 3.568 1.00 95.41 83 A 1 ATOM 671 C CA . ASN A 1 83 ? 2.253 -21.622 2.682 1.00 94.80 83 A 1 ATOM 672 C C . ASN A 1 83 ? 3.050 -22.725 1.966 1.00 95.57 83 A 1 ATOM 673 O O . ASN A 1 83 ? 3.931 -22.430 1.163 1.00 94.87 83 A 1 ATOM 674 C CB . ASN A 1 83 ? 1.603 -20.619 1.719 1.00 92.59 83 A 1 ATOM 675 C CG . ASN A 1 83 ? 0.617 -21.260 0.760 1.00 89.39 83 A 1 ATOM 676 O OD1 . ASN A 1 83 ? 0.544 -22.459 0.572 1.00 81.89 83 A 1 ATOM 677 N ND2 . ASN A 1 83 ? -0.188 -20.453 0.107 1.00 80.11 83 A 1 ATOM 678 N N . ILE A 1 84 ? 2.705 -23.991 2.214 1.00 94.11 84 A 1 ATOM 679 C CA . ILE A 1 84 ? 3.385 -25.154 1.613 1.00 94.52 84 A 1 ATOM 680 C C . ILE A 1 84 ? 3.394 -25.086 0.076 1.00 95.27 84 A 1 ATOM 681 O O . ILE A 1 84 ? 4.398 -25.409 -0.551 1.00 94.09 84 A 1 ATOM 682 C CB . ILE A 1 84 ? 2.731 -26.460 2.122 1.00 92.28 84 A 1 ATOM 683 C CG1 . ILE A 1 84 ? 3.046 -26.647 3.626 1.00 84.50 84 A 1 ATOM 684 C CG2 . ILE A 1 84 ? 3.191 -27.677 1.308 1.00 81.32 84 A 1 ATOM 685 C CD1 . ILE A 1 84 ? 2.328 -27.834 4.281 1.00 77.49 84 A 1 ATOM 686 N N . VAL A 1 85 ? 2.306 -24.617 -0.538 1.00 94.30 85 A 1 ATOM 687 C CA . VAL A 1 85 ? 2.243 -24.439 -1.999 1.00 93.64 85 A 1 ATOM 688 C C . VAL A 1 85 ? 3.257 -23.393 -2.458 1.00 94.63 85 A 1 ATOM 689 O O . VAL A 1 85 ? 3.903 -23.570 -3.488 1.00 94.26 85 A 1 ATOM 690 C CB . VAL A 1 85 ? 0.827 -24.044 -2.455 1.00 91.86 85 A 1 ATOM 691 C CG1 . VAL A 1 85 ? 0.737 -23.859 -3.971 1.00 87.04 85 A 1 ATOM 692 C CG2 . VAL A 1 85 ? -0.202 -25.109 -2.052 1.00 86.91 85 A 1 ATOM 693 N N . GLU A 1 86 ? 3.442 -22.324 -1.693 1.00 94.70 86 A 1 ATOM 694 C CA . GLU A 1 86 ? 4.465 -21.331 -2.006 1.00 95.14 86 A 1 ATOM 695 C C . GLU A 1 86 ? 5.873 -21.921 -1.881 1.00 95.96 86 A 1 ATOM 696 O O . GLU A 1 86 ? 6.690 -21.689 -2.766 1.00 95.82 86 A 1 ATOM 697 C CB . GLU A 1 86 ? 4.284 -20.066 -1.157 1.00 94.27 86 A 1 ATOM 698 C CG . GLU A 1 86 ? 5.311 -18.997 -1.550 1.00 93.01 86 A 1 ATOM 699 C CD . GLU A 1 86 ? 5.043 -17.603 -0.984 1.00 92.78 86 A 1 ATOM 700 O OE1 . GLU A 1 86 ? 5.695 -16.662 -1.506 1.00 88.26 86 A 1 ATOM 701 O OE2 . GLU A 1 86 ? 4.193 -17.454 -0.081 1.00 89.32 86 A 1 ATOM 702 N N . LEU A 1 87 ? 6.147 -22.741 -0.858 1.00 96.56 87 A 1 ATOM 703 C CA . LEU A 1 87 ? 7.445 -23.413 -0.709 1.00 97.36 87 A 1 ATOM 704 C C . LEU A 1 87 ? 7.776 -24.276 -1.934 1.00 97.42 87 A 1 ATOM 705 O O . LEU A 1 87 ? 8.889 -24.202 -2.453 1.00 97.29 87 A 1 ATOM 706 C CB . LEU A 1 87 ? 7.482 -24.269 0.570 1.00 97.70 87 A 1 ATOM 707 C CG . LEU A 1 87 ? 7.272 -23.521 1.898 1.00 97.12 87 A 1 ATOM 708 C CD1 . LEU A 1 87 ? 7.415 -24.499 3.063 1.00 96.59 87 A 1 ATOM 709 C CD2 . LEU A 1 87 ? 8.267 -22.379 2.095 1.00 96.09 87 A 1 ATOM 710 N N . GLU A 1 88 ? 6.803 -25.021 -2.451 1.00 96.79 88 A 1 ATOM 711 C CA . GLU A 1 88 ? 6.971 -25.820 -3.668 1.00 96.27 88 A 1 ATOM 712 C C . GLU A 1 88 ? 7.256 -24.941 -4.898 1.00 96.77 88 A 1 ATOM 713 O O . GLU A 1 88 ? 8.203 -25.187 -5.651 1.00 96.28 88 A 1 ATOM 714 C CB . GLU A 1 88 ? 5.721 -26.683 -3.881 1.00 94.81 88 A 1 ATOM 715 C CG . GLU A 1 88 ? 5.921 -27.684 -5.022 1.00 88.54 88 A 1 ATOM 716 C CD . GLU A 1 88 ? 4.685 -28.538 -5.325 1.00 82.88 88 A 1 ATOM 717 O OE1 . GLU A 1 88 ? 4.745 -29.253 -6.354 1.00 75.59 88 A 1 ATOM 718 O OE2 . GLU A 1 88 ? 3.685 -28.460 -4.575 1.00 75.44 88 A 1 ATOM 719 N N . LEU A 1 89 ? 6.478 -23.872 -5.091 1.00 96.42 89 A 1 ATOM 720 C CA . LEU A 1 89 ? 6.664 -22.948 -6.214 1.00 96.28 89 A 1 ATOM 721 C C . LEU A 1 89 ? 8.019 -22.229 -6.149 1.00 96.85 89 A 1 ATOM 722 O O . LEU A 1 89 ? 8.704 -22.105 -7.167 1.00 96.66 89 A 1 ATOM 723 C CB . LEU A 1 89 ? 5.517 -21.924 -6.230 1.00 95.34 89 A 1 ATOM 724 C CG . LEU A 1 89 ? 4.133 -22.501 -6.579 1.00 93.05 89 A 1 ATOM 725 C CD1 . LEU A 1 89 ? 3.082 -21.399 -6.453 1.00 89.85 89 A 1 ATOM 726 C CD2 . LEU A 1 89 ? 4.081 -23.057 -7.999 1.00 89.38 89 A 1 ATOM 727 N N . ARG A 1 90 ? 8.422 -21.794 -4.961 1.00 97.52 90 A 1 ATOM 728 C CA . ARG A 1 90 ? 9.730 -21.168 -4.713 1.00 97.59 90 A 1 ATOM 729 C C . ARG A 1 90 ? 10.867 -22.149 -4.980 1.00 97.97 90 A 1 ATOM 730 O O . ARG A 1 90 ? 11.856 -21.772 -5.596 1.00 97.70 90 A 1 ATOM 731 C CB . ARG A 1 90 ? 9.787 -20.658 -3.271 1.00 97.05 90 A 1 ATOM 732 C CG . ARG A 1 90 ? 8.821 -19.497 -2.972 1.00 95.03 90 A 1 ATOM 733 C CD . ARG A 1 90 ? 9.321 -18.158 -3.472 1.00 93.43 90 A 1 ATOM 734 N NE . ARG A 1 90 ? 8.338 -17.116 -3.143 1.00 91.80 90 A 1 ATOM 735 C CZ . ARG A 1 90 ? 8.365 -15.859 -3.517 1.00 92.45 90 A 1 ATOM 736 N NH1 . ARG A 1 90 ? 9.352 -15.356 -4.212 1.00 85.41 90 A 1 ATOM 737 N NH2 . ARG A 1 90 ? 7.369 -15.078 -3.204 1.00 88.34 90 A 1 ATOM 738 N N . THR A 1 91 ? 10.699 -23.421 -4.620 1.00 98.11 91 A 1 ATOM 739 C CA . THR A 1 91 ? 11.688 -24.471 -4.908 1.00 98.37 91 A 1 ATOM 740 C C . THR A 1 91 ? 11.823 -24.737 -6.402 1.00 98.36 91 A 1 ATOM 741 O O . THR A 1 91 ? 12.938 -24.884 -6.896 1.00 98.16 91 A 1 ATOM 742 C CB . THR A 1 91 ? 11.356 -25.758 -4.150 1.00 98.38 91 A 1 ATOM 743 O OG1 . THR A 1 91 ? 11.325 -25.463 -2.775 1.00 96.70 91 A 1 ATOM 744 C CG2 . THR A 1 91 ? 12.416 -26.834 -4.358 1.00 96.72 91 A 1 ATOM 745 N N . CYS A 1 92 ? 10.730 -24.689 -7.169 1.00 98.04 92 A 1 ATOM 746 C CA . CYS A 1 92 ? 10.821 -24.726 -8.633 1.00 97.76 92 A 1 ATOM 747 C C . CYS A 1 92 ? 11.706 -23.594 -9.180 1.00 97.93 92 A 1 ATOM 748 O O . CYS A 1 92 ? 12.506 -23.814 -10.086 1.00 97.61 92 A 1 ATOM 749 C CB . CYS A 1 92 ? 9.419 -24.626 -9.260 1.00 97.07 92 A 1 ATOM 750 S SG . CYS A 1 92 ? 8.381 -26.063 -8.868 1.00 95.59 92 A 1 ATOM 751 N N . MET A 1 93 ? 11.596 -22.386 -8.623 1.00 97.80 93 A 1 ATOM 752 C CA . MET A 1 93 ? 12.444 -21.254 -9.016 1.00 97.54 93 A 1 ATOM 753 C C . MET A 1 93 ? 13.900 -21.425 -8.568 1.00 97.77 93 A 1 ATOM 754 O O . MET A 1 93 ? 14.807 -21.085 -9.325 1.00 97.31 93 A 1 ATOM 755 C CB . MET A 1 93 ? 11.892 -19.955 -8.436 1.00 96.74 93 A 1 ATOM 756 C CG . MET A 1 93 ? 10.527 -19.566 -9.018 1.00 93.74 93 A 1 ATOM 757 S SD . MET A 1 93 ? 9.792 -18.118 -8.208 1.00 89.35 93 A 1 ATOM 758 C CE . MET A 1 93 ? 11.127 -16.906 -8.410 1.00 75.99 93 A 1 ATOM 759 N N . ILE A 1 94 ? 14.127 -21.969 -7.365 1.00 98.33 94 A 1 ATOM 760 C CA . ILE A 1 94 ? 15.469 -22.257 -6.832 1.00 98.42 94 A 1 ATOM 761 C C . ILE A 1 94 ? 16.206 -23.245 -7.738 1.00 98.48 94 A 1 ATOM 762 O O . ILE A 1 94 ? 17.369 -23.018 -8.061 1.00 98.26 94 A 1 ATOM 763 C CB . ILE A 1 94 ? 15.371 -22.768 -5.375 1.00 98.38 94 A 1 ATOM 764 C CG1 . ILE A 1 94 ? 15.020 -21.595 -4.434 1.00 97.92 94 A 1 ATOM 765 C CG2 . ILE A 1 94 ? 16.676 -23.442 -4.906 1.00 97.83 94 A 1 ATOM 766 C CD1 . ILE A 1 94 ? 14.581 -22.038 -3.035 1.00 96.97 94 A 1 ATOM 767 N N . LEU A 1 95 ? 15.520 -24.288 -8.200 1.00 98.28 95 A 1 ATOM 768 C CA . LEU A 1 95 ? 16.088 -25.342 -9.050 1.00 98.44 95 A 1 ATOM 769 C C . LEU A 1 95 ? 15.963 -25.056 -10.559 1.00 98.40 95 A 1 ATOM 770 O O . LEU A 1 95 ? 16.460 -25.822 -11.383 1.00 98.00 95 A 1 ATOM 771 C CB . LEU A 1 95 ? 15.457 -26.691 -8.659 1.00 98.47 95 A 1 ATOM 772 C CG . LEU A 1 95 ? 15.655 -27.102 -7.184 1.00 98.15 95 A 1 ATOM 773 C CD1 . LEU A 1 95 ? 15.003 -28.460 -6.942 1.00 97.62 95 A 1 ATOM 774 C CD2 . LEU A 1 95 ? 17.130 -27.198 -6.793 1.00 97.36 95 A 1 ATOM 775 N N . GLY A 1 96 ? 15.288 -23.966 -10.946 1.00 97.98 96 A 1 ATOM 776 C CA . GLY A 1 96 ? 15.164 -23.544 -12.343 1.00 97.85 96 A 1 ATOM 777 C C . GLY A 1 96 ? 14.337 -24.486 -13.228 1.00 97.94 96 A 1 ATOM 778 O O . GLY A 1 96 ? 14.554 -24.538 -14.439 1.00 97.05 96 A 1 ATOM 779 N N . ILE A 1 97 ? 13.393 -25.234 -12.657 1.00 97.42 97 A 1 ATOM 780 C CA . ILE A 1 97 ? 12.561 -26.209 -13.372 1.00 97.20 97 A 1 ATOM 781 C C . ILE A 1 97 ? 11.110 -26.164 -12.880 1.00 96.79 97 A 1 ATOM 782 O O . ILE A 1 97 ? 10.843 -25.942 -11.702 1.00 95.99 97 A 1 ATOM 783 C CB . ILE A 1 97 ? 13.196 -27.614 -13.280 1.00 96.80 97 A 1 ATOM 784 C CG1 . ILE A 1 97 ? 12.569 -28.580 -14.300 1.00 94.66 97 A 1 ATOM 785 C CG2 . ILE A 1 97 ? 13.124 -28.181 -11.849 1.00 93.11 97 A 1 ATOM 786 C CD1 . ILE A 1 97 ? 13.349 -29.893 -14.457 1.00 92.75 97 A 1 ATOM 787 N N . ASN A 1 98 ? 10.142 -26.357 -13.785 1.00 96.13 98 A 1 ATOM 788 C CA . ASN A 1 98 ? 8.721 -26.284 -13.436 1.00 94.92 98 A 1 ATOM 789 C C . ASN A 1 98 ? 8.192 -27.538 -12.723 1.00 94.62 98 A 1 ATOM 790 O O . ASN A 1 98 ? 7.184 -27.448 -12.029 1.00 92.76 98 A 1 ATOM 791 C CB . ASN A 1 98 ? 7.889 -25.955 -14.687 1.00 93.07 98 A 1 ATOM 792 C CG . ASN A 1 98 ? 7.793 -27.101 -15.684 1.00 92.42 98 A 1 ATOM 793 O OD1 . ASN A 1 98 ? 8.645 -27.959 -15.791 1.00 85.97 98 A 1 ATOM 794 N ND2 . ASN A 1 98 ? 6.737 -27.135 -16.463 1.00 85.94 98 A 1 ATOM 795 N N . ASP A 1 99 ? 8.849 -28.684 -12.894 1.00 94.77 99 A 1 ATOM 796 C CA . ASP A 1 99 ? 8.520 -29.938 -12.221 1.00 94.51 99 A 1 ATOM 797 C C . ASP A 1 99 ? 9.732 -30.422 -11.426 1.00 95.51 99 A 1 ATOM 798 O O . ASP A 1 99 ? 10.766 -30.765 -11.995 1.00 94.80 99 A 1 ATOM 799 C CB . ASP A 1 99 ? 8.051 -30.978 -13.246 1.00 92.45 99 A 1 ATOM 800 C CG . ASP A 1 99 ? 7.594 -32.286 -12.595 1.00 90.56 99 A 1 ATOM 801 O OD1 . ASP A 1 99 ? 7.655 -32.403 -11.349 1.00 86.55 99 A 1 ATOM 802 O OD2 . ASP A 1 99 ? 7.164 -33.175 -13.356 1.00 84.08 99 A 1 ATOM 803 N N . ILE A 1 100 ? 9.597 -30.425 -10.107 1.00 95.56 100 A 1 ATOM 804 C CA . ILE A 1 100 ? 10.657 -30.785 -9.162 1.00 96.11 100 A 1 ATOM 805 C C . ILE A 1 100 ? 10.511 -32.209 -8.622 1.00 96.45 100 A 1 ATOM 806 O O . ILE A 1 100 ? 11.246 -32.594 -7.722 1.00 95.74 100 A 1 ATOM 807 C CB . ILE A 1 100 ? 10.763 -29.746 -8.031 1.00 95.80 100 A 1 ATOM 808 C CG1 . ILE A 1 100 ? 9.411 -29.557 -7.303 1.00 94.12 100 A 1 ATOM 809 C CG2 . ILE A 1 100 ? 11.308 -28.426 -8.602 1.00 92.25 100 A 1 ATOM 810 C CD1 . ILE A 1 100 ? 9.523 -28.725 -6.028 1.00 93.27 100 A 1 ATOM 811 N N . THR A 1 101 ? 9.602 -33.007 -9.179 1.00 95.57 101 A 1 ATOM 812 C CA . THR A 1 101 ? 9.301 -34.370 -8.706 1.00 94.78 101 A 1 ATOM 813 C C . THR A 1 101 ? 10.548 -35.257 -8.687 1.00 95.69 101 A 1 ATOM 814 O O . THR A 1 101 ? 10.742 -36.041 -7.761 1.00 94.64 101 A 1 ATOM 815 C CB . THR A 1 101 ? 8.218 -35.014 -9.585 1.00 92.16 101 A 1 ATOM 816 O OG1 . THR A 1 101 ? 7.094 -34.172 -9.659 1.00 83.27 101 A 1 ATOM 817 C CG2 . THR A 1 101 ? 7.727 -36.350 -9.033 1.00 80.89 101 A 1 ATOM 818 N N . GLU A 1 102 ? 11.458 -35.089 -9.664 1.00 95.88 102 A 1 ATOM 819 C CA . GLU A 1 102 ? 12.714 -35.859 -9.720 1.00 95.93 102 A 1 ATOM 820 C C . GLU A 1 102 ? 13.697 -35.545 -8.576 1.00 96.98 102 A 1 ATOM 821 O O . GLU A 1 102 ? 14.631 -36.317 -8.350 1.00 96.10 102 A 1 ATOM 822 C CB . GLU A 1 102 ? 13.381 -35.662 -11.083 1.00 93.58 102 A 1 ATOM 823 C CG . GLU A 1 102 ? 14.060 -34.284 -11.284 1.00 84.11 102 A 1 ATOM 824 C CD . GLU A 1 102 ? 14.576 -34.118 -12.731 1.00 82.42 102 A 1 ATOM 825 O OE1 . GLU A 1 102 ? 14.747 -32.978 -13.205 1.00 75.36 102 A 1 ATOM 826 O OE2 . GLU A 1 102 ? 14.697 -35.129 -13.466 1.00 78.49 102 A 1 ATOM 827 N N . TYR A 1 103 ? 13.481 -34.442 -7.862 1.00 97.24 103 A 1 ATOM 828 C CA . TYR A 1 103 ? 14.293 -34.019 -6.721 1.00 97.93 103 A 1 ATOM 829 C C . TYR A 1 103 ? 13.673 -34.399 -5.369 1.00 98.24 103 A 1 ATOM 830 O O . TYR A 1 103 ? 14.324 -34.218 -4.347 1.00 97.73 103 A 1 ATOM 831 C CB . TYR A 1 103 ? 14.559 -32.510 -6.806 1.00 97.96 103 A 1 ATOM 832 C CG . TYR A 1 103 ? 15.211 -32.076 -8.100 1.00 98.11 103 A 1 ATOM 833 C CD1 . TYR A 1 103 ? 16.599 -32.234 -8.289 1.00 97.20 103 A 1 ATOM 834 C CD2 . TYR A 1 103 ? 14.429 -31.538 -9.141 1.00 97.32 103 A 1 ATOM 835 C CE1 . TYR A 1 103 ? 17.201 -31.871 -9.505 1.00 96.88 103 A 1 ATOM 836 C CE2 . TYR A 1 103 ? 15.022 -31.172 -10.365 1.00 97.09 103 A 1 ATOM 837 C CZ . TYR A 1 103 ? 16.407 -31.346 -10.545 1.00 97.40 103 A 1 ATOM 838 O OH . TYR A 1 103 ? 16.980 -31.017 -11.744 1.00 96.51 103 A 1 ATOM 839 N N . TYR A 1 104 ? 12.445 -34.926 -5.339 1.00 97.34 104 A 1 ATOM 840 C CA . TYR A 1 104 ? 11.780 -35.271 -4.085 1.00 97.28 104 A 1 ATOM 841 C C . TYR A 1 104 ? 12.618 -36.234 -3.234 1.00 97.59 104 A 1 ATOM 842 O O . TYR A 1 104 ? 13.218 -37.187 -3.727 1.00 95.97 104 A 1 ATOM 843 C CB . TYR A 1 104 ? 10.367 -35.820 -4.332 1.00 95.87 104 A 1 ATOM 844 C CG . TYR A 1 104 ? 9.282 -34.813 -4.684 1.00 93.09 104 A 1 ATOM 845 C CD1 . TYR A 1 104 ? 9.515 -33.424 -4.709 1.00 85.58 104 A 1 ATOM 846 C CD2 . TYR A 1 104 ? 7.979 -35.289 -4.950 1.00 85.10 104 A 1 ATOM 847 C CE1 . TYR A 1 104 ? 8.473 -32.521 -4.990 1.00 82.99 104 A 1 ATOM 848 C CE2 . TYR A 1 104 ? 6.933 -34.395 -5.231 1.00 82.89 104 A 1 ATOM 849 C CZ . TYR A 1 104 ? 7.183 -33.013 -5.251 1.00 83.24 104 A 1 ATOM 850 O OH . TYR A 1 104 ? 6.160 -32.141 -5.520 1.00 81.12 104 A 1 ATOM 851 N N . GLY A 1 105 ? 12.680 -35.935 -1.941 1.00 97.40 105 A 1 ATOM 852 C CA . GLY A 1 105 ? 13.487 -36.655 -0.959 1.00 97.46 105 A 1 ATOM 853 C C . GLY A 1 105 ? 14.984 -36.334 -0.990 1.00 97.93 105 A 1 ATOM 854 O O . GLY A 1 105 ? 15.691 -36.717 -0.057 1.00 96.24 105 A 1 ATOM 855 N N . LYS A 1 106 ? 15.483 -35.634 -2.010 1.00 98.24 106 A 1 ATOM 856 C CA . LYS A 1 106 ? 16.898 -35.262 -2.083 1.00 98.26 106 A 1 ATOM 857 C C . LYS A 1 106 ? 17.174 -34.051 -1.201 1.00 98.48 106 A 1 ATOM 858 O O . LYS A 1 106 ? 16.524 -33.015 -1.346 1.00 97.95 106 A 1 ATOM 859 C CB . LYS A 1 106 ? 17.341 -34.994 -3.523 1.00 97.68 106 A 1 ATOM 860 C CG . LYS A 1 106 ? 17.175 -36.220 -4.430 1.00 94.09 106 A 1 ATOM 861 C CD . LYS A 1 106 ? 17.699 -35.898 -5.834 1.00 89.43 106 A 1 ATOM 862 C CE . LYS A 1 106 ? 17.481 -37.085 -6.770 1.00 82.70 106 A 1 ATOM 863 N NZ . LYS A 1 106 ? 17.784 -36.717 -8.178 1.00 72.20 106 A 1 ATOM 864 N N . LYS A 1 107 ? 18.169 -34.192 -0.339 1.00 98.55 107 A 1 ATOM 865 C CA . LYS A 1 107 ? 18.787 -33.078 0.379 1.00 98.64 107 A 1 ATOM 866 C C . LYS A 1 107 ? 19.845 -32.476 -0.530 1.00 98.61 107 A 1 ATOM 867 O O . LYS A 1 107 ? 20.695 -33.220 -1.019 1.00 97.85 107 A 1 ATOM 868 C CB . LYS A 1 107 ? 19.396 -33.559 1.696 1.00 98.42 107 A 1 ATOM 869 C CG . LYS A 1 107 ? 18.340 -34.167 2.623 1.00 97.85 107 A 1 ATOM 870 C CD . LYS A 1 107 ? 18.980 -34.538 3.960 1.00 96.96 107 A 1 ATOM 871 C CE . LYS A 1 107 ? 17.928 -35.152 4.879 1.00 93.99 107 A 1 ATOM 872 N NZ . LYS A 1 107 ? 18.413 -35.177 6.280 1.00 90.81 107 A 1 ATOM 873 N N . ILE A 1 108 ? 19.745 -31.189 -0.806 1.00 98.69 108 A 1 ATOM 874 C CA . ILE A 1 108 ? 20.578 -30.504 -1.796 1.00 98.72 108 A 1 ATOM 875 C C . ILE A 1 108 ? 21.161 -29.270 -1.117 1.00 98.76 108 A 1 ATOM 876 O O . ILE A 1 108 ? 20.389 -28.422 -0.665 1.00 98.53 108 A 1 ATOM 877 C CB . ILE A 1 108 ? 19.763 -30.127 -3.053 1.00 98.51 108 A 1 ATOM 878 C CG1 . ILE A 1 108 ? 18.935 -31.308 -3.615 1.00 97.32 108 A 1 ATOM 879 C CG2 . ILE A 1 108 ? 20.721 -29.601 -4.130 1.00 97.14 108 A 1 ATOM 880 C CD1 . ILE A 1 108 ? 18.010 -30.930 -4.785 1.00 96.71 108 A 1 ATOM 881 N N . SER A 1 109 ? 22.480 -29.175 -1.067 1.00 98.75 109 A 1 ATOM 882 C CA . SER A 1 109 ? 23.147 -28.014 -0.481 1.00 98.72 109 A 1 ATOM 883 C C . SER A 1 109 ? 22.834 -26.736 -1.257 1.00 98.78 109 A 1 ATOM 884 O O . SER A 1 109 ? 22.427 -26.773 -2.424 1.00 98.53 109 A 1 ATOM 885 C CB . SER A 1 109 ? 24.661 -28.242 -0.407 1.00 98.31 109 A 1 ATOM 886 O OG . SER A 1 109 ? 25.226 -28.250 -1.706 1.00 95.54 109 A 1 ATOM 887 N N . GLU A 1 110 ? 23.037 -25.572 -0.646 1.00 98.46 110 A 1 ATOM 888 C CA . GLU A 1 110 ? 22.783 -24.293 -1.315 1.00 98.14 110 A 1 ATOM 889 C C . GLU A 1 110 ? 23.637 -24.126 -2.587 1.00 98.32 110 A 1 ATOM 890 O O . GLU A 1 110 ? 23.155 -23.615 -3.600 1.00 97.78 110 A 1 ATOM 891 C CB . GLU A 1 110 ? 23.007 -23.137 -0.323 1.00 96.89 110 A 1 ATOM 892 C CG . GLU A 1 110 ? 22.499 -21.817 -0.918 1.00 87.52 110 A 1 ATOM 893 C CD . GLU A 1 110 ? 22.574 -20.584 -0.013 1.00 84.23 110 A 1 ATOM 894 O OE1 . GLU A 1 110 ? 22.235 -19.487 -0.520 1.00 76.72 110 A 1 ATOM 895 O OE2 . GLU A 1 110 ? 22.917 -20.620 1.187 1.00 78.79 110 A 1 ATOM 896 N N . GLU A 1 111 ? 24.881 -24.612 -2.580 1.00 98.41 111 A 1 ATOM 897 C CA . GLU A 1 111 ? 25.765 -24.596 -3.748 1.00 98.32 111 A 1 ATOM 898 C C . GLU A 1 111 ? 25.238 -25.506 -4.866 1.00 98.47 111 A 1 ATOM 899 O O . GLU A 1 111 ? 25.091 -25.071 -6.012 1.00 97.87 111 A 1 ATOM 900 C CB . GLU A 1 111 ? 27.187 -25.007 -3.343 1.00 97.68 111 A 1 ATOM 901 C CG . GLU A 1 111 ? 27.849 -23.955 -2.437 1.00 83.52 111 A 1 ATOM 902 C CD . GLU A 1 111 ? 29.306 -24.282 -2.074 1.00 76.54 111 A 1 ATOM 903 O OE1 . GLU A 1 111 ? 29.977 -23.369 -1.541 1.00 69.71 111 A 1 ATOM 904 O OE2 . GLU A 1 111 ? 29.759 -25.419 -2.331 1.00 70.91 111 A 1 ATOM 905 N N . GLU A 1 112 ? 24.855 -26.739 -4.535 1.00 98.64 112 A 1 ATOM 906 C CA . GLU A 1 112 ? 24.272 -27.691 -5.487 1.00 98.56 112 A 1 ATOM 907 C C . GLU A 1 112 ? 22.939 -27.191 -6.051 1.00 98.65 112 A 1 ATOM 908 O O . GLU A 1 112 ? 22.664 -27.381 -7.237 1.00 98.36 112 A 1 ATOM 909 C CB . GLU A 1 112 ? 24.041 -29.044 -4.811 1.00 98.06 112 A 1 ATOM 910 C CG . GLU A 1 112 ? 25.329 -29.835 -4.525 1.00 81.15 112 A 1 ATOM 911 C CD . GLU A 1 112 ? 25.035 -31.078 -3.669 1.00 73.94 112 A 1 ATOM 912 O OE1 . GLU A 1 112 ? 25.695 -32.116 -3.887 1.00 67.82 112 A 1 ATOM 913 O OE2 . GLU A 1 112 ? 24.136 -30.999 -2.797 1.00 70.49 112 A 1 ATOM 914 N N . GLN A 1 113 ? 22.111 -26.516 -5.250 1.00 98.77 113 A 1 ATOM 915 C CA . GLN A 1 113 ? 20.867 -25.898 -5.714 1.00 98.75 113 A 1 ATOM 916 C C . GLN A 1 113 ? 21.141 -24.897 -6.849 1.00 98.74 113 A 1 ATOM 917 O O . GLN A 1 113 ? 20.452 -24.920 -7.878 1.00 98.51 113 A 1 ATOM 918 C CB . GLN A 1 113 ? 20.152 -25.181 -4.555 1.00 98.58 113 A 1 ATOM 919 C CG . GLN A 1 113 ? 19.507 -26.121 -3.522 1.00 98.31 113 A 1 ATOM 920 C CD . GLN A 1 113 ? 19.041 -25.355 -2.282 1.00 98.45 113 A 1 ATOM 921 O OE1 . GLN A 1 113 ? 18.538 -24.244 -2.365 1.00 93.81 113 A 1 ATOM 922 N NE2 . GLN A 1 113 ? 19.182 -25.907 -1.098 1.00 94.59 113 A 1 ATOM 923 N N . GLU A 1 114 ? 22.159 -24.060 -6.705 1.00 98.42 114 A 1 ATOM 924 C CA . GLU A 1 114 ? 22.527 -23.073 -7.720 1.00 98.14 114 A 1 ATOM 925 C C . GLU A 1 114 ? 23.142 -23.730 -8.970 1.00 98.32 114 A 1 ATOM 926 O O . GLU A 1 114 ? 22.869 -23.302 -10.097 1.00 97.84 114 A 1 ATOM 927 C CB . GLU A 1 114 ? 23.456 -22.023 -7.090 1.00 97.16 114 A 1 ATOM 928 C CG . GLU A 1 114 ? 23.738 -20.805 -7.990 1.00 80.78 114 A 1 ATOM 929 C CD . GLU A 1 114 ? 22.502 -19.978 -8.410 1.00 69.78 114 A 1 ATOM 930 O OE1 . GLU A 1 114 ? 22.597 -19.279 -9.447 1.00 63.95 114 A 1 ATOM 931 O OE2 . GLU A 1 114 ? 21.446 -20.017 -7.745 1.00 63.26 114 A 1 ATOM 932 N N . GLU A 1 115 ? 23.911 -24.820 -8.821 1.00 98.60 115 A 1 ATOM 933 C CA . GLU A 1 115 ? 24.406 -25.608 -9.955 1.00 98.57 115 A 1 ATOM 934 C C . GLU A 1 115 ? 23.270 -26.283 -10.731 1.00 98.64 115 A 1 ATOM 935 O O . GLU A 1 115 ? 23.209 -26.187 -11.962 1.00 98.30 115 A 1 ATOM 936 C CB . GLU A 1 115 ? 25.408 -26.671 -9.503 1.00 98.29 115 A 1 ATOM 937 C CG . GLU A 1 115 ? 26.762 -26.064 -9.114 1.00 88.13 115 A 1 ATOM 938 C CD . GLU A 1 115 ? 27.901 -27.084 -9.203 1.00 75.28 115 A 1 ATOM 939 O OE1 . GLU A 1 115 ? 29.044 -26.623 -9.422 1.00 68.41 115 A 1 ATOM 940 O OE2 . GLU A 1 115 ? 27.623 -28.306 -9.161 1.00 69.69 115 A 1 ATOM 941 N N . ILE A 1 116 ? 22.328 -26.908 -10.031 1.00 98.63 116 A 1 ATOM 942 C CA . ILE A 1 116 ? 21.140 -27.520 -10.633 1.00 98.60 116 A 1 ATOM 943 C C . ILE A 1 116 ? 20.345 -26.471 -11.408 1.00 98.59 116 A 1 ATOM 944 O O . ILE A 1 116 ? 19.959 -26.715 -12.553 1.00 98.36 116 A 1 ATOM 945 C CB . ILE A 1 116 ? 20.282 -28.214 -9.555 1.00 98.47 116 A 1 ATOM 946 C CG1 . ILE A 1 116 ? 20.999 -29.498 -9.068 1.00 97.75 116 A 1 ATOM 947 C CG2 . ILE A 1 116 ? 18.882 -28.566 -10.093 1.00 97.78 116 A 1 ATOM 948 C CD1 . ILE A 1 116 ? 20.400 -30.086 -7.787 1.00 95.84 116 A 1 ATOM 949 N N . LYS A 1 117 ? 20.138 -25.287 -10.830 1.00 98.60 117 A 1 ATOM 950 C CA . LYS A 1 117 ? 19.454 -24.180 -11.504 1.00 98.47 117 A 1 ATOM 951 C C . LYS A 1 117 ? 20.156 -23.789 -12.799 1.00 98.49 117 A 1 ATOM 952 O O . LYS A 1 117 ? 19.508 -23.708 -13.847 1.00 98.21 117 A 1 ATOM 953 C CB . LYS A 1 117 ? 19.370 -22.994 -10.548 1.00 98.09 117 A 1 ATOM 954 C CG . LYS A 1 117 ? 18.584 -21.814 -11.133 1.00 97.16 117 A 1 ATOM 955 C CD . LYS A 1 117 ? 18.583 -20.715 -10.078 1.00 95.07 117 A 1 ATOM 956 C CE . LYS A 1 117 ? 17.834 -19.461 -10.502 1.00 90.13 117 A 1 ATOM 957 N NZ . LYS A 1 117 ? 17.927 -18.479 -9.397 1.00 84.18 117 A 1 ATOM 958 N N . LYS A 1 118 ? 21.473 -23.586 -12.769 1.00 98.38 118 A 1 ATOM 959 C CA . LYS A 1 118 ? 22.270 -23.257 -13.960 1.00 98.31 118 A 1 ATOM 960 C C . LYS A 1 118 ? 22.164 -24.351 -15.024 1.00 98.36 118 A 1 ATOM 961 O O . LYS A 1 118 ? 21.944 -24.040 -16.200 1.00 98.01 118 A 1 ATOM 962 C CB . LYS A 1 118 ? 23.735 -23.034 -13.557 1.00 97.93 118 A 1 ATOM 963 C CG . LYS A 1 118 ? 23.949 -21.701 -12.823 1.00 90.66 118 A 1 ATOM 964 C CD . LYS A 1 118 ? 25.361 -21.646 -12.230 1.00 88.80 118 A 1 ATOM 965 C CE . LYS A 1 118 ? 25.540 -20.383 -11.381 1.00 79.55 118 A 1 ATOM 966 N NZ . LYS A 1 118 ? 26.731 -20.474 -10.496 1.00 71.04 118 A 1 ATOM 967 N N . SER A 1 119 ? 22.256 -25.615 -14.617 1.00 98.41 119 A 1 ATOM 968 C CA . SER A 1 119 ? 22.120 -26.776 -15.499 1.00 98.33 119 A 1 ATOM 969 C C . SER A 1 119 ? 20.737 -26.835 -16.158 1.00 98.38 119 A 1 ATOM 970 O O . SER A 1 119 ? 20.633 -26.916 -17.383 1.00 97.85 119 A 1 ATOM 971 C CB . SER A 1 119 ? 22.402 -28.052 -14.702 1.00 97.83 119 A 1 ATOM 972 O OG . SER A 1 119 ? 22.369 -29.173 -15.564 1.00 84.20 119 A 1 ATOM 973 N N . ASN A 1 120 ? 19.671 -26.690 -15.376 1.00 98.39 120 A 1 ATOM 974 C CA . ASN A 1 120 ? 18.297 -26.690 -15.874 1.00 98.32 120 A 1 ATOM 975 C C . ASN A 1 120 ? 18.029 -25.520 -16.833 1.00 98.22 120 A 1 ATOM 976 O O . ASN A 1 120 ? 17.446 -25.722 -17.902 1.00 97.75 120 A 1 ATOM 977 C CB . ASN A 1 120 ? 17.329 -26.687 -14.681 1.00 98.14 120 A 1 ATOM 978 C CG . ASN A 1 120 ? 17.172 -28.065 -14.055 1.00 98.10 120 A 1 ATOM 979 O OD1 . ASN A 1 120 ? 17.261 -29.088 -14.717 1.00 94.72 120 A 1 ATOM 980 N ND2 . ASN A 1 120 ? 16.875 -28.125 -12.775 1.00 94.28 120 A 1 ATOM 981 N N . ILE A 1 121 ? 18.509 -24.319 -16.526 1.00 98.06 121 A 1 ATOM 982 C CA . ILE A 1 121 ? 18.402 -23.160 -17.424 1.00 97.75 121 A 1 ATOM 983 C C . ILE A 1 121 ? 19.152 -23.415 -18.740 1.00 97.85 121 A 1 ATOM 984 O O . ILE A 1 121 ? 18.621 -23.131 -19.820 1.00 97.35 121 A 1 ATOM 985 C CB . ILE A 1 121 ? 18.897 -21.882 -16.712 1.00 97.07 121 A 1 ATOM 986 C CG1 . ILE A 1 121 ? 17.883 -21.468 -15.618 1.00 95.37 121 A 1 ATOM 987 C CG2 . ILE A 1 121 ? 19.110 -20.721 -17.704 1.00 95.42 121 A 1 ATOM 988 C CD1 . ILE A 1 121 ? 18.373 -20.340 -14.702 1.00 89.93 121 A 1 ATOM 989 N N . ALA A 1 122 ? 20.371 -23.963 -18.683 1.00 98.14 122 A 1 ATOM 990 C CA . ALA A 1 122 ? 21.150 -24.296 -19.876 1.00 98.17 122 A 1 ATOM 991 C C . ALA A 1 122 ? 20.439 -25.349 -20.741 1.00 98.18 122 A 1 ATOM 992 O O . ALA A 1 122 ? 20.329 -25.183 -21.959 1.00 97.55 122 A 1 ATOM 993 C CB . ALA A 1 122 ? 22.544 -24.759 -19.444 1.00 97.95 122 A 1 ATOM 994 N N . LYS A 1 123 ? 19.883 -26.381 -20.118 1.00 97.87 123 A 1 ATOM 995 C CA . LYS A 1 123 ? 19.101 -27.420 -20.789 1.00 97.44 123 A 1 ATOM 996 C C . LYS A 1 123 ? 17.837 -26.845 -21.427 1.00 97.58 123 A 1 ATOM 997 O O . LYS A 1 123 ? 17.579 -27.100 -22.599 1.00 96.71 123 A 1 ATOM 998 C CB . LYS A 1 123 ? 18.802 -28.534 -19.778 1.00 96.09 123 A 1 ATOM 999 C CG . LYS A 1 123 ? 18.289 -29.804 -20.471 1.00 85.82 123 A 1 ATOM 1000 C CD . LYS A 1 123 ? 18.132 -30.924 -19.435 1.00 84.95 123 A 1 ATOM 1001 C CE . LYS A 1 123 ? 17.725 -32.228 -20.120 1.00 75.75 123 A 1 ATOM 1002 N NZ . LYS A 1 123 ? 17.611 -33.333 -19.138 1.00 68.56 123 A 1 ATOM 1003 N N . GLY A 1 124 ? 17.114 -26.004 -20.705 1.00 97.50 124 A 1 ATOM 1004 C CA . GLY A 1 124 ? 15.932 -25.310 -21.211 1.00 97.25 124 A 1 ATOM 1005 C C . GLY A 1 124 ? 16.226 -24.418 -22.415 1.00 97.35 124 A 1 ATOM 1006 O O . GLY A 1 124 ? 15.470 -24.436 -23.387 1.00 96.63 124 A 1 ATOM 1007 N N . LYS A 1 125 ? 17.348 -23.700 -22.414 1.00 97.59 125 A 1 ATOM 1008 C CA . LYS A 1 125 ? 17.819 -22.924 -23.576 1.00 97.31 125 A 1 ATOM 1009 C C . LYS A 1 125 ? 18.121 -23.831 -24.768 1.00 97.30 125 A 1 ATOM 1010 O O . LYS A 1 125 ? 17.649 -23.557 -25.867 1.00 96.26 125 A 1 ATOM 1011 C CB . LYS A 1 125 ? 19.064 -22.099 -23.218 1.00 96.65 125 A 1 ATOM 1012 C CG . LYS A 1 125 ? 18.729 -20.863 -22.374 1.00 87.32 125 A 1 ATOM 1013 C CD . LYS A 1 125 ? 20.006 -20.110 -21.982 1.00 86.26 125 A 1 ATOM 1014 C CE . LYS A 1 125 ? 19.659 -18.883 -21.130 1.00 78.20 125 A 1 ATOM 1015 N NZ . LYS A 1 125 ? 20.872 -18.134 -20.697 1.00 69.66 125 A 1 ATOM 1016 N N . LYS A 1 126 ? 18.873 -24.917 -24.551 1.00 97.55 126 A 1 ATOM 1017 C CA . LYS A 1 126 ? 19.262 -25.867 -25.605 1.00 97.48 126 A 1 ATOM 1018 C C . LYS A 1 126 ? 18.055 -26.555 -26.248 1.00 97.39 126 A 1 ATOM 1019 O O . LYS A 1 126 ? 18.044 -26.772 -27.456 1.00 96.09 126 A 1 ATOM 1020 C CB . LYS A 1 126 ? 20.243 -26.887 -25.015 1.00 96.88 126 A 1 ATOM 1021 C CG . LYS A 1 126 ? 20.838 -27.814 -26.091 1.00 87.77 126 A 1 ATOM 1022 C CD . LYS A 1 126 ? 21.826 -28.807 -25.467 1.00 84.13 126 A 1 ATOM 1023 C CE . LYS A 1 126 ? 22.391 -29.726 -26.557 1.00 73.06 126 A 1 ATOM 1024 N NZ . LYS A 1 126 ? 23.337 -30.738 -26.008 1.00 63.74 126 A 1 ATOM 1025 N N . GLU A 1 127 ? 17.044 -26.886 -25.453 1.00 97.07 127 A 1 ATOM 1026 C CA . GLU A 1 127 ? 15.810 -27.540 -25.911 1.00 96.39 127 A 1 ATOM 1027 C C . GLU A 1 127 ? 14.716 -26.557 -26.369 1.00 96.30 127 A 1 ATOM 1028 O O . GLU A 1 127 ? 13.628 -26.990 -26.749 1.00 94.19 127 A 1 ATOM 1029 C CB . GLU A 1 127 ? 15.272 -28.458 -24.809 1.00 94.94 127 A 1 ATOM 1030 C CG . GLU A 1 127 ? 16.176 -29.673 -24.534 1.00 91.77 127 A 1 ATOM 1031 C CD . GLU A 1 127 ? 15.549 -30.631 -23.513 1.00 92.01 127 A 1 ATOM 1032 O OE1 . GLU A 1 127 ? 16.309 -31.308 -22.788 1.00 85.83 127 A 1 ATOM 1033 O OE2 . GLU A 1 127 ? 14.295 -30.714 -23.449 1.00 88.51 127 A 1 ATOM 1034 N N . ASN A 1 128 ? 14.979 -25.258 -26.337 1.00 96.62 128 A 1 ATOM 1035 C CA . ASN A 1 128 ? 14.008 -24.201 -26.625 1.00 96.43 128 A 1 ATOM 1036 C C . ASN A 1 128 ? 12.741 -24.278 -25.741 1.00 96.33 128 A 1 ATOM 1037 O O . ASN A 1 128 ? 11.629 -23.988 -26.178 1.00 94.17 128 A 1 ATOM 1038 C CB . ASN A 1 128 ? 13.757 -24.157 -28.143 1.00 95.66 128 A 1 ATOM 1039 C CG . ASN A 1 128 ? 13.493 -22.755 -28.658 1.00 87.70 128 A 1 ATOM 1040 O OD1 . ASN A 1 128 ? 13.839 -21.755 -28.059 1.00 79.65 128 A 1 ATOM 1041 N ND2 . ASN A 1 128 ? 12.905 -22.649 -29.833 1.00 77.53 128 A 1 ATOM 1042 N N . LYS A 1 129 ? 12.918 -24.686 -24.491 1.00 96.18 129 A 1 ATOM 1043 C CA . LYS A 1 129 ? 11.868 -24.878 -23.471 1.00 96.10 129 A 1 ATOM 1044 C C . LYS A 1 129 ? 12.103 -24.013 -22.228 1.00 96.47 129 A 1 ATOM 1045 O O . LYS A 1 129 ? 11.649 -24.356 -21.138 1.00 95.08 129 A 1 ATOM 1046 C CB . LYS A 1 129 ? 11.767 -26.359 -23.096 1.00 94.74 129 A 1 ATOM 1047 C CG . LYS A 1 129 ? 11.231 -27.253 -24.219 1.00 92.30 129 A 1 ATOM 1048 C CD . LYS A 1 129 ? 11.278 -28.698 -23.717 1.00 87.85 129 A 1 ATOM 1049 C CE . LYS A 1 129 ? 11.009 -29.707 -24.825 1.00 82.26 129 A 1 ATOM 1050 N NZ . LYS A 1 129 ? 11.519 -31.042 -24.406 1.00 73.20 129 A 1 ATOM 1051 N N . LEU A 1 130 ? 12.838 -22.916 -22.363 1.00 95.92 130 A 1 ATOM 1052 C CA . LEU A 1 130 ? 13.044 -21.976 -21.268 1.00 95.69 130 A 1 ATOM 1053 C C . LEU A 1 130 ? 11.967 -20.893 -21.310 1.00 95.32 130 A 1 ATOM 1054 O O . LEU A 1 130 ? 11.801 -20.217 -22.325 1.00 93.61 130 A 1 ATOM 1055 C CB . LEU A 1 130 ? 14.457 -21.387 -21.342 1.00 94.72 130 A 1 ATOM 1056 C CG . LEU A 1 130 ? 14.844 -20.639 -20.048 1.00 93.46 130 A 1 ATOM 1057 C CD1 . LEU A 1 130 ? 15.218 -21.620 -18.937 1.00 90.67 130 A 1 ATOM 1058 C CD2 . LEU A 1 130 ? 16.043 -19.733 -20.299 1.00 91.00 130 A 1 ATOM 1059 N N . LYS A 1 131 ? 11.266 -20.700 -20.188 1.00 95.84 131 A 1 ATOM 1060 C CA . LYS A 1 131 ? 10.309 -19.611 -20.013 1.00 95.26 131 A 1 ATOM 1061 C C . LYS A 1 131 ? 10.447 -19.049 -18.607 1.00 95.73 131 A 1 ATOM 1062 O O . LYS A 1 131 ? 10.526 -19.819 -17.654 1.00 94.55 131 A 1 ATOM 1063 C CB . LYS A 1 131 ? 8.894 -20.131 -20.288 1.00 93.25 131 A 1 ATOM 1064 C CG . LYS A 1 131 ? 7.862 -19.002 -20.282 1.00 86.14 131 A 1 ATOM 1065 C CD . LYS A 1 131 ? 6.463 -19.569 -20.512 1.00 81.12 131 A 1 ATOM 1066 C CE . LYS A 1 131 ? 5.450 -18.432 -20.425 1.00 72.73 131 A 1 ATOM 1067 N NZ . LYS A 1 131 ? 4.064 -18.950 -20.499 1.00 63.92 131 A 1 ATOM 1068 N N . ASP A 1 132 ? 10.506 -17.729 -18.486 1.00 95.68 132 A 1 ATOM 1069 C CA . ASP A 1 132 ? 10.634 -17.034 -17.201 1.00 95.61 132 A 1 ATOM 1070 C C . ASP A 1 132 ? 11.836 -17.525 -16.349 1.00 95.82 132 A 1 ATOM 1071 O O . ASP A 1 132 ? 11.740 -17.650 -15.135 1.00 93.87 132 A 1 ATOM 1072 C CB . ASP A 1 132 ? 9.278 -17.049 -16.460 1.00 94.89 132 A 1 ATOM 1073 C CG . ASP A 1 132 ? 8.134 -16.487 -17.320 1.00 93.96 132 A 1 ATOM 1074 O OD1 . ASP A 1 132 ? 8.321 -15.394 -17.903 1.00 89.68 132 A 1 ATOM 1075 O OD2 . ASP A 1 132 ? 7.082 -17.157 -17.449 1.00 90.15 132 A 1 ATOM 1076 N N . ASN A 1 133 ? 12.963 -17.831 -17.000 1.00 95.41 133 A 1 ATOM 1077 C CA . ASN A 1 133 ? 14.154 -18.474 -16.410 1.00 95.13 133 A 1 ATOM 1078 C C . ASN A 1 133 ? 13.910 -19.862 -15.787 1.00 96.14 133 A 1 ATOM 1079 O O . ASN A 1 133 ? 14.703 -20.321 -14.967 1.00 94.06 133 A 1 ATOM 1080 C CB . ASN A 1 133 ? 14.891 -17.510 -15.461 1.00 92.71 133 A 1 ATOM 1081 C CG . ASN A 1 133 ? 15.713 -16.460 -16.183 1.00 87.63 133 A 1 ATOM 1082 O OD1 . ASN A 1 133 ? 16.161 -16.635 -17.305 1.00 78.57 133 A 1 ATOM 1083 N ND2 . ASN A 1 133 ? 15.985 -15.352 -15.523 1.00 77.22 133 A 1 ATOM 1084 N N . ILE A 1 134 ? 12.863 -20.558 -16.215 1.00 96.10 134 A 1 ATOM 1085 C CA . ILE A 1 134 ? 12.500 -21.890 -15.736 1.00 96.36 134 A 1 ATOM 1086 C C . ILE A 1 134 ? 12.435 -22.852 -16.917 1.00 96.67 134 A 1 ATOM 1087 O O . ILE A 1 134 ? 11.763 -22.594 -17.921 1.00 95.73 134 A 1 ATOM 1088 C CB . ILE A 1 134 ? 11.185 -21.828 -14.931 1.00 95.17 134 A 1 ATOM 1089 C CG1 . ILE A 1 134 ? 11.405 -20.948 -13.677 1.00 91.89 134 A 1 ATOM 1090 C CG2 . ILE A 1 134 ? 10.695 -23.233 -14.537 1.00 92.52 134 A 1 ATOM 1091 C CD1 . ILE A 1 134 ? 10.150 -20.724 -12.845 1.00 86.35 134 A 1 ATOM 1092 N N . TYR A 1 135 ? 13.118 -23.989 -16.793 1.00 96.95 135 A 1 ATOM 1093 C CA . TYR A 1 135 ? 13.018 -25.081 -17.752 1.00 96.90 135 A 1 ATOM 1094 C C . TYR A 1 135 ? 11.621 -25.709 -17.683 1.00 96.57 135 A 1 ATOM 1095 O O . TYR A 1 135 ? 11.205 -26.232 -16.653 1.00 95.61 135 A 1 ATOM 1096 C CB . TYR A 1 135 ? 14.130 -26.096 -17.491 1.00 96.53 135 A 1 ATOM 1097 C CG . TYR A 1 135 ? 14.062 -27.351 -18.340 1.00 96.75 135 A 1 ATOM 1098 C CD1 . TYR A 1 135 ? 14.215 -28.615 -17.737 1.00 94.53 135 A 1 ATOM 1099 C CD2 . TYR A 1 135 ? 13.858 -27.279 -19.732 1.00 94.77 135 A 1 ATOM 1100 C CE1 . TYR A 1 135 ? 14.177 -29.783 -18.510 1.00 94.51 135 A 1 ATOM 1101 C CE2 . TYR A 1 135 ? 13.809 -28.448 -20.509 1.00 94.24 135 A 1 ATOM 1102 C CZ . TYR A 1 135 ? 13.975 -29.701 -19.895 1.00 94.65 135 A 1 ATOM 1103 O OH . TYR A 1 135 ? 13.947 -30.842 -20.643 1.00 92.70 135 A 1 ATOM 1104 N N . GLN A 1 136 ? 10.896 -25.648 -18.791 1.00 95.69 136 A 1 ATOM 1105 C CA . GLN A 1 136 ? 9.554 -26.200 -18.925 1.00 94.36 136 A 1 ATOM 1106 C C . GLN A 1 136 ? 9.641 -27.693 -19.252 1.00 93.96 136 A 1 ATOM 1107 O O . GLN A 1 136 ? 9.446 -28.108 -20.397 1.00 91.56 136 A 1 ATOM 1108 C CB . GLN A 1 136 ? 8.760 -25.419 -19.982 1.00 92.43 136 A 1 ATOM 1109 C CG . GLN A 1 136 ? 8.677 -23.908 -19.707 1.00 87.76 136 A 1 ATOM 1110 C CD . GLN A 1 136 ? 7.966 -23.574 -18.395 1.00 85.33 136 A 1 ATOM 1111 O OE1 . GLN A 1 136 ? 6.824 -23.928 -18.177 1.00 76.27 136 A 1 ATOM 1112 N NE2 . GLN A 1 136 ? 8.623 -22.875 -17.502 1.00 74.87 136 A 1 ATOM 1113 N N . LYS A 1 137 ? 9.966 -28.499 -18.246 1.00 91.24 137 A 1 ATOM 1114 C CA . LYS A 1 137 ? 9.895 -29.953 -18.376 1.00 88.16 137 A 1 ATOM 1115 C C . LYS A 1 137 ? 8.422 -30.335 -18.508 1.00 84.67 137 A 1 ATOM 1116 O O . LYS A 1 137 ? 7.613 -30.005 -17.641 1.00 76.65 137 A 1 ATOM 1117 C CB . LYS A 1 137 ? 10.594 -30.626 -17.190 1.00 83.93 137 A 1 ATOM 1118 C CG . LYS A 1 137 ? 10.861 -32.123 -17.420 1.00 78.28 137 A 1 ATOM 1119 C CD . LYS A 1 137 ? 11.640 -32.697 -16.225 1.00 74.28 137 A 1 ATOM 1120 C CE . LYS A 1 137 ? 11.997 -34.174 -16.391 1.00 67.65 137 A 1 ATOM 1121 N NZ . LYS A 1 137 ? 12.733 -34.678 -15.202 1.00 60.58 137 A 1 ATOM 1122 N N . LEU A 1 138 ? 8.071 -30.988 -19.624 1.00 81.01 138 A 1 ATOM 1123 C CA . LEU A 1 138 ? 6.738 -31.557 -19.789 1.00 75.38 138 A 1 ATOM 1124 C C . LEU A 1 138 ? 6.593 -32.646 -18.732 1.00 72.81 138 A 1 ATOM 1125 O O . LEU A 1 138 ? 7.365 -33.604 -18.744 1.00 63.59 138 A 1 ATOM 1126 C CB . LEU A 1 138 ? 6.561 -32.119 -21.210 1.00 68.50 138 A 1 ATOM 1127 C CG . LEU A 1 138 ? 6.428 -31.038 -22.294 1.00 60.80 138 A 1 ATOM 1128 C CD1 . LEU A 1 138 ? 6.594 -31.661 -23.682 1.00 56.00 138 A 1 ATOM 1129 C CD2 . LEU A 1 138 ? 5.064 -30.342 -22.253 1.00 55.11 138 A 1 ATOM 1130 N N . GLN A 1 139 ? 5.618 -32.500 -17.831 1.00 69.59 139 A 1 ATOM 1131 C CA . GLN A 1 139 ? 5.128 -33.657 -17.101 1.00 64.37 139 A 1 ATOM 1132 C C . GLN A 1 139 ? 4.621 -34.625 -18.165 1.00 61.89 139 A 1 ATOM 1133 O O . GLN A 1 139 ? 3.712 -34.291 -18.930 1.00 54.64 139 A 1 ATOM 1134 C CB . GLN A 1 139 ? 4.030 -33.270 -16.103 1.00 57.51 139 A 1 ATOM 1135 C CG . GLN A 1 139 ? 4.628 -32.602 -14.855 1.00 51.89 139 A 1 ATOM 1136 C CD . GLN A 1 139 ? 3.592 -32.244 -13.800 1.00 47.74 139 A 1 ATOM 1137 O OE1 . GLN A 1 139 ? 2.421 -32.051 -14.068 1.00 44.38 139 A 1 ATOM 1138 N NE2 . GLN A 1 139 ? 4.007 -32.115 -12.560 1.00 42.58 139 A 1 ATOM 1139 N N . GLN A 1 140 ? 5.260 -35.791 -18.270 1.00 51.84 140 A 1 ATOM 1140 C CA . GLN A 1 140 ? 4.586 -36.900 -18.915 1.00 48.32 140 A 1 ATOM 1141 C C . GLN A 1 140 ? 3.337 -37.125 -18.069 1.00 46.20 140 A 1 ATOM 1142 O O . GLN A 1 140 ? 3.443 -37.531 -16.916 1.00 41.88 140 A 1 ATOM 1143 C CB . GLN A 1 140 ? 5.481 -38.144 -18.965 1.00 44.49 140 A 1 ATOM 1144 C CG . GLN A 1 140 ? 6.578 -38.022 -20.040 1.00 40.12 140 A 1 ATOM 1145 C CD . GLN A 1 140 ? 7.455 -39.279 -20.155 1.00 36.65 140 A 1 ATOM 1146 O OE1 . GLN A 1 140 ? 7.475 -40.150 -19.309 1.00 34.19 140 A 1 ATOM 1147 N NE2 . GLN A 1 140 ? 8.224 -39.407 -21.209 1.00 33.38 140 A 1 ATOM 1148 N N . MET A 1 141 ? 2.155 -36.805 -18.635 1.00 46.91 141 A 1 ATOM 1149 C CA . MET A 1 141 ? 0.920 -37.405 -18.158 1.00 43.45 141 A 1 ATOM 1150 C C . MET A 1 141 ? 1.102 -38.907 -18.384 1.00 41.47 141 A 1 ATOM 1151 O O . MET A 1 141 ? 0.934 -39.383 -19.503 1.00 38.89 141 A 1 ATOM 1152 C CB . MET A 1 141 ? -0.297 -36.887 -18.933 1.00 41.40 141 A 1 ATOM 1153 C CG . MET A 1 141 ? -0.589 -35.408 -18.702 1.00 38.93 141 A 1 ATOM 1154 S SD . MET A 1 141 ? -2.098 -34.851 -19.570 1.00 37.23 141 A 1 ATOM 1155 C CE . MET A 1 141 ? -1.795 -33.062 -19.618 1.00 33.97 141 A 1 ATOM 1156 N N . GLN A 1 142 ? 1.598 -39.590 -17.354 1.00 33.15 142 A 1 ATOM 1157 C CA . GLN A 1 142 ? 1.440 -41.033 -17.255 1.00 31.50 142 A 1 ATOM 1158 C C . GLN A 1 142 ? -0.008 -41.334 -16.844 1.00 28.71 142 A 1 ATOM 1159 O O . GLN A 1 142 ? -0.573 -40.559 -16.042 1.00 25.89 142 A 1 ATOM 1160 C CB . GLN A 1 142 ? 2.444 -41.645 -16.273 1.00 29.97 142 A 1 ATOM 1161 C CG . GLN A 1 142 ? 3.863 -41.675 -16.866 1.00 28.87 142 A 1 ATOM 1162 C CD . GLN A 1 142 ? 4.848 -42.493 -16.018 1.00 26.85 142 A 1 ATOM 1163 O OE1 . GLN A 1 142 ? 4.580 -42.943 -14.911 1.00 25.35 142 A 1 ATOM 1164 N NE2 . GLN A 1 142 ? 6.031 -42.741 -16.512 1.00 26.03 142 A 1 ATOM 1165 O OXT . GLN A 1 142 ? -0.513 -42.355 -17.348 1.00 25.60 142 A 1 ATOM 1166 N N . ASP B 2 1 ? -19.917 -32.377 6.306 1.00 53.54 1 B 1 ATOM 1167 C CA . ASP B 2 1 ? -20.363 -33.393 5.324 1.00 58.00 1 B 1 ATOM 1168 C C . ASP B 2 1 ? -20.933 -32.807 4.037 1.00 60.34 1 B 1 ATOM 1169 O O . ASP B 2 1 ? -20.546 -33.272 2.973 1.00 57.31 1 B 1 ATOM 1170 C CB . ASP B 2 1 ? -21.272 -34.421 5.991 1.00 54.47 1 B 1 ATOM 1171 C CG . ASP B 2 1 ? -20.464 -35.160 7.057 1.00 50.11 1 B 1 ATOM 1172 O OD1 . ASP B 2 1 ? -19.218 -35.093 6.936 1.00 47.06 1 B 1 ATOM 1173 O OD2 . ASP B 2 1 ? -21.068 -35.651 8.023 1.00 45.11 1 B 1 ATOM 1174 N N . ASP B 2 2 ? -21.691 -31.710 4.076 1.00 65.20 2 B 1 ATOM 1175 C CA . ASP B 2 2 ? -22.282 -31.055 2.883 1.00 68.18 2 B 1 ATOM 1176 C C . ASP B 2 2 ? -21.315 -30.750 1.720 1.00 69.54 2 B 1 ATOM 1177 O O . ASP B 2 2 ? -21.733 -30.598 0.566 1.00 65.50 2 B 1 ATOM 1178 C CB . ASP B 2 2 ? -22.906 -29.717 3.308 1.00 62.98 2 B 1 ATOM 1179 C CG . ASP B 2 2 ? -24.260 -29.836 3.998 1.00 57.19 2 B 1 ATOM 1180 O OD1 . ASP B 2 2 ? -24.832 -30.942 3.983 1.00 53.35 2 B 1 ATOM 1181 O OD2 . ASP B 2 2 ? -24.707 -28.792 4.522 1.00 52.18 2 B 1 ATOM 1182 N N . TYR B 2 3 ? -20.013 -30.644 1.977 1.00 77.74 3 B 1 ATOM 1183 C CA . TYR B 2 3 ? -19.036 -30.411 0.906 1.00 77.80 3 B 1 ATOM 1184 C C . TYR B 2 3 ? -18.880 -31.627 -0.017 1.00 78.88 3 B 1 ATOM 1185 O O . TYR B 2 3 ? -18.639 -31.455 -1.214 1.00 76.10 3 B 1 ATOM 1186 C CB . TYR B 2 3 ? -17.687 -30.002 1.514 1.00 73.27 3 B 1 ATOM 1187 C CG . TYR B 2 3 ? -17.200 -28.669 0.996 1.00 66.18 3 B 1 ATOM 1188 C CD1 . TYR B 2 3 ? -16.438 -28.594 -0.188 1.00 61.10 3 B 1 ATOM 1189 C CD2 . TYR B 2 3 ? -17.525 -27.486 1.690 1.00 59.75 3 B 1 ATOM 1190 C CE1 . TYR B 2 3 ? -15.996 -27.349 -0.669 1.00 54.63 3 B 1 ATOM 1191 C CE2 . TYR B 2 3 ? -17.088 -26.238 1.217 1.00 54.86 3 B 1 ATOM 1192 C CZ . TYR B 2 3 ? -16.318 -26.171 0.037 1.00 52.84 3 B 1 ATOM 1193 O OH . TYR B 2 3 ? -15.882 -24.954 -0.423 1.00 50.41 3 B 1 ATOM 1194 N N . LEU B 2 4 ? -19.034 -32.846 0.522 1.00 81.38 4 B 1 ATOM 1195 C CA . LEU B 2 4 ? -18.955 -34.096 -0.243 1.00 81.89 4 B 1 ATOM 1196 C C . LEU B 2 4 ? -20.158 -34.268 -1.174 1.00 82.25 4 B 1 ATOM 1197 O O . LEU B 2 4 ? -19.997 -34.749 -2.293 1.00 78.47 4 B 1 ATOM 1198 C CB . LEU B 2 4 ? -18.839 -35.288 0.726 1.00 79.43 4 B 1 ATOM 1199 C CG . LEU B 2 4 ? -17.460 -35.411 1.398 1.00 73.93 4 B 1 ATOM 1200 C CD1 . LEU B 2 4 ? -17.543 -36.393 2.569 1.00 69.77 4 B 1 ATOM 1201 C CD2 . LEU B 2 4 ? -16.405 -35.936 0.422 1.00 69.87 4 B 1 ATOM 1202 N N . ASP B 2 5 ? -21.344 -33.809 -0.766 1.00 80.21 5 B 1 ATOM 1203 C CA . ASP B 2 5 ? -22.555 -33.912 -1.594 1.00 80.23 5 B 1 ATOM 1204 C C . ASP B 2 5 ? -22.527 -33.025 -2.846 1.00 80.63 5 B 1 ATOM 1205 O O . ASP B 2 5 ? -23.260 -33.276 -3.812 1.00 77.50 5 B 1 ATOM 1206 C CB . ASP B 2 5 ? -23.802 -33.615 -0.750 1.00 77.08 5 B 1 ATOM 1207 C CG . ASP B 2 5 ? -24.473 -34.885 -0.228 1.00 70.23 5 B 1 ATOM 1208 O OD1 . ASP B 2 5 ? -24.448 -35.915 -0.959 1.00 64.84 5 B 1 ATOM 1209 O OD2 . ASP B 2 5 ? -25.073 -34.800 0.858 1.00 63.18 5 B 1 ATOM 1210 N N . ARG B 2 6 ? -21.656 -32.019 -2.876 1.00 82.13 6 B 1 ATOM 1211 C CA . ARG B 2 6 ? -21.430 -31.174 -4.062 1.00 81.72 6 B 1 ATOM 1212 C C . ARG B 2 6 ? -20.416 -31.766 -5.041 1.00 83.32 6 B 1 ATOM 1213 O O . ARG B 2 6 ? -20.251 -31.222 -6.135 1.00 80.35 6 B 1 ATOM 1214 C CB . ARG B 2 6 ? -21.014 -29.761 -3.638 1.00 77.88 6 B 1 ATOM 1215 C CG . ARG B 2 6 ? -22.134 -29.048 -2.877 1.00 71.01 6 B 1 ATOM 1216 C CD . ARG B 2 6 ? -21.709 -27.613 -2.576 1.00 66.74 6 B 1 ATOM 1217 N NE . ARG B 2 6 ? -22.709 -26.925 -1.754 1.00 60.30 6 B 1 ATOM 1218 C CZ . ARG B 2 6 ? -22.728 -25.638 -1.448 1.00 54.26 6 B 1 ATOM 1219 N NH1 . ARG B 2 6 ? -21.819 -24.817 -1.896 1.00 50.33 6 B 1 ATOM 1220 N NH2 . ARG B 2 6 ? -23.663 -25.166 -0.676 1.00 47.88 6 B 1 ATOM 1221 N N . LEU B 2 7 ? -19.716 -32.831 -4.669 1.00 86.54 7 B 1 ATOM 1222 C CA . LEU B 2 7 ? -18.781 -33.487 -5.572 1.00 86.60 7 B 1 ATOM 1223 C C . LEU B 2 7 ? -19.552 -34.295 -6.625 1.00 87.02 7 B 1 ATOM 1224 O O . LEU B 2 7 ? -20.572 -34.916 -6.317 1.00 85.03 7 B 1 ATOM 1225 C CB . LEU B 2 7 ? -17.790 -34.364 -4.794 1.00 84.46 7 B 1 ATOM 1226 C CG . LEU B 2 7 ? -16.787 -33.568 -3.937 1.00 79.61 7 B 1 ATOM 1227 C CD1 . LEU B 2 7 ? -15.985 -34.533 -3.064 1.00 75.52 7 B 1 ATOM 1228 C CD2 . LEU B 2 7 ? -15.789 -32.781 -4.799 1.00 75.25 7 B 1 ATOM 1229 N N . PRO B 2 8 ? -19.043 -34.334 -7.865 1.00 84.28 8 B 1 ATOM 1230 C CA . PRO B 2 8 ? -19.618 -35.204 -8.884 1.00 83.86 8 B 1 ATOM 1231 C C . PRO B 2 8 ? -19.650 -36.655 -8.383 1.00 85.51 8 B 1 ATOM 1232 O O . PRO B 2 8 ? -18.619 -37.221 -8.019 1.00 83.41 8 B 1 ATOM 1233 C CB . PRO B 2 8 ? -18.722 -35.044 -10.118 1.00 79.55 8 B 1 ATOM 1234 C CG . PRO B 2 8 ? -18.026 -33.701 -9.907 1.00 78.97 8 B 1 ATOM 1235 C CD . PRO B 2 8 ? -17.909 -33.597 -8.389 1.00 81.79 8 B 1 ATOM 1236 N N . LYS B 2 9 ? -20.829 -37.288 -8.414 1.00 83.73 9 B 1 ATOM 1237 C CA . LYS B 2 9 ? -20.993 -38.682 -7.947 1.00 83.16 9 B 1 ATOM 1238 C C . LYS B 2 9 ? -20.538 -39.720 -8.983 1.00 84.78 9 B 1 ATOM 1239 O O . LYS B 2 9 ? -20.407 -40.897 -8.676 1.00 80.62 9 B 1 ATOM 1240 C CB . LYS B 2 9 ? -22.441 -38.918 -7.456 1.00 78.63 9 B 1 ATOM 1241 C CG . LYS B 2 9 ? -22.785 -38.043 -6.232 1.00 74.10 9 B 1 ATOM 1242 C CD . LYS B 2 9 ? -24.113 -38.400 -5.532 1.00 66.98 9 B 1 ATOM 1243 C CE . LYS B 2 9 ? -24.259 -37.462 -4.310 1.00 63.06 9 B 1 ATOM 1244 N NZ . LYS B 2 9 ? -25.395 -37.747 -3.393 1.00 55.24 9 B 1 ATOM 1245 N N . SER B 2 10 ? -20.283 -39.285 -10.220 1.00 86.29 10 B 1 ATOM 1246 C CA . SER B 2 10 ? -19.800 -40.168 -11.286 1.00 86.80 10 B 1 ATOM 1247 C C . SER B 2 10 ? -18.274 -40.105 -11.418 1.00 88.22 10 B 1 ATOM 1248 O O . SER B 2 10 ? -17.674 -39.036 -11.301 1.00 86.67 10 B 1 ATOM 1249 C CB . SER B 2 10 ? -20.498 -39.868 -12.616 1.00 83.66 10 B 1 ATOM 1250 O OG . SER B 2 10 ? -20.006 -38.686 -13.220 1.00 77.17 10 B 1 ATOM 1251 N N . LYS B 2 11 ? -17.645 -41.251 -11.759 1.00 88.54 11 B 1 ATOM 1252 C CA . LYS B 2 11 ? -16.196 -41.330 -12.024 1.00 88.86 11 B 1 ATOM 1253 C C . LYS B 2 11 ? -15.760 -40.329 -13.101 1.00 89.71 11 B 1 ATOM 1254 O O . LYS B 2 11 ? -14.745 -39.655 -12.938 1.00 89.21 11 B 1 ATOM 1255 C CB . LYS B 2 11 ? -15.827 -42.779 -12.400 1.00 87.57 11 B 1 ATOM 1256 C CG . LYS B 2 11 ? -14.309 -42.990 -12.520 1.00 81.06 11 B 1 ATOM 1257 C CD . LYS B 2 11 ? -13.969 -44.461 -12.824 1.00 76.36 11 B 1 ATOM 1258 C CE . LYS B 2 11 ? -12.449 -44.641 -12.923 1.00 68.37 11 B 1 ATOM 1259 N NZ . LYS B 2 11 ? -12.055 -46.051 -13.195 1.00 60.53 11 B 1 ATOM 1260 N N . LYS B 2 12 ? -16.560 -40.193 -14.167 1.00 89.42 12 B 1 ATOM 1261 C CA . LYS B 2 12 ? -16.301 -39.240 -15.259 1.00 89.69 12 B 1 ATOM 1262 C C . LYS B 2 12 ? -16.391 -37.780 -14.787 1.00 90.76 12 B 1 ATOM 1263 O O . LYS B 2 12 ? -15.562 -36.963 -15.176 1.00 88.49 12 B 1 ATOM 1264 C CB . LYS B 2 12 ? -17.273 -39.530 -16.418 1.00 88.26 12 B 1 ATOM 1265 C CG . LYS B 2 12 ? -16.897 -38.760 -17.692 1.00 78.80 12 B 1 ATOM 1266 C CD . LYS B 2 12 ? -17.838 -39.119 -18.857 1.00 73.52 12 B 1 ATOM 1267 C CE . LYS B 2 12 ? -17.403 -38.383 -20.127 1.00 64.57 12 B 1 ATOM 1268 N NZ . LYS B 2 12 ? -18.273 -38.699 -21.294 1.00 56.42 12 B 1 ATOM 1269 N N . GLY B 2 13 ? -17.360 -37.472 -13.937 1.00 91.32 13 B 1 ATOM 1270 C CA . GLY B 2 13 ? -17.500 -36.137 -13.352 1.00 90.92 13 B 1 ATOM 1271 C C . GLY B 2 13 ? -16.344 -35.783 -12.411 1.00 92.29 13 B 1 ATOM 1272 O O . GLY B 2 13 ? -15.814 -34.676 -12.486 1.00 91.28 13 B 1 ATOM 1273 N N . LEU B 2 14 ? -15.900 -36.743 -11.594 1.00 92.77 14 B 1 ATOM 1274 C CA . LEU B 2 14 ? -14.714 -36.585 -10.742 1.00 92.71 14 B 1 ATOM 1275 C C . LEU B 2 14 ? -13.438 -36.373 -11.566 1.00 93.25 14 B 1 ATOM 1276 O O . LEU B 2 14 ? -12.658 -35.479 -11.252 1.00 93.42 14 B 1 ATOM 1277 C CB . LEU B 2 14 ? -14.571 -37.814 -9.825 1.00 91.69 14 B 1 ATOM 1278 C CG . LEU B 2 14 ? -15.510 -37.781 -8.607 1.00 84.52 14 B 1 ATOM 1279 C CD1 . LEU B 2 14 ? -15.636 -39.174 -7.995 1.00 79.22 14 B 1 ATOM 1280 C CD2 . LEU B 2 14 ? -14.983 -36.833 -7.527 1.00 80.66 14 B 1 ATOM 1281 N N . GLN B 2 15 ? -13.245 -37.138 -12.644 1.00 92.36 15 B 1 ATOM 1282 C CA . GLN B 2 15 ? -12.112 -36.955 -13.559 1.00 91.42 15 B 1 ATOM 1283 C C . GLN B 2 15 ? -12.133 -35.574 -14.230 1.00 91.84 15 B 1 ATOM 1284 O O . GLN B 2 15 ? -11.092 -34.924 -14.303 1.00 91.29 15 B 1 ATOM 1285 C CB . GLN B 2 15 ? -12.120 -38.060 -14.621 1.00 90.25 15 B 1 ATOM 1286 C CG . GLN B 2 15 ? -11.588 -39.390 -14.063 1.00 82.95 15 B 1 ATOM 1287 C CD . GLN B 2 15 ? -11.665 -40.527 -15.092 1.00 77.97 15 B 1 ATOM 1288 O OE1 . GLN B 2 15 ? -12.530 -40.596 -15.951 1.00 72.88 15 B 1 ATOM 1289 N NE2 . GLN B 2 15 ? -10.761 -41.478 -15.026 1.00 68.54 15 B 1 ATOM 1290 N N . GLY B 2 16 ? -13.301 -35.116 -14.667 1.00 91.44 16 B 1 ATOM 1291 C CA . GLY B 2 16 ? -13.448 -33.771 -15.236 1.00 90.87 16 B 1 ATOM 1292 C C . GLY B 2 16 ? -13.102 -32.671 -14.229 1.00 92.04 16 B 1 ATOM 1293 O O . GLY B 2 16 ? -12.336 -31.760 -14.548 1.00 90.66 16 B 1 ATOM 1294 N N . LEU B 2 17 ? -13.590 -32.805 -12.993 1.00 94.28 17 B 1 ATOM 1295 C CA . LEU B 2 17 ? -13.265 -31.867 -11.918 1.00 93.83 17 B 1 ATOM 1296 C C . LEU B 2 17 ? -11.759 -31.857 -11.608 1.00 94.28 17 B 1 ATOM 1297 O O . LEU B 2 17 ? -11.181 -30.782 -11.451 1.00 93.99 17 B 1 ATOM 1298 C CB . LEU B 2 17 ? -14.095 -32.223 -10.674 1.00 93.13 17 B 1 ATOM 1299 C CG . LEU B 2 17 ? -13.866 -31.269 -9.480 1.00 87.70 17 B 1 ATOM 1300 C CD1 . LEU B 2 17 ? -14.350 -29.847 -9.783 1.00 80.95 17 B 1 ATOM 1301 C CD2 . LEU B 2 17 ? -14.620 -31.779 -8.253 1.00 82.70 17 B 1 ATOM 1302 N N . LEU B 2 18 ? -11.117 -33.033 -11.542 1.00 93.00 18 B 1 ATOM 1303 C CA . LEU B 2 18 ? -9.671 -33.150 -11.335 1.00 92.06 18 B 1 ATOM 1304 C C . LEU B 2 18 ? -8.890 -32.449 -12.449 1.00 92.02 18 B 1 ATOM 1305 O O . LEU B 2 18 ? -8.031 -31.621 -12.148 1.00 92.63 18 B 1 ATOM 1306 C CB . LEU B 2 18 ? -9.273 -34.631 -11.225 1.00 91.61 18 B 1 ATOM 1307 C CG . LEU B 2 18 ? -9.576 -35.253 -9.848 1.00 80.46 18 B 1 ATOM 1308 C CD1 . LEU B 2 18 ? -9.473 -36.779 -9.934 1.00 75.38 18 B 1 ATOM 1309 C CD2 . LEU B 2 18 ? -8.601 -34.767 -8.777 1.00 78.09 18 B 1 ATOM 1310 N N . GLN B 2 19 ? -9.246 -32.683 -13.713 1.00 93.33 19 B 1 ATOM 1311 C CA . GLN B 2 19 ? -8.606 -32.014 -14.851 1.00 92.10 19 B 1 ATOM 1312 C C . GLN B 2 19 ? -8.764 -30.488 -14.805 1.00 92.01 19 B 1 ATOM 1313 O O . GLN B 2 19 ? -7.827 -29.752 -15.124 1.00 91.14 19 B 1 ATOM 1314 C CB . GLN B 2 19 ? -9.203 -32.537 -16.161 1.00 91.02 19 B 1 ATOM 1315 C CG . GLN B 2 19 ? -8.698 -33.947 -16.503 1.00 83.58 19 B 1 ATOM 1316 C CD . GLN B 2 19 ? -9.298 -34.478 -17.809 1.00 79.81 19 B 1 ATOM 1317 O OE1 . GLN B 2 19 ? -10.175 -33.897 -18.437 1.00 74.37 19 B 1 ATOM 1318 N NE2 . GLN B 2 19 ? -8.830 -35.613 -18.276 1.00 71.17 19 B 1 ATOM 1319 N N . ASP B 2 20 ? -9.929 -29.994 -14.394 1.00 93.66 20 B 1 ATOM 1320 C CA . ASP B 2 20 ? -10.150 -28.552 -14.254 1.00 92.49 20 B 1 ATOM 1321 C C . ASP B 2 20 ? -9.325 -27.949 -13.105 1.00 92.13 20 B 1 ATOM 1322 O O . ASP B 2 20 ? -8.795 -26.839 -13.232 1.00 91.58 20 B 1 ATOM 1323 C CB . ASP B 2 20 ? -11.642 -28.264 -14.041 1.00 92.09 20 B 1 ATOM 1324 C CG . ASP B 2 20 ? -12.473 -28.266 -15.330 1.00 82.21 20 B 1 ATOM 1325 O OD1 . ASP B 2 20 ? -11.880 -28.228 -16.438 1.00 76.77 20 B 1 ATOM 1326 O OD2 . ASP B 2 20 ? -13.715 -28.195 -15.191 1.00 76.39 20 B 1 ATOM 1327 N N . ILE B 2 21 ? -9.191 -28.682 -11.998 1.00 93.59 21 B 1 ATOM 1328 C CA . ILE B 2 21 ? -8.336 -28.286 -10.875 1.00 92.36 21 B 1 ATOM 1329 C C . ILE B 2 21 ? -6.868 -28.266 -11.317 1.00 91.60 21 B 1 ATOM 1330 O O . ILE B 2 21 ? -6.194 -27.258 -11.105 1.00 91.43 21 B 1 ATOM 1331 C CB . ILE B 2 21 ? -8.577 -29.191 -9.649 1.00 92.10 21 B 1 ATOM 1332 C CG1 . ILE B 2 21 ? -9.978 -28.909 -9.054 1.00 87.74 21 B 1 ATOM 1333 C CG2 . ILE B 2 21 ? -7.492 -28.977 -8.576 1.00 86.25 21 B 1 ATOM 1334 C CD1 . ILE B 2 21 ? -10.437 -29.958 -8.030 1.00 79.20 21 B 1 ATOM 1335 N N . GLU B 2 22 ? -6.384 -29.314 -11.982 1.00 92.22 22 B 1 ATOM 1336 C CA . GLU B 2 22 ? -5.011 -29.395 -12.498 1.00 90.49 22 B 1 ATOM 1337 C C . GLU B 2 22 ? -4.697 -28.254 -13.470 1.00 90.50 22 B 1 ATOM 1338 O O . GLU B 2 22 ? -3.670 -27.585 -13.335 1.00 89.58 22 B 1 ATOM 1339 C CB . GLU B 2 22 ? -4.805 -30.733 -13.210 1.00 89.40 22 B 1 ATOM 1340 C CG . GLU B 2 22 ? -4.661 -31.902 -12.229 1.00 83.52 22 B 1 ATOM 1341 C CD . GLU B 2 22 ? -4.659 -33.267 -12.933 1.00 78.17 22 B 1 ATOM 1342 O OE1 . GLU B 2 22 ? -4.532 -34.275 -12.205 1.00 72.82 22 B 1 ATOM 1343 O OE2 . GLU B 2 22 ? -4.826 -33.304 -14.175 1.00 76.04 22 B 1 ATOM 1344 N N . LYS B 2 23 ? -5.618 -27.957 -14.408 1.00 92.50 23 B 1 ATOM 1345 C CA . LYS B 2 23 ? -5.474 -26.815 -15.320 1.00 91.54 23 B 1 ATOM 1346 C C . LYS B 2 23 ? -5.376 -25.487 -14.572 1.00 91.01 23 B 1 ATOM 1347 O O . LYS B 2 23 ? -4.546 -24.647 -14.927 1.00 89.91 23 B 1 ATOM 1348 C CB . LYS B 2 23 ? -6.653 -26.761 -16.296 1.00 90.97 23 B 1 ATOM 1349 C CG . LYS B 2 23 ? -6.505 -27.777 -17.434 1.00 81.97 23 B 1 ATOM 1350 C CD . LYS B 2 23 ? -7.767 -27.736 -18.297 1.00 79.87 23 B 1 ATOM 1351 C CE . LYS B 2 23 ? -7.683 -28.782 -19.405 1.00 70.53 23 B 1 ATOM 1352 N NZ . LYS B 2 23 ? -8.966 -28.865 -20.150 1.00 63.49 23 B 1 ATOM 1353 N N . ARG B 2 24 ? -6.202 -25.290 -13.537 1.00 92.50 24 B 1 ATOM 1354 C CA . ARG B 2 24 ? -6.140 -24.082 -12.704 1.00 91.25 24 B 1 ATOM 1355 C C . ARG B 2 24 ? -4.821 -23.998 -11.943 1.00 90.96 24 B 1 ATOM 1356 O O . ARG B 2 24 ? -4.200 -22.938 -11.965 1.00 90.15 24 B 1 ATOM 1357 C CB . ARG B 2 24 ? -7.323 -24.023 -11.731 1.00 91.28 24 B 1 ATOM 1358 C CG . ARG B 2 24 ? -8.617 -23.608 -12.441 1.00 81.05 24 B 1 ATOM 1359 C CD . ARG B 2 24 ? -9.757 -23.603 -11.426 1.00 77.83 24 B 1 ATOM 1360 N NE . ARG B 2 24 ? -11.035 -23.242 -12.063 1.00 69.84 24 B 1 ATOM 1361 C CZ . ARG B 2 24 ? -12.168 -22.974 -11.431 1.00 62.69 24 B 1 ATOM 1362 N NH1 . ARG B 2 24 ? -12.244 -22.968 -10.125 1.00 56.18 24 B 1 ATOM 1363 N NH2 . ARG B 2 24 ? -13.248 -22.714 -12.110 1.00 54.24 24 B 1 ATOM 1364 N N . ILE B 2 25 ? -4.371 -25.093 -11.331 1.00 91.09 25 B 1 ATOM 1365 C CA . ILE B 2 25 ? -3.086 -25.155 -10.622 1.00 89.07 25 B 1 ATOM 1366 C C . ILE B 2 25 ? -1.944 -24.804 -11.579 1.00 89.76 25 B 1 ATOM 1367 O O . ILE B 2 25 ? -1.138 -23.927 -11.266 1.00 89.37 25 B 1 ATOM 1368 C CB . ILE B 2 25 ? -2.886 -26.536 -9.962 1.00 87.55 25 B 1 ATOM 1369 C CG1 . ILE B 2 25 ? -3.875 -26.707 -8.785 1.00 83.44 25 B 1 ATOM 1370 C CG2 . ILE B 2 25 ? -1.437 -26.705 -9.468 1.00 82.73 25 B 1 ATOM 1371 C CD1 . ILE B 2 25 ? -3.948 -28.139 -8.245 1.00 76.59 25 B 1 ATOM 1372 N N . LEU B 2 26 ? -1.911 -25.413 -12.769 1.00 89.71 26 B 1 ATOM 1373 C CA . LEU B 2 26 ? -0.892 -25.128 -13.780 1.00 89.51 26 B 1 ATOM 1374 C C . LEU B 2 26 ? -0.915 -23.657 -14.208 1.00 91.51 26 B 1 ATOM 1375 O O . LEU B 2 26 ? 0.140 -23.029 -14.321 1.00 91.40 26 B 1 ATOM 1376 C CB . LEU B 2 26 ? -1.103 -26.068 -14.978 1.00 87.11 26 B 1 ATOM 1377 C CG . LEU B 2 26 ? -0.011 -25.935 -16.060 1.00 77.17 26 B 1 ATOM 1378 C CD1 . LEU B 2 26 ? 1.363 -26.371 -15.543 1.00 72.31 26 B 1 ATOM 1379 C CD2 . LEU B 2 26 ? -0.376 -26.799 -17.267 1.00 73.56 26 B 1 ATOM 1380 N N . HIS B 2 27 ? -2.110 -23.084 -14.407 1.00 92.07 27 B 1 ATOM 1381 C CA . HIS B 2 27 ? -2.260 -21.671 -14.748 1.00 92.63 27 B 1 ATOM 1382 C C . HIS B 2 27 ? -1.725 -20.756 -13.639 1.00 92.87 27 B 1 ATOM 1383 O O . HIS B 2 27 ? -0.927 -19.861 -13.922 1.00 92.82 27 B 1 ATOM 1384 C CB . HIS B 2 27 ? -3.729 -21.375 -15.058 1.00 92.52 27 B 1 ATOM 1385 C CG . HIS B 2 27 ? -3.949 -19.942 -15.462 1.00 88.77 27 B 1 ATOM 1386 N ND1 . HIS B 2 27 ? -3.455 -19.341 -16.601 1.00 76.00 27 B 1 ATOM 1387 C CD2 . HIS B 2 27 ? -4.647 -18.980 -14.775 1.00 77.98 27 B 1 ATOM 1388 C CE1 . HIS B 2 27 ? -3.851 -18.062 -16.601 1.00 76.97 27 B 1 ATOM 1389 N NE2 . HIS B 2 27 ? -4.580 -17.808 -15.511 1.00 77.69 27 B 1 ATOM 1390 N N . TYR B 2 28 ? -2.089 -21.014 -12.382 1.00 93.16 28 B 1 ATOM 1391 C CA . TYR B 2 28 ? -1.574 -20.243 -11.248 1.00 92.82 28 B 1 ATOM 1392 C C . TYR B 2 28 ? -0.058 -20.385 -11.092 1.00 93.80 28 B 1 ATOM 1393 O O . TYR B 2 28 ? 0.621 -19.387 -10.844 1.00 93.59 28 B 1 ATOM 1394 C CB . TYR B 2 28 ? -2.279 -20.663 -9.954 1.00 91.45 28 B 1 ATOM 1395 C CG . TYR B 2 28 ? -3.687 -20.123 -9.808 1.00 82.22 28 B 1 ATOM 1396 C CD1 . TYR B 2 28 ? -3.914 -18.732 -9.790 1.00 75.72 28 B 1 ATOM 1397 C CD2 . TYR B 2 28 ? -4.781 -21.002 -9.667 1.00 74.03 28 B 1 ATOM 1398 C CE1 . TYR B 2 28 ? -5.215 -18.226 -9.650 1.00 68.63 28 B 1 ATOM 1399 C CE2 . TYR B 2 28 ? -6.087 -20.502 -9.528 1.00 67.64 28 B 1 ATOM 1400 C CZ . TYR B 2 28 ? -6.301 -19.112 -9.524 1.00 66.66 28 B 1 ATOM 1401 O OH . TYR B 2 28 ? -7.573 -18.619 -9.392 1.00 61.04 28 B 1 ATOM 1402 N N . LYS B 2 29 ? 0.492 -21.581 -11.301 1.00 93.01 29 B 1 ATOM 1403 C CA . LYS B 2 29 ? 1.935 -21.843 -11.283 1.00 93.36 29 B 1 ATOM 1404 C C . LYS B 2 29 ? 2.660 -21.009 -12.343 1.00 94.47 29 B 1 ATOM 1405 O O . LYS B 2 29 ? 3.657 -20.351 -12.042 1.00 94.53 29 B 1 ATOM 1406 C CB . LYS B 2 29 ? 2.153 -23.360 -11.452 1.00 91.68 29 B 1 ATOM 1407 C CG . LYS B 2 29 ? 3.606 -23.802 -11.234 1.00 86.34 29 B 1 ATOM 1408 C CD . LYS B 2 29 ? 3.716 -25.342 -11.214 1.00 86.33 29 B 1 ATOM 1409 C CE . LYS B 2 29 ? 5.120 -25.787 -10.795 1.00 80.07 29 B 1 ATOM 1410 N NZ . LYS B 2 29 ? 5.249 -27.254 -10.556 1.00 75.64 29 B 1 ATOM 1411 N N . GLN B 2 30 ? 2.130 -20.971 -13.573 1.00 93.83 30 B 1 ATOM 1412 C CA . GLN B 2 30 ? 2.693 -20.159 -14.656 1.00 93.95 30 B 1 ATOM 1413 C C . GLN B 2 30 ? 2.610 -18.654 -14.365 1.00 94.95 30 B 1 ATOM 1414 O O . GLN B 2 30 ? 3.584 -17.940 -14.602 1.00 94.46 30 B 1 ATOM 1415 C CB . GLN B 2 30 ? 1.961 -20.465 -15.967 1.00 92.65 30 B 1 ATOM 1416 C CG . GLN B 2 30 ? 2.347 -21.837 -16.534 1.00 84.08 30 B 1 ATOM 1417 C CD . GLN B 2 30 ? 1.545 -22.191 -17.791 1.00 76.45 30 B 1 ATOM 1418 O OE1 . GLN B 2 30 ? 0.700 -21.452 -18.275 1.00 70.16 30 B 1 ATOM 1419 N NE2 . GLN B 2 30 ? 1.801 -23.338 -18.376 1.00 65.36 30 B 1 ATOM 1420 N N . LEU B 2 31 ? 1.483 -18.179 -13.840 1.00 94.61 31 B 1 ATOM 1421 C CA . LEU B 2 31 ? 1.332 -16.780 -13.436 1.00 94.61 31 B 1 ATOM 1422 C C . LEU B 2 31 ? 2.323 -16.407 -12.336 1.00 95.25 31 B 1 ATOM 1423 O O . LEU B 2 31 ? 2.969 -15.369 -12.441 1.00 95.00 31 B 1 ATOM 1424 C CB . LEU B 2 31 ? -0.101 -16.512 -12.954 1.00 93.75 31 B 1 ATOM 1425 C CG . LEU B 2 31 ? -1.166 -16.434 -14.061 1.00 84.97 31 B 1 ATOM 1426 C CD1 . LEU B 2 31 ? -2.529 -16.214 -13.395 1.00 81.77 31 B 1 ATOM 1427 C CD2 . LEU B 2 31 ? -0.922 -15.281 -15.036 1.00 82.98 31 B 1 ATOM 1428 N N . PHE B 2 32 ? 2.490 -17.275 -11.339 1.00 94.72 32 B 1 ATOM 1429 C CA . PHE B 2 32 ? 3.449 -17.069 -10.260 1.00 95.05 32 B 1 ATOM 1430 C C . PHE B 2 32 ? 4.878 -16.944 -10.801 1.00 95.52 32 B 1 ATOM 1431 O O . PHE B 2 32 ? 5.562 -15.972 -10.500 1.00 95.60 32 B 1 ATOM 1432 C CB . PHE B 2 32 ? 3.323 -18.214 -9.254 1.00 94.73 32 B 1 ATOM 1433 C CG . PHE B 2 32 ? 4.300 -18.098 -8.102 1.00 94.72 32 B 1 ATOM 1434 C CD1 . PHE B 2 32 ? 5.558 -18.722 -8.168 1.00 93.13 32 B 1 ATOM 1435 C CD2 . PHE B 2 32 ? 3.953 -17.347 -6.965 1.00 93.19 32 B 1 ATOM 1436 C CE1 . PHE B 2 32 ? 6.461 -18.599 -7.100 1.00 92.70 32 B 1 ATOM 1437 C CE2 . PHE B 2 32 ? 4.854 -17.226 -5.896 1.00 92.31 32 B 1 ATOM 1438 C CZ . PHE B 2 32 ? 6.106 -17.852 -5.964 1.00 92.55 32 B 1 ATOM 1439 N N . PHE B 2 33 ? 5.319 -17.870 -11.655 1.00 96.03 33 B 1 ATOM 1440 C CA . PHE B 2 33 ? 6.665 -17.813 -12.232 1.00 96.29 33 B 1 ATOM 1441 C C . PHE B 2 33 ? 6.885 -16.559 -13.072 1.00 96.39 33 B 1 ATOM 1442 O O . PHE B 2 33 ? 7.928 -15.921 -12.949 1.00 96.00 33 B 1 ATOM 1443 C CB . PHE B 2 33 ? 6.924 -19.059 -13.081 1.00 96.13 33 B 1 ATOM 1444 C CG . PHE B 2 33 ? 6.941 -20.378 -12.338 1.00 96.14 33 B 1 ATOM 1445 C CD1 . PHE B 2 33 ? 7.322 -20.465 -10.986 1.00 94.06 33 B 1 ATOM 1446 C CD2 . PHE B 2 33 ? 6.614 -21.559 -13.038 1.00 94.19 33 B 1 ATOM 1447 C CE1 . PHE B 2 33 ? 7.371 -21.708 -10.337 1.00 93.68 33 B 1 ATOM 1448 C CE2 . PHE B 2 33 ? 6.665 -22.803 -12.395 1.00 93.48 33 B 1 ATOM 1449 C CZ . PHE B 2 33 ? 7.045 -22.879 -11.043 1.00 94.12 33 B 1 ATOM 1450 N N . LYS B 2 34 ? 5.894 -16.183 -13.890 1.00 96.53 34 B 1 ATOM 1451 C CA . LYS B 2 34 ? 5.950 -14.955 -14.676 1.00 96.45 34 B 1 ATOM 1452 C C . LYS B 2 34 ? 6.098 -13.730 -13.779 1.00 96.31 34 B 1 ATOM 1453 O O . LYS B 2 34 ? 6.991 -12.918 -14.006 1.00 95.93 34 B 1 ATOM 1454 C CB . LYS B 2 34 ? 4.703 -14.866 -15.565 1.00 96.27 34 B 1 ATOM 1455 C CG . LYS B 2 34 ? 4.776 -13.622 -16.451 1.00 91.62 34 B 1 ATOM 1456 C CD . LYS B 2 34 ? 3.526 -13.464 -17.313 1.00 88.63 34 B 1 ATOM 1457 C CE . LYS B 2 34 ? 3.674 -12.123 -18.028 1.00 79.37 34 B 1 ATOM 1458 N NZ . LYS B 2 34 ? 2.452 -11.733 -18.765 1.00 71.70 34 B 1 ATOM 1459 N N . GLU B 2 35 ? 5.263 -13.614 -12.754 1.00 95.16 35 B 1 ATOM 1460 C CA . GLU B 2 35 ? 5.288 -12.483 -11.827 1.00 94.12 35 B 1 ATOM 1461 C C . GLU B 2 35 ? 6.624 -12.400 -11.077 1.00 94.36 35 B 1 ATOM 1462 O O . GLU B 2 35 ? 7.241 -11.335 -11.036 1.00 93.58 35 B 1 ATOM 1463 C CB . GLU B 2 35 ? 4.097 -12.594 -10.869 1.00 92.78 35 B 1 ATOM 1464 C CG . GLU B 2 35 ? 4.000 -11.395 -9.913 1.00 82.39 35 B 1 ATOM 1465 C CD . GLU B 2 35 ? 2.729 -11.416 -9.044 1.00 76.68 35 B 1 ATOM 1466 O OE1 . GLU B 2 35 ? 2.337 -10.324 -8.573 1.00 70.56 35 B 1 ATOM 1467 O OE2 . GLU B 2 35 ? 2.133 -12.503 -8.864 1.00 72.45 35 B 1 ATOM 1468 N N . GLN B 2 36 ? 7.124 -13.522 -10.561 1.00 94.74 36 B 1 ATOM 1469 C CA . GLN B 2 36 ? 8.408 -13.546 -9.858 1.00 94.81 36 B 1 ATOM 1470 C C . GLN B 2 36 ? 9.584 -13.212 -10.785 1.00 95.01 36 B 1 ATOM 1471 O O . GLN B 2 36 ? 10.503 -12.512 -10.370 1.00 94.12 36 B 1 ATOM 1472 C CB . GLN B 2 36 ? 8.631 -14.906 -9.185 1.00 94.29 36 B 1 ATOM 1473 C CG . GLN B 2 36 ? 7.617 -15.240 -8.078 1.00 92.72 36 B 1 ATOM 1474 C CD . GLN B 2 36 ? 7.495 -14.154 -7.014 1.00 92.39 36 B 1 ATOM 1475 O OE1 . GLN B 2 36 ? 8.447 -13.780 -6.354 1.00 85.45 36 B 1 ATOM 1476 N NE2 . GLN B 2 36 ? 6.309 -13.616 -6.823 1.00 84.33 36 B 1 ATOM 1477 N N . ASN B 2 37 ? 9.550 -13.651 -12.038 1.00 95.29 37 B 1 ATOM 1478 C CA . ASN B 2 37 ? 10.579 -13.303 -13.017 1.00 95.11 37 B 1 ATOM 1479 C C . ASN B 2 37 ? 10.526 -11.815 -13.397 1.00 94.74 37 B 1 ATOM 1480 O O . ASN B 2 37 ? 11.563 -11.162 -13.513 1.00 93.69 37 B 1 ATOM 1481 C CB . ASN B 2 37 ? 10.417 -14.207 -14.241 1.00 94.88 37 B 1 ATOM 1482 C CG . ASN B 2 37 ? 11.545 -14.010 -15.238 1.00 92.78 37 B 1 ATOM 1483 O OD1 . ASN B 2 37 ? 12.714 -14.159 -14.941 1.00 84.52 37 B 1 ATOM 1484 N ND2 . ASN B 2 37 ? 11.211 -13.692 -16.471 1.00 84.18 37 B 1 ATOM 1485 N N . GLU B 2 38 ? 9.332 -11.237 -13.542 1.00 95.43 38 B 1 ATOM 1486 C CA . GLU B 2 38 ? 9.166 -9.796 -13.757 1.00 94.79 38 B 1 ATOM 1487 C C . GLU B 2 38 ? 9.699 -8.980 -12.567 1.00 94.40 38 B 1 ATOM 1488 O O . GLU B 2 38 ? 10.390 -7.982 -12.774 1.00 92.84 38 B 1 ATOM 1489 C CB . GLU B 2 38 ? 7.683 -9.469 -14.002 1.00 94.37 38 B 1 ATOM 1490 C CG . GLU B 2 38 ? 7.165 -9.894 -15.386 1.00 92.41 38 B 1 ATOM 1491 C CD . GLU B 2 38 ? 5.650 -9.644 -15.577 1.00 91.60 38 B 1 ATOM 1492 O OE1 . GLU B 2 38 ? 5.124 -9.987 -16.661 1.00 85.10 38 B 1 ATOM 1493 O OE2 . GLU B 2 38 ? 4.981 -9.072 -14.674 1.00 87.85 38 B 1 ATOM 1494 N N . ILE B 2 39 ? 9.423 -9.418 -11.337 1.00 94.31 39 B 1 ATOM 1495 C CA . ILE B 2 39 ? 9.957 -8.808 -10.109 1.00 93.27 39 B 1 ATOM 1496 C C . ILE B 2 39 ? 11.489 -8.894 -10.085 1.00 92.81 39 B 1 ATOM 1497 O O . ILE B 2 39 ? 12.151 -7.879 -9.859 1.00 91.19 39 B 1 ATOM 1498 C CB . ILE B 2 39 ? 9.317 -9.465 -8.861 1.00 92.27 39 B 1 ATOM 1499 C CG1 . ILE B 2 39 ? 7.827 -9.057 -8.741 1.00 90.24 39 B 1 ATOM 1500 C CG2 . ILE B 2 39 ? 10.070 -9.085 -7.572 1.00 90.17 39 B 1 ATOM 1501 C CD1 . ILE B 2 39 ? 7.031 -9.877 -7.713 1.00 86.16 39 B 1 ATOM 1502 N N . ALA B 2 40 ? 12.055 -10.068 -10.358 1.00 93.14 40 B 1 ATOM 1503 C CA . ALA B 2 40 ? 13.503 -10.274 -10.390 1.00 92.41 40 B 1 ATOM 1504 C C . ALA B 2 40 ? 14.203 -9.428 -11.470 1.00 92.98 40 B 1 ATOM 1505 O O . ALA B 2 40 ? 15.335 -8.986 -11.278 1.00 91.15 40 B 1 ATOM 1506 C CB . ALA B 2 40 ? 13.777 -11.770 -10.596 1.00 90.96 40 B 1 ATOM 1507 N N . ASN B 2 41 ? 13.513 -9.142 -12.571 1.00 93.73 41 B 1 ATOM 1508 C CA . ASN B 2 41 ? 13.994 -8.267 -13.645 1.00 94.18 41 B 1 ATOM 1509 C C . ASN B 2 41 ? 13.763 -6.767 -13.370 1.00 93.95 41 B 1 ATOM 1510 O O . ASN B 2 41 ? 13.884 -5.946 -14.284 1.00 90.72 41 B 1 ATOM 1511 C CB . ASN B 2 41 ? 13.374 -8.733 -14.973 1.00 93.14 41 B 1 ATOM 1512 C CG . ASN B 2 41 ? 13.914 -10.078 -15.433 1.00 89.62 41 B 1 ATOM 1513 O OD1 . ASN B 2 41 ? 15.069 -10.423 -15.271 1.00 81.12 41 B 1 ATOM 1514 N ND2 . ASN B 2 41 ? 13.085 -10.878 -16.062 1.00 79.89 41 B 1 ATOM 1515 N N . GLY B 2 42 ? 13.426 -6.395 -12.130 1.00 92.94 42 B 1 ATOM 1516 C CA . GLY B 2 42 ? 13.303 -4.991 -11.733 1.00 92.65 42 B 1 ATOM 1517 C C . GLY B 2 42 ? 11.975 -4.331 -12.115 1.00 93.77 42 B 1 ATOM 1518 O O . GLY B 2 42 ? 11.924 -3.111 -12.272 1.00 91.49 42 B 1 ATOM 1519 N N . LYS B 2 43 ? 10.901 -5.095 -12.256 1.00 94.99 43 B 1 ATOM 1520 C CA . LYS B 2 43 ? 9.558 -4.540 -12.455 1.00 95.66 43 B 1 ATOM 1521 C C . LYS B 2 43 ? 9.240 -3.542 -11.348 1.00 95.88 43 B 1 ATOM 1522 O O . LYS B 2 43 ? 9.294 -3.863 -10.159 1.00 94.99 43 B 1 ATOM 1523 C CB . LYS B 2 43 ? 8.516 -5.663 -12.494 1.00 94.39 43 B 1 ATOM 1524 C CG . LYS B 2 43 ? 7.088 -5.143 -12.759 1.00 91.66 43 B 1 ATOM 1525 C CD . LYS B 2 43 ? 6.129 -6.329 -12.730 1.00 89.05 43 B 1 ATOM 1526 C CE . LYS B 2 43 ? 4.690 -5.940 -13.058 1.00 83.91 43 B 1 ATOM 1527 N NZ . LYS B 2 43 ? 3.862 -7.168 -13.133 1.00 76.73 43 B 1 ATOM 1528 N N . ARG B 2 44 ? 8.844 -2.342 -11.759 1.00 95.62 44 B 1 ATOM 1529 C CA . ARG B 2 44 ? 8.413 -1.290 -10.844 1.00 95.36 44 B 1 ATOM 1530 C C . ARG B 2 44 ? 6.943 -1.471 -10.467 1.00 95.58 44 B 1 ATOM 1531 O O . ARG B 2 44 ? 6.116 -1.879 -11.287 1.00 93.55 44 B 1 ATOM 1532 C CB . ARG B 2 44 ? 8.693 0.092 -11.443 1.00 93.07 44 B 1 ATOM 1533 C CG . ARG B 2 44 ? 10.205 0.352 -11.551 1.00 84.10 44 B 1 ATOM 1534 C CD . ARG B 2 44 ? 10.469 1.767 -12.051 1.00 82.07 44 B 1 ATOM 1535 N NE . ARG B 2 44 ? 11.908 2.112 -11.978 1.00 75.47 44 B 1 ATOM 1536 C CZ . ARG B 2 44 ? 12.381 3.315 -11.713 1.00 69.68 44 B 1 ATOM 1537 N NH1 . ARG B 2 44 ? 11.611 4.362 -11.638 1.00 62.26 44 B 1 ATOM 1538 N NH2 . ARG B 2 44 ? 13.641 3.487 -11.482 1.00 62.31 44 B 1 ATOM 1539 N N . SER B 2 45 ? 6.634 -1.156 -9.214 1.00 96.25 45 B 1 ATOM 1540 C CA . SER B 2 45 ? 5.260 -1.000 -8.751 1.00 95.87 45 B 1 ATOM 1541 C C . SER B 2 45 ? 4.686 0.346 -9.211 1.00 96.24 45 B 1 ATOM 1542 O O . SER B 2 45 ? 5.381 1.166 -9.808 1.00 95.15 45 B 1 ATOM 1543 C CB . SER B 2 45 ? 5.214 -1.136 -7.223 1.00 94.45 45 B 1 ATOM 1544 O OG . SER B 2 45 ? 5.790 -0.006 -6.610 1.00 93.41 45 B 1 ATOM 1545 N N . MET B 2 46 ? 3.412 0.594 -8.886 1.00 95.64 46 B 1 ATOM 1546 C CA . MET B 2 46 ? 2.777 1.903 -9.079 1.00 95.35 46 B 1 ATOM 1547 C C . MET B 2 46 ? 3.158 2.927 -7.997 1.00 96.62 46 B 1 ATOM 1548 O O . MET B 2 46 ? 2.677 4.055 -8.037 1.00 95.26 46 B 1 ATOM 1549 C CB . MET B 2 46 ? 1.247 1.728 -9.124 1.00 93.19 46 B 1 ATOM 1550 C CG . MET B 2 46 ? 0.767 0.876 -10.305 1.00 86.27 46 B 1 ATOM 1551 S SD . MET B 2 46 ? 1.160 1.513 -11.961 1.00 75.91 46 B 1 ATOM 1552 C CE . MET B 2 46 ? 0.229 3.068 -11.970 1.00 65.29 46 B 1 ATOM 1553 N N . VAL B 2 47 ? 3.956 2.540 -7.006 1.00 97.25 47 B 1 ATOM 1554 C CA . VAL B 2 47 ? 4.363 3.420 -5.905 1.00 97.64 47 B 1 ATOM 1555 C C . VAL B 2 47 ? 5.474 4.352 -6.393 1.00 97.81 47 B 1 ATOM 1556 O O . VAL B 2 47 ? 6.463 3.859 -6.936 1.00 97.15 47 B 1 ATOM 1557 C CB . VAL B 2 47 ? 4.799 2.600 -4.679 1.00 96.93 47 B 1 ATOM 1558 C CG1 . VAL B 2 47 ? 5.298 3.494 -3.551 1.00 94.41 47 B 1 ATOM 1559 C CG2 . VAL B 2 47 ? 3.610 1.794 -4.133 1.00 94.59 47 B 1 ATOM 1560 N N . PRO B 2 48 ? 5.340 5.682 -6.201 1.00 98.09 48 B 1 ATOM 1561 C CA . PRO B 2 48 ? 6.347 6.633 -6.659 1.00 97.97 48 B 1 ATOM 1562 C C . PRO B 2 48 ? 7.686 6.496 -5.920 1.00 97.99 48 B 1 ATOM 1563 O O . PRO B 2 48 ? 7.724 6.270 -4.712 1.00 97.34 48 B 1 ATOM 1564 C CB . PRO B 2 48 ? 5.724 8.017 -6.460 1.00 97.37 48 B 1 ATOM 1565 C CG . PRO B 2 48 ? 4.221 7.750 -6.432 1.00 96.02 48 B 1 ATOM 1566 C CD . PRO B 2 48 ? 4.144 6.389 -5.759 1.00 97.59 48 B 1 ATOM 1567 N N . ASP B 2 49 ? 8.796 6.695 -6.639 1.00 97.21 49 B 1 ATOM 1568 C CA . ASP B 2 49 ? 10.155 6.482 -6.113 1.00 96.99 49 B 1 ATOM 1569 C C . ASP B 2 49 ? 10.524 7.418 -4.944 1.00 97.54 49 B 1 ATOM 1570 O O . ASP B 2 49 ? 11.320 7.042 -4.085 1.00 96.43 49 B 1 ATOM 1571 C CB . ASP B 2 49 ? 11.188 6.649 -7.245 1.00 95.30 49 B 1 ATOM 1572 C CG . ASP B 2 49 ? 11.284 5.459 -8.202 1.00 92.43 49 B 1 ATOM 1573 O OD1 . ASP B 2 49 ? 11.048 4.304 -7.782 1.00 87.65 49 B 1 ATOM 1574 O OD2 . ASP B 2 49 ? 11.667 5.660 -9.380 1.00 86.76 49 B 1 ATOM 1575 N N . ASN B 2 50 ? 9.938 8.616 -4.891 1.00 97.52 50 B 1 ATOM 1576 C CA . ASN B 2 50 ? 10.160 9.588 -3.814 1.00 97.70 50 B 1 ATOM 1577 C C . ASN B 2 50 ? 9.064 9.560 -2.730 1.00 98.01 50 B 1 ATOM 1578 O O . ASN B 2 50 ? 9.004 10.464 -1.891 1.00 97.27 50 B 1 ATOM 1579 C CB . ASN B 2 50 ? 10.363 10.992 -4.408 1.00 97.06 50 B 1 ATOM 1580 C CG . ASN B 2 50 ? 11.660 11.158 -5.179 1.00 95.95 50 B 1 ATOM 1581 O OD1 . ASN B 2 50 ? 12.555 10.328 -5.180 1.00 89.74 50 B 1 ATOM 1582 N ND2 . ASN B 2 50 ? 11.812 12.282 -5.847 1.00 88.67 50 B 1 ATOM 1583 N N . SER B 2 51 ? 8.204 8.550 -2.714 1.00 98.25 51 B 1 ATOM 1584 C CA . SER B 2 51 ? 7.284 8.310 -1.601 1.00 98.28 51 B 1 ATOM 1585 C C . SER B 2 51 ? 8.033 7.766 -0.377 1.00 98.41 51 B 1 ATOM 1586 O O . SER B 2 51 ? 9.071 7.110 -0.505 1.00 97.97 51 B 1 ATOM 1587 C CB . SER B 2 51 ? 6.145 7.372 -2.018 1.00 97.59 51 B 1 ATOM 1588 O OG . SER B 2 51 ? 6.625 6.073 -2.288 1.00 94.39 51 B 1 ATOM 1589 N N . ILE B 2 52 ? 7.508 8.018 0.815 1.00 98.45 52 B 1 ATOM 1590 C CA . ILE B 2 52 ? 8.120 7.614 2.087 1.00 98.51 52 B 1 ATOM 1591 C C . ILE B 2 52 ? 7.091 6.824 2.910 1.00 98.49 52 B 1 ATOM 1592 O O . ILE B 2 52 ? 6.423 7.381 3.782 1.00 98.19 52 B 1 ATOM 1593 C CB . ILE B 2 52 ? 8.693 8.841 2.833 1.00 98.45 52 B 1 ATOM 1594 C CG1 . ILE B 2 52 ? 9.693 9.642 1.958 1.00 97.85 52 B 1 ATOM 1595 C CG2 . ILE B 2 52 ? 9.394 8.386 4.131 1.00 97.94 52 B 1 ATOM 1596 C CD1 . ILE B 2 52 ? 9.894 11.081 2.444 1.00 95.56 52 B 1 ATOM 1597 N N . PRO B 2 53 ? 6.905 5.528 2.627 1.00 98.53 53 B 1 ATOM 1598 C CA . PRO B 2 53 ? 5.925 4.701 3.320 1.00 98.37 53 B 1 ATOM 1599 C C . PRO B 2 53 ? 6.430 4.263 4.698 1.00 98.30 53 B 1 ATOM 1600 O O . PRO B 2 53 ? 7.517 3.698 4.822 1.00 97.50 53 B 1 ATOM 1601 C CB . PRO B 2 53 ? 5.666 3.495 2.409 1.00 97.85 53 B 1 ATOM 1602 C CG . PRO B 2 53 ? 6.356 3.837 1.087 1.00 96.43 53 B 1 ATOM 1603 C CD . PRO B 2 53 ? 7.464 4.787 1.504 1.00 97.98 53 B 1 ATOM 1604 N N . ILE B 2 54 ? 5.604 4.444 5.722 1.00 98.25 54 B 1 ATOM 1605 C CA . ILE B 2 54 ? 5.847 3.966 7.085 1.00 98.22 54 B 1 ATOM 1606 C C . ILE B 2 54 ? 4.709 3.020 7.469 1.00 98.04 54 B 1 ATOM 1607 O O . ILE B 2 54 ? 3.591 3.447 7.770 1.00 97.42 54 B 1 ATOM 1608 C CB . ILE B 2 54 ? 5.994 5.145 8.075 1.00 98.17 54 B 1 ATOM 1609 C CG1 . ILE B 2 54 ? 7.104 6.127 7.623 1.00 97.48 54 B 1 ATOM 1610 C CG2 . ILE B 2 54 ? 6.280 4.601 9.490 1.00 97.56 54 B 1 ATOM 1611 C CD1 . ILE B 2 54 ? 7.204 7.391 8.490 1.00 95.75 54 B 1 ATOM 1612 N N . CYS B 2 55 ? 4.981 1.726 7.467 1.00 97.35 55 B 1 ATOM 1613 C CA . CYS B 2 55 ? 4.011 0.726 7.896 1.00 96.75 55 B 1 ATOM 1614 C C . CYS B 2 55 ? 3.999 0.638 9.424 1.00 96.58 55 B 1 ATOM 1615 O O . CYS B 2 55 ? 4.848 -0.030 10.018 1.00 95.48 55 B 1 ATOM 1616 C CB . CYS B 2 55 ? 4.315 -0.617 7.224 1.00 95.88 55 B 1 ATOM 1617 S SG . CYS B 2 55 ? 2.992 -1.797 7.626 1.00 93.96 55 B 1 ATOM 1618 N N . SER B 2 56 ? 3.029 1.284 10.057 1.00 96.60 56 B 1 ATOM 1619 C CA . SER B 2 56 ? 2.906 1.277 11.513 1.00 96.77 56 B 1 ATOM 1620 C C . SER B 2 56 ? 1.462 1.466 11.978 1.00 97.07 56 B 1 ATOM 1621 O O . SER B 2 56 ? 0.636 2.087 11.308 1.00 96.23 56 B 1 ATOM 1622 C CB . SER B 2 56 ? 3.806 2.362 12.116 1.00 96.16 56 B 1 ATOM 1623 O OG . SER B 2 56 ? 3.922 2.177 13.516 1.00 91.16 56 B 1 ATOM 1624 N N . ASP B 2 57 ? 1.180 0.937 13.155 1.00 96.64 57 B 1 ATOM 1625 C CA . ASP B 2 57 ? 0.035 1.342 13.968 1.00 97.16 57 B 1 ATOM 1626 C C . ASP B 2 57 ? 0.392 2.662 14.663 1.00 97.50 57 B 1 ATOM 1627 O O . ASP B 2 57 ? 1.365 2.721 15.416 1.00 96.81 57 B 1 ATOM 1628 C CB . ASP B 2 57 ? -0.263 0.207 14.958 1.00 96.75 57 B 1 ATOM 1629 C CG . ASP B 2 57 ? -1.358 0.483 15.988 1.00 96.40 57 B 1 ATOM 1630 O OD1 . ASP B 2 57 ? -1.854 1.627 16.080 1.00 93.84 57 B 1 ATOM 1631 O OD2 . ASP B 2 57 ? -1.660 -0.468 16.753 1.00 93.03 57 B 1 ATOM 1632 N N . VAL B 2 58 ? -0.392 3.722 14.411 1.00 97.66 58 B 1 ATOM 1633 C CA . VAL B 2 58 ? -0.125 5.051 14.980 1.00 97.80 58 B 1 ATOM 1634 C C . VAL B 2 58 ? -0.174 5.063 16.509 1.00 97.91 58 B 1 ATOM 1635 O O . VAL B 2 58 ? 0.449 5.916 17.124 1.00 97.17 58 B 1 ATOM 1636 C CB . VAL B 2 58 ? -1.067 6.138 14.430 1.00 97.07 58 B 1 ATOM 1637 C CG1 . VAL B 2 58 ? -0.932 6.272 12.909 1.00 93.58 58 B 1 ATOM 1638 C CG2 . VAL B 2 58 ? -2.536 5.883 14.795 1.00 94.18 58 B 1 ATOM 1639 N N . THR B 2 59 ? -0.859 4.108 17.127 1.00 97.42 59 B 1 ATOM 1640 C CA . THR B 2 59 ? -0.914 3.991 18.594 1.00 97.08 59 B 1 ATOM 1641 C C . THR B 2 59 ? 0.384 3.440 19.194 1.00 97.09 59 B 1 ATOM 1642 O O . THR B 2 59 ? 0.574 3.505 20.407 1.00 95.73 59 B 1 ATOM 1643 C CB . THR B 2 59 ? -2.104 3.144 19.067 1.00 96.38 59 B 1 ATOM 1644 O OG1 . THR B 2 59 ? -1.961 1.774 18.766 1.00 90.10 59 B 1 ATOM 1645 C CG2 . THR B 2 59 ? -3.438 3.615 18.480 1.00 88.79 59 B 1 ATOM 1646 N N . LYS B 2 60 ? 1.278 2.906 18.350 1.00 97.03 60 B 1 ATOM 1647 C CA . LYS B 2 60 ? 2.577 2.333 18.733 1.00 96.51 60 B 1 ATOM 1648 C C . LYS B 2 60 ? 3.758 3.039 18.070 1.00 96.82 60 B 1 ATOM 1649 O O . LYS B 2 60 ? 4.903 2.725 18.381 1.00 95.01 60 B 1 ATOM 1650 C CB . LYS B 2 60 ? 2.594 0.840 18.387 1.00 95.40 60 B 1 ATOM 1651 C CG . LYS B 2 60 ? 1.490 0.056 19.114 1.00 92.82 60 B 1 ATOM 1652 C CD . LYS B 2 60 ? 1.489 -1.397 18.648 1.00 86.83 60 B 1 ATOM 1653 C CE . LYS B 2 60 ? 0.256 -2.092 19.224 1.00 80.71 60 B 1 ATOM 1654 N NZ . LYS B 2 60 ? -0.035 -3.346 18.498 1.00 69.49 60 B 1 ATOM 1655 N N . LEU B 2 61 ? 3.491 3.963 17.147 1.00 96.88 61 B 1 ATOM 1656 C CA . LEU B 2 61 ? 4.524 4.686 16.418 1.00 97.33 61 B 1 ATOM 1657 C C . LEU B 2 61 ? 5.310 5.606 17.362 1.00 97.64 61 B 1 ATOM 1658 O O . LEU B 2 61 ? 4.738 6.396 18.106 1.00 97.05 61 B 1 ATOM 1659 C CB . LEU B 2 61 ? 3.874 5.466 15.264 1.00 96.98 61 B 1 ATOM 1660 C CG . LEU B 2 61 ? 4.867 6.289 14.422 1.00 96.49 61 B 1 ATOM 1661 C CD1 . LEU B 2 61 ? 5.868 5.405 13.679 1.00 94.05 61 B 1 ATOM 1662 C CD2 . LEU B 2 61 ? 4.102 7.105 13.386 1.00 93.82 61 B 1 ATOM 1663 N N . ASN B 2 62 ? 6.637 5.552 17.257 1.00 97.26 62 B 1 ATOM 1664 C CA . ASN B 2 62 ? 7.500 6.537 17.892 1.00 97.40 62 B 1 ATOM 1665 C C . ASN B 2 62 ? 7.490 7.843 17.077 1.00 97.87 62 B 1 ATOM 1666 O O . ASN B 2 62 ? 8.294 8.037 16.164 1.00 97.47 62 B 1 ATOM 1667 C CB . ASN B 2 62 ? 8.909 5.943 18.075 1.00 96.52 62 B 1 ATOM 1668 C CG . ASN B 2 62 ? 9.820 6.900 18.829 1.00 95.10 62 B 1 ATOM 1669 O OD1 . ASN B 2 62 ? 9.468 8.017 19.154 1.00 90.42 62 B 1 ATOM 1670 N ND2 . ASN B 2 62 ? 11.027 6.479 19.133 1.00 88.39 62 B 1 ATOM 1671 N N . PHE B 2 63 ? 6.578 8.755 17.421 1.00 98.07 63 B 1 ATOM 1672 C CA . PHE B 2 63 ? 6.478 10.065 16.774 1.00 98.25 63 B 1 ATOM 1673 C C . PHE B 2 63 ? 7.729 10.929 16.979 1.00 98.35 63 B 1 ATOM 1674 O O . PHE B 2 63 ? 8.045 11.733 16.108 1.00 97.90 63 B 1 ATOM 1675 C CB . PHE B 2 63 ? 5.232 10.794 17.278 1.00 98.04 63 B 1 ATOM 1676 C CG . PHE B 2 63 ? 3.946 10.319 16.630 1.00 98.13 63 B 1 ATOM 1677 C CD1 . PHE B 2 63 ? 3.569 10.825 15.372 1.00 97.12 63 B 1 ATOM 1678 C CD2 . PHE B 2 63 ? 3.119 9.383 17.275 1.00 97.14 63 B 1 ATOM 1679 C CE1 . PHE B 2 63 ? 2.370 10.409 14.767 1.00 96.44 63 B 1 ATOM 1680 C CE2 . PHE B 2 63 ? 1.920 8.963 16.673 1.00 96.45 63 B 1 ATOM 1681 C CZ . PHE B 2 63 ? 1.544 9.479 15.420 1.00 96.87 63 B 1 ATOM 1682 N N . GLN B 2 64 ? 8.478 10.739 18.068 1.00 98.01 64 B 1 ATOM 1683 C CA . GLN B 2 64 ? 9.727 11.474 18.274 1.00 97.99 64 B 1 ATOM 1684 C C . GLN B 2 64 ? 10.775 11.088 17.227 1.00 98.12 64 B 1 ATOM 1685 O O . GLN B 2 64 ? 11.429 11.963 16.671 1.00 97.80 64 B 1 ATOM 1686 C CB . GLN B 2 64 ? 10.244 11.269 19.706 1.00 97.62 64 B 1 ATOM 1687 C CG . GLN B 2 64 ? 11.420 12.208 20.028 1.00 93.48 64 B 1 ATOM 1688 C CD . GLN B 2 64 ? 11.016 13.679 19.910 1.00 93.97 64 B 1 ATOM 1689 O OE1 . GLN B 2 64 ? 10.010 14.110 20.453 1.00 85.96 64 B 1 ATOM 1690 N NE2 . GLN B 2 64 ? 11.755 14.480 19.180 1.00 85.06 64 B 1 ATOM 1691 N N . ALA B 2 65 ? 10.875 9.808 16.869 1.00 98.14 65 B 1 ATOM 1692 C CA . ALA B 2 65 ? 11.764 9.369 15.790 1.00 98.01 65 B 1 ATOM 1693 C C . ALA B 2 65 ? 11.383 9.990 14.431 1.00 98.26 65 B 1 ATOM 1694 O O . ALA B 2 65 ? 12.267 10.362 13.657 1.00 97.78 65 B 1 ATOM 1695 C CB . ALA B 2 65 ? 11.759 7.840 15.730 1.00 97.48 65 B 1 ATOM 1696 N N . LEU B 2 66 ? 10.084 10.157 14.152 1.00 98.39 66 B 1 ATOM 1697 C CA . LEU B 2 66 ? 9.602 10.871 12.962 1.00 98.47 66 B 1 ATOM 1698 C C . LEU B 2 66 ? 10.026 12.346 12.987 1.00 98.54 66 B 1 ATOM 1699 O O . LEU B 2 66 ? 10.544 12.849 11.989 1.00 98.29 66 B 1 ATOM 1700 C CB . LEU B 2 66 ? 8.072 10.708 12.856 1.00 98.28 66 B 1 ATOM 1701 C CG . LEU B 2 66 ? 7.398 11.570 11.765 1.00 97.58 66 B 1 ATOM 1702 C CD1 . LEU B 2 66 ? 7.866 11.202 10.361 1.00 96.46 66 B 1 ATOM 1703 C CD2 . LEU B 2 66 ? 5.883 11.385 11.827 1.00 96.17 66 B 1 ATOM 1704 N N . ILE B 2 67 ? 9.843 13.028 14.120 1.00 98.43 67 B 1 ATOM 1705 C CA . ILE B 2 67 ? 10.240 14.430 14.311 1.00 98.31 67 B 1 ATOM 1706 C C . ILE B 2 67 ? 11.752 14.586 14.112 1.00 98.36 67 B 1 ATOM 1707 O O . ILE B 2 67 ? 12.191 15.447 13.348 1.00 98.10 67 B 1 ATOM 1708 C CB . ILE B 2 67 ? 9.787 14.925 15.707 1.00 97.98 67 B 1 ATOM 1709 C CG1 . ILE B 2 67 ? 8.246 15.036 15.771 1.00 96.39 67 B 1 ATOM 1710 C CG2 . ILE B 2 67 ? 10.420 16.285 16.068 1.00 96.79 67 B 1 ATOM 1711 C CD1 . ILE B 2 67 ? 7.692 15.112 17.197 1.00 93.04 67 B 1 ATOM 1712 N N . ASP B 2 68 ? 12.544 13.733 14.742 1.00 98.33 68 B 1 ATOM 1713 C CA . ASP B 2 68 ? 14.001 13.788 14.686 1.00 98.26 68 B 1 ATOM 1714 C C . ASP B 2 68 ? 14.522 13.553 13.261 1.00 98.25 68 B 1 ATOM 1715 O O . ASP B 2 68 ? 15.398 14.284 12.792 1.00 97.77 68 B 1 ATOM 1716 C CB . ASP B 2 68 ? 14.599 12.749 15.648 1.00 98.03 68 B 1 ATOM 1717 C CG . ASP B 2 68 ? 14.323 13.012 17.131 1.00 96.42 68 B 1 ATOM 1718 O OD1 . ASP B 2 68 ? 13.894 14.133 17.487 1.00 93.71 68 B 1 ATOM 1719 O OD2 . ASP B 2 68 ? 14.556 12.071 17.928 1.00 93.70 68 B 1 ATOM 1720 N N . ALA B 2 69 ? 13.962 12.578 12.543 1.00 98.31 69 B 1 ATOM 1721 C CA . ALA B 2 69 ? 14.310 12.318 11.147 1.00 98.25 69 B 1 ATOM 1722 C C . ALA B 2 69 ? 13.914 13.488 10.234 1.00 98.35 69 B 1 ATOM 1723 O O . ALA B 2 69 ? 14.723 13.943 9.420 1.00 97.97 69 B 1 ATOM 1724 C CB . ALA B 2 69 ? 13.643 11.010 10.708 1.00 97.97 69 B 1 ATOM 1725 N N . GLN B 2 70 ? 12.716 14.034 10.401 1.00 98.34 70 B 1 ATOM 1726 C CA . GLN B 2 70 ? 12.238 15.176 9.624 1.00 98.30 70 B 1 ATOM 1727 C C . GLN B 2 70 ? 13.124 16.411 9.837 1.00 98.23 70 B 1 ATOM 1728 O O . GLN B 2 70 ? 13.538 17.053 8.867 1.00 97.81 70 B 1 ATOM 1729 C CB . GLN B 2 70 ? 10.764 15.437 9.983 1.00 98.02 70 B 1 ATOM 1730 C CG . GLN B 2 70 ? 10.154 16.651 9.263 1.00 96.95 70 B 1 ATOM 1731 C CD . GLN B 2 70 ? 10.169 16.562 7.743 1.00 97.84 70 B 1 ATOM 1732 O OE1 . GLN B 2 70 ? 10.285 15.518 7.129 1.00 93.29 70 B 1 ATOM 1733 N NE2 . GLN B 2 70 ? 10.063 17.689 7.077 1.00 92.95 70 B 1 ATOM 1734 N N . MET B 2 71 ? 13.481 16.723 11.080 1.00 98.06 71 B 1 ATOM 1735 C CA . MET B 2 71 ? 14.389 17.831 11.382 1.00 97.79 71 B 1 ATOM 1736 C C . MET B 2 71 ? 15.795 17.588 10.822 1.00 97.68 71 B 1 ATOM 1737 O O . MET B 2 71 ? 16.395 18.504 10.259 1.00 96.88 71 B 1 ATOM 1738 C CB . MET B 2 71 ? 14.445 18.066 12.896 1.00 97.37 71 B 1 ATOM 1739 C CG . MET B 2 71 ? 13.174 18.748 13.416 1.00 93.34 71 B 1 ATOM 1740 S SD . MET B 2 71 ? 12.828 20.391 12.709 1.00 92.00 71 B 1 ATOM 1741 C CE . MET B 2 71 ? 14.207 21.349 13.385 1.00 80.33 71 B 1 ATOM 1742 N N . ARG B 2 72 ? 16.310 16.364 10.915 1.00 97.76 72 B 1 ATOM 1743 C CA . ARG B 2 72 ? 17.640 15.993 10.409 1.00 97.57 72 B 1 ATOM 1744 C C . ARG B 2 72 ? 17.750 16.116 8.890 1.00 97.42 72 B 1 ATOM 1745 O O . ARG B 2 72 ? 18.768 16.590 8.392 1.00 96.54 72 B 1 ATOM 1746 C CB . ARG B 2 72 ? 17.958 14.566 10.869 1.00 97.01 72 B 1 ATOM 1747 C CG . ARG B 2 72 ? 19.432 14.194 10.711 1.00 89.65 72 B 1 ATOM 1748 C CD . ARG B 2 72 ? 19.678 12.715 11.057 1.00 89.17 72 B 1 ATOM 1749 N NE . ARG B 2 72 ? 18.936 12.283 12.261 1.00 81.61 72 B 1 ATOM 1750 C CZ . ARG B 2 72 ? 18.272 11.144 12.392 1.00 77.69 72 B 1 ATOM 1751 N NH1 . ARG B 2 72 ? 18.364 10.198 11.523 1.00 68.04 72 B 1 ATOM 1752 N NH2 . ARG B 2 72 ? 17.479 10.938 13.395 1.00 69.61 72 B 1 ATOM 1753 N N . HIS B 2 73 ? 16.716 15.696 8.159 1.00 97.61 73 B 1 ATOM 1754 C CA . HIS B 2 73 ? 16.775 15.560 6.699 1.00 97.21 73 B 1 ATOM 1755 C C . HIS B 2 73 ? 16.136 16.721 5.926 1.00 96.68 73 B 1 ATOM 1756 O O . HIS B 2 73 ? 16.501 16.933 4.772 1.00 95.40 73 B 1 ATOM 1757 C CB . HIS B 2 73 ? 16.175 14.208 6.296 1.00 97.19 73 B 1 ATOM 1758 C CG . HIS B 2 73 ? 16.926 13.038 6.873 1.00 97.55 73 B 1 ATOM 1759 N ND1 . HIS B 2 73 ? 18.299 12.831 6.791 1.00 89.68 73 B 1 ATOM 1760 C CD2 . HIS B 2 73 ? 16.390 12.008 7.598 1.00 90.74 73 B 1 ATOM 1761 C CE1 . HIS B 2 73 ? 18.565 11.699 7.451 1.00 92.96 73 B 1 ATOM 1762 N NE2 . HIS B 2 73 ? 17.435 11.176 7.953 1.00 94.13 73 B 1 ATOM 1763 N N . ALA B 2 74 ? 15.225 17.481 6.535 1.00 97.70 74 B 1 ATOM 1764 C CA . ALA B 2 74 ? 14.585 18.650 5.916 1.00 97.12 74 B 1 ATOM 1765 C C . ALA B 2 74 ? 14.862 19.977 6.651 1.00 96.50 74 B 1 ATOM 1766 O O . ALA B 2 74 ? 14.611 21.048 6.098 1.00 93.81 74 B 1 ATOM 1767 C CB . ALA B 2 74 ? 13.080 18.381 5.785 1.00 96.49 74 B 1 ATOM 1768 N N . GLY B 2 75 ? 15.344 19.934 7.892 1.00 96.77 75 B 1 ATOM 1769 C CA . GLY B 2 75 ? 15.627 21.129 8.699 1.00 95.96 75 B 1 ATOM 1770 C C . GLY B 2 75 ? 14.389 21.889 9.188 1.00 95.92 75 B 1 ATOM 1771 O O . GLY B 2 75 ? 14.516 22.991 9.720 1.00 93.73 75 B 1 ATOM 1772 N N . LYS B 2 76 ? 13.191 21.335 8.993 1.00 96.02 76 B 1 ATOM 1773 C CA . LYS B 2 76 ? 11.912 21.919 9.416 1.00 95.88 76 B 1 ATOM 1774 C C . LYS B 2 76 ? 10.834 20.849 9.558 1.00 96.84 76 B 1 ATOM 1775 O O . LYS B 2 76 ? 10.942 19.778 8.965 1.00 96.29 76 B 1 ATOM 1776 C CB . LYS B 2 76 ? 11.469 23.022 8.434 1.00 93.11 76 B 1 ATOM 1777 C CG . LYS B 2 76 ? 11.125 22.508 7.031 1.00 89.34 76 B 1 ATOM 1778 C CD . LYS B 2 76 ? 10.751 23.683 6.105 1.00 87.91 76 B 1 ATOM 1779 C CE . LYS B 2 76 ? 10.319 23.199 4.718 1.00 82.92 76 B 1 ATOM 1780 N NZ . LYS B 2 76 ? 8.961 22.611 4.731 1.00 78.40 76 B 1 ATOM 1781 N N . MET B 2 77 ? 9.775 21.177 10.294 1.00 97.05 77 B 1 ATOM 1782 C CA . MET B 2 77 ? 8.576 20.345 10.397 1.00 97.33 77 B 1 ATOM 1783 C C . MET B 2 77 ? 7.722 20.376 9.119 1.00 97.54 77 B 1 ATOM 1784 O O . MET B 2 77 ? 8.056 21.057 8.142 1.00 96.76 77 B 1 ATOM 1785 C CB . MET B 2 77 ? 7.775 20.758 11.639 1.00 96.77 77 B 1 ATOM 1786 C CG . MET B 2 77 ? 8.499 20.429 12.958 1.00 93.44 77 B 1 ATOM 1787 S SD . MET B 2 77 ? 8.639 18.651 13.288 1.00 90.60 77 B 1 ATOM 1788 C CE . MET B 2 77 ? 10.171 18.216 12.473 1.00 78.68 77 B 1 ATOM 1789 N N . PHE B 2 78 ? 6.629 19.618 9.118 1.00 98.10 78 B 1 ATOM 1790 C CA . PHE B 2 78 ? 5.727 19.497 7.977 1.00 98.30 78 B 1 ATOM 1791 C C . PHE B 2 78 ? 4.960 20.795 7.707 1.00 98.15 78 B 1 ATOM 1792 O O . PHE B 2 78 ? 4.519 21.477 8.630 1.00 97.52 78 B 1 ATOM 1793 C CB . PHE B 2 78 ? 4.791 18.306 8.195 1.00 98.42 78 B 1 ATOM 1794 C CG . PHE B 2 78 ? 5.527 16.987 8.280 1.00 98.56 78 B 1 ATOM 1795 C CD1 . PHE B 2 78 ? 6.026 16.388 7.108 1.00 98.17 78 B 1 ATOM 1796 C CD2 . PHE B 2 78 ? 5.770 16.380 9.524 1.00 98.05 78 B 1 ATOM 1797 C CE1 . PHE B 2 78 ? 6.753 15.191 7.176 1.00 97.89 78 B 1 ATOM 1798 C CE2 . PHE B 2 78 ? 6.497 15.179 9.597 1.00 97.88 78 B 1 ATOM 1799 C CZ . PHE B 2 78 ? 6.988 14.587 8.422 1.00 98.12 78 B 1 ATOM 1800 N N . ASP B 2 79 ? 4.784 21.119 6.424 1.00 98.12 79 B 1 ATOM 1801 C CA . ASP B 2 79 ? 4.016 22.284 5.974 1.00 98.00 79 B 1 ATOM 1802 C C . ASP B 2 79 ? 2.521 21.963 5.870 1.00 98.24 79 B 1 ATOM 1803 O O . ASP B 2 79 ? 1.677 22.794 6.202 1.00 97.72 79 B 1 ATOM 1804 C CB . ASP B 2 79 ? 4.532 22.748 4.607 1.00 97.46 79 B 1 ATOM 1805 C CG . ASP B 2 79 ? 6.007 23.140 4.617 1.00 96.93 79 B 1 ATOM 1806 O OD1 . ASP B 2 79 ? 6.400 24.089 5.329 1.00 94.58 79 B 1 ATOM 1807 O OD2 . ASP B 2 79 ? 6.806 22.515 3.887 1.00 94.38 79 B 1 ATOM 1808 N N . VAL B 2 80 ? 2.191 20.757 5.427 1.00 98.36 80 B 1 ATOM 1809 C CA . VAL B 2 80 ? 0.808 20.271 5.372 1.00 98.53 80 B 1 ATOM 1810 C C . VAL B 2 80 ? 0.737 18.874 5.971 1.00 98.68 80 B 1 ATOM 1811 O O . VAL B 2 80 ? 1.520 17.991 5.620 1.00 98.49 80 B 1 ATOM 1812 C CB . VAL B 2 80 ? 0.227 20.296 3.943 1.00 98.27 80 B 1 ATOM 1813 C CG1 . VAL B 2 80 ? -1.250 19.885 3.945 1.00 97.31 80 B 1 ATOM 1814 C CG2 . VAL B 2 80 ? 0.325 21.693 3.310 1.00 97.36 80 B 1 ATOM 1815 N N . ILE B 2 81 ? -0.221 18.669 6.860 1.00 98.73 81 B 1 ATOM 1816 C CA . ILE B 2 81 ? -0.598 17.355 7.383 1.00 98.80 81 B 1 ATOM 1817 C C . ILE B 2 81 ? -1.983 17.022 6.851 1.00 98.82 81 B 1 ATOM 1818 O O . ILE B 2 81 ? -2.905 17.813 7.001 1.00 98.63 81 B 1 ATOM 1819 C CB . ILE B 2 81 ? -0.551 17.323 8.927 1.00 98.72 81 B 1 ATOM 1820 C CG1 . ILE B 2 81 ? 0.865 17.693 9.434 1.00 98.17 81 B 1 ATOM 1821 C CG2 . ILE B 2 81 ? -0.980 15.933 9.441 1.00 98.36 81 B 1 ATOM 1822 C CD1 . ILE B 2 81 ? 1.000 17.730 10.959 1.00 97.46 81 B 1 ATOM 1823 N N . MET B 2 82 ? -2.160 15.842 6.272 1.00 98.82 82 B 1 ATOM 1824 C CA . MET B 2 82 ? -3.473 15.322 5.905 1.00 98.79 82 B 1 ATOM 1825 C C . MET B 2 82 ? -3.752 14.040 6.673 1.00 98.84 82 B 1 ATOM 1826 O O . MET B 2 82 ? -2.859 13.222 6.894 1.00 98.62 82 B 1 ATOM 1827 C CB . MET B 2 82 ? -3.574 15.140 4.384 1.00 98.31 82 B 1 ATOM 1828 C CG . MET B 2 82 ? -4.979 14.681 3.954 1.00 96.59 82 B 1 ATOM 1829 S SD . MET B 2 82 ? -5.297 14.746 2.168 1.00 95.87 82 B 1 ATOM 1830 C CE . MET B 2 82 ? -4.079 13.545 1.569 1.00 89.51 82 B 1 ATOM 1831 N N . MET B 2 83 ? -5.008 13.833 7.068 1.00 98.56 83 B 1 ATOM 1832 C CA . MET B 2 83 ? -5.427 12.548 7.612 1.00 98.34 83 B 1 ATOM 1833 C C . MET B 2 83 ? -6.831 12.160 7.167 1.00 98.58 83 B 1 ATOM 1834 O O . MET B 2 83 ? -7.726 12.991 7.042 1.00 98.04 83 B 1 ATOM 1835 C CB . MET B 2 83 ? -5.250 12.513 9.137 1.00 95.63 83 B 1 ATOM 1836 C CG . MET B 2 83 ? -6.133 13.517 9.885 1.00 88.50 83 B 1 ATOM 1837 S SD . MET B 2 83 ? -5.889 13.514 11.689 1.00 91.17 83 B 1 ATOM 1838 C CE . MET B 2 83 ? -4.245 14.250 11.777 1.00 84.04 83 B 1 ATOM 1839 N N . ASP B 2 84 ? -7.018 10.860 6.952 1.00 98.40 84 B 1 ATOM 1840 C CA . ASP B 2 84 ? -8.310 10.242 6.662 1.00 98.24 84 B 1 ATOM 1841 C C . ASP B 2 84 ? -8.588 9.170 7.721 1.00 98.19 84 B 1 ATOM 1842 O O . ASP B 2 84 ? -8.302 7.987 7.505 1.00 97.53 84 B 1 ATOM 1843 C CB . ASP B 2 84 ? -8.307 9.687 5.230 1.00 97.68 84 B 1 ATOM 1844 C CG . ASP B 2 84 ? -9.659 9.102 4.824 1.00 96.87 84 B 1 ATOM 1845 O OD1 . ASP B 2 84 ? -10.705 9.414 5.441 1.00 95.08 84 B 1 ATOM 1846 O OD2 . ASP B 2 84 ? -9.733 8.403 3.788 1.00 94.06 84 B 1 ATOM 1847 N N . PRO B 2 85 ? -9.082 9.568 8.911 1.00 98.15 85 B 1 ATOM 1848 C CA . PRO B 2 85 ? -9.107 8.683 10.063 1.00 98.00 85 B 1 ATOM 1849 C C . PRO B 2 85 ? -10.023 7.468 9.880 1.00 97.68 85 B 1 ATOM 1850 O O . PRO B 2 85 ? -11.109 7.578 9.301 1.00 96.75 85 B 1 ATOM 1851 C CB . PRO B 2 85 ? -9.535 9.548 11.252 1.00 97.81 85 B 1 ATOM 1852 C CG . PRO B 2 85 ? -9.176 10.970 10.823 1.00 97.09 85 B 1 ATOM 1853 C CD . PRO B 2 85 ? -9.432 10.927 9.322 1.00 98.04 85 B 1 ATOM 1854 N N . PRO B 2 86 ? -9.653 6.321 10.456 1.00 97.56 86 B 1 ATOM 1855 C CA . PRO B 2 86 ? -10.488 5.126 10.470 1.00 96.96 86 B 1 ATOM 1856 C C . PRO B 2 86 ? -11.564 5.248 11.564 1.00 96.37 86 B 1 ATOM 1857 O O . PRO B 2 86 ? -11.527 4.565 12.592 1.00 94.82 86 B 1 ATOM 1858 C CB . PRO B 2 86 ? -9.501 3.973 10.681 1.00 96.51 86 B 1 ATOM 1859 C CG . PRO B 2 86 ? -8.458 4.586 11.608 1.00 96.10 86 B 1 ATOM 1860 C CD . PRO B 2 86 ? -8.374 6.030 11.117 1.00 96.95 86 B 1 ATOM 1861 N N . TRP B 2 87 ? -12.519 6.153 11.354 1.00 96.68 87 B 1 ATOM 1862 C CA . TRP B 2 87 ? -13.531 6.533 12.340 1.00 96.32 87 B 1 ATOM 1863 C C . TRP B 2 87 ? -14.318 5.330 12.865 1.00 95.66 87 B 1 ATOM 1864 O O . TRP B 2 87 ? -14.999 4.634 12.104 1.00 93.99 87 B 1 ATOM 1865 C CB . TRP B 2 87 ? -14.487 7.547 11.722 1.00 96.23 87 B 1 ATOM 1866 C CG . TRP B 2 87 ? -13.864 8.853 11.331 1.00 96.55 87 B 1 ATOM 1867 C CD1 . TRP B 2 87 ? -13.682 9.290 10.069 1.00 95.38 87 B 1 ATOM 1868 C CD2 . TRP B 2 87 ? -13.338 9.893 12.209 1.00 96.71 87 B 1 ATOM 1869 N NE1 . TRP B 2 87 ? -13.086 10.548 10.095 1.00 95.64 87 B 1 ATOM 1870 C CE2 . TRP B 2 87 ? -12.862 10.952 11.389 1.00 96.41 87 B 1 ATOM 1871 C CE3 . TRP B 2 87 ? -13.229 10.040 13.610 1.00 96.41 87 B 1 ATOM 1872 C CZ2 . TRP B 2 87 ? -12.294 12.126 11.941 1.00 96.06 87 B 1 ATOM 1873 C CZ3 . TRP B 2 87 ? -12.659 11.207 14.160 1.00 95.67 87 B 1 ATOM 1874 C CH2 . TRP B 2 87 ? -12.199 12.236 13.330 1.00 95.72 87 B 1 ATOM 1875 N N . GLN B 2 88 ? -14.303 5.152 14.175 1.00 94.62 88 B 1 ATOM 1876 C CA . GLN B 2 88 ? -15.129 4.153 14.838 1.00 93.39 88 B 1 ATOM 1877 C C . GLN B 2 88 ? -16.558 4.682 15.000 1.00 92.13 88 B 1 ATOM 1878 O O . GLN B 2 88 ? -16.808 5.671 15.693 1.00 89.15 88 B 1 ATOM 1879 C CB . GLN B 2 88 ? -14.478 3.758 16.167 1.00 91.48 88 B 1 ATOM 1880 C CG . GLN B 2 88 ? -15.182 2.543 16.791 1.00 85.98 88 B 1 ATOM 1881 C CD . GLN B 2 88 ? -14.464 2.039 18.044 1.00 84.98 88 B 1 ATOM 1882 O OE1 . GLN B 2 88 ? -13.527 2.631 18.552 1.00 77.46 88 B 1 ATOM 1883 N NE2 . GLN B 2 88 ? -14.885 0.927 18.590 1.00 74.81 88 B 1 ATOM 1884 N N . LEU B 2 89 ? -17.511 4.002 14.358 1.00 90.98 89 B 1 ATOM 1885 C CA . LEU B 2 89 ? -18.931 4.296 14.528 1.00 87.67 89 B 1 ATOM 1886 C C . LEU B 2 89 ? -19.471 3.531 15.739 1.00 85.43 89 B 1 ATOM 1887 O O . LEU B 2 89 ? -19.244 2.333 15.876 1.00 76.57 89 B 1 ATOM 1888 C CB . LEU B 2 89 ? -19.697 3.970 13.235 1.00 82.96 89 B 1 ATOM 1889 C CG . LEU B 2 89 ? -19.347 4.895 12.053 1.00 77.23 89 B 1 ATOM 1890 C CD1 . LEU B 2 89 ? -20.028 4.394 10.774 1.00 71.82 89 B 1 ATOM 1891 C CD2 . LEU B 2 89 ? -19.816 6.335 12.309 1.00 71.17 89 B 1 ATOM 1892 N N . SER B 2 90 ? -20.218 4.227 16.597 1.00 77.68 90 B 1 ATOM 1893 C CA . SER B 2 90 ? -20.811 3.659 17.818 1.00 74.78 90 B 1 ATOM 1894 C C . SER B 2 90 ? -22.039 2.783 17.578 1.00 73.90 90 B 1 ATOM 1895 O O . SER B 2 90 ? -22.596 2.248 18.529 1.00 65.32 90 B 1 ATOM 1896 C CB . SER B 2 90 ? -21.197 4.807 18.764 1.00 67.93 90 B 1 ATOM 1897 O OG . SER B 2 90 ? -22.065 5.708 18.103 1.00 59.05 90 B 1 ATOM 1898 N N . SER B 2 91 ? -22.528 2.681 16.348 1.00 66.77 91 B 1 ATOM 1899 C CA . SER B 2 91 ? -23.766 1.958 16.055 1.00 63.87 91 B 1 ATOM 1900 C C . SER B 2 91 ? -23.632 0.484 16.444 1.00 63.76 91 B 1 ATOM 1901 O O . SER B 2 91 ? -22.795 -0.230 15.889 1.00 57.58 91 B 1 ATOM 1902 C CB . SER B 2 91 ? -24.160 2.106 14.582 1.00 57.45 91 B 1 ATOM 1903 O OG . SER B 2 91 ? -23.097 1.728 13.737 1.00 52.03 91 B 1 ATOM 1904 N N . SER B 2 92 ? -24.491 0.053 17.363 1.00 56.01 92 B 1 ATOM 1905 C CA . SER B 2 92 ? -24.540 -1.284 17.961 1.00 53.33 92 B 1 ATOM 1906 C C . SER B 2 92 ? -24.747 -2.399 16.943 1.00 54.20 92 B 1 ATOM 1907 O O . SER B 2 92 ? -23.956 -3.332 16.859 1.00 50.16 92 B 1 ATOM 1908 C CB . SER B 2 92 ? -25.695 -1.322 18.971 1.00 46.69 92 B 1 ATOM 1909 O OG . SER B 2 92 ? -26.895 -0.879 18.355 1.00 43.96 92 B 1 ATOM 1910 N N . GLN B 2 93 ? -25.840 -2.332 16.201 1.00 51.74 93 B 1 ATOM 1911 C CA . GLN B 2 93 ? -26.085 -3.319 15.164 1.00 50.86 93 B 1 ATOM 1912 C C . GLN B 2 93 ? -25.215 -2.977 13.955 1.00 52.41 93 B 1 ATOM 1913 O O . GLN B 2 93 ? -25.324 -1.865 13.429 1.00 47.93 93 B 1 ATOM 1914 C CB . GLN B 2 93 ? -27.566 -3.404 14.785 1.00 44.05 93 B 1 ATOM 1915 C CG . GLN B 2 93 ? -28.383 -4.118 15.882 1.00 39.38 93 B 1 ATOM 1916 C CD . GLN B 2 93 ? -29.775 -4.535 15.416 1.00 35.57 93 B 1 ATOM 1917 O OE1 . GLN B 2 93 ? -30.235 -4.211 14.331 1.00 32.22 93 B 1 ATOM 1918 N NE2 . GLN B 2 93 ? -30.497 -5.280 16.221 1.00 32.94 93 B 1 ATOM 1919 N N . PRO B 2 94 ? -24.407 -3.938 13.466 1.00 53.23 94 B 1 ATOM 1920 C CA . PRO B 2 94 ? -23.876 -3.850 12.126 1.00 52.11 94 B 1 ATOM 1921 C C . PRO B 2 94 ? -25.086 -3.835 11.187 1.00 53.58 94 B 1 ATOM 1922 O O . PRO B 2 94 ? -25.639 -4.875 10.833 1.00 50.91 94 B 1 ATOM 1923 C CB . PRO B 2 94 ? -22.959 -5.068 11.968 1.00 47.50 94 B 1 ATOM 1924 C CG . PRO B 2 94 ? -23.546 -6.098 12.930 1.00 46.40 94 B 1 ATOM 1925 C CD . PRO B 2 94 ? -24.165 -5.255 14.041 1.00 49.53 94 B 1 ATOM 1926 N N . SER B 2 95 ? -25.569 -2.631 10.846 1.00 52.37 95 B 1 ATOM 1927 C CA . SER B 2 95 ? -26.502 -2.501 9.743 1.00 51.42 95 B 1 ATOM 1928 C C . SER B 2 95 ? -25.856 -3.144 8.514 1.00 52.32 95 B 1 ATOM 1929 O O . SER B 2 95 ? -24.642 -3.373 8.496 1.00 48.60 95 B 1 ATOM 1930 C CB . SER B 2 95 ? -26.868 -1.023 9.526 1.00 46.56 95 B 1 ATOM 1931 O OG . SER B 2 95 ? -25.739 -0.266 9.175 1.00 43.73 95 B 1 ATOM 1932 N N . ARG B 2 96 ? -26.618 -3.406 7.452 1.00 49.94 96 B 1 ATOM 1933 C CA . ARG B 2 96 ? -26.098 -3.886 6.149 1.00 48.79 96 B 1 ATOM 1934 C C . ARG B 2 96 ? -25.066 -2.931 5.503 1.00 50.90 96 B 1 ATOM 1935 O O . ARG B 2 96 ? -24.845 -2.988 4.295 1.00 47.23 96 B 1 ATOM 1936 C CB . ARG B 2 96 ? -27.270 -4.105 5.170 1.00 42.86 96 B 1 ATOM 1937 C CG . ARG B 2 96 ? -28.251 -5.222 5.544 1.00 39.75 96 B 1 ATOM 1938 C CD . ARG B 2 96 ? -29.296 -5.313 4.426 1.00 37.30 96 B 1 ATOM 1939 N NE . ARG B 2 96 ? -30.295 -6.367 4.674 1.00 32.95 96 B 1 ATOM 1940 C CZ . ARG B 2 96 ? -31.332 -6.645 3.902 1.00 30.18 96 B 1 ATOM 1941 N NH1 . ARG B 2 96 ? -31.577 -5.983 2.806 1.00 27.82 96 B 1 ATOM 1942 N NH2 . ARG B 2 96 ? -32.151 -7.606 4.228 1.00 26.72 96 B 1 ATOM 1943 N N . GLY B 2 97 ? -24.494 -2.026 6.273 1.00 56.19 97 B 1 ATOM 1944 C CA . GLY B 2 97 ? -23.410 -1.167 5.865 1.00 54.64 97 B 1 ATOM 1945 C C . GLY B 2 97 ? -22.254 -2.014 5.351 1.00 56.63 97 B 1 ATOM 1946 O O . GLY B 2 97 ? -22.035 -3.140 5.790 1.00 53.31 97 B 1 ATOM 1947 N N . VAL B 2 98 ? -21.551 -1.449 4.385 1.00 60.70 98 B 1 ATOM 1948 C CA . VAL B 2 98 ? -20.360 -2.075 3.807 1.00 61.12 98 B 1 ATOM 1949 C C . VAL B 2 98 ? -19.423 -2.413 4.962 1.00 63.38 98 B 1 ATOM 1950 O O . VAL B 2 98 ? -19.028 -1.507 5.689 1.00 59.14 98 B 1 ATOM 1951 C CB . VAL B 2 98 ? -19.684 -1.127 2.803 1.00 55.93 98 B 1 ATOM 1952 C CG1 . VAL B 2 98 ? -18.493 -1.792 2.119 1.00 49.83 98 B 1 ATOM 1953 C CG2 . VAL B 2 98 ? -20.671 -0.685 1.705 1.00 50.38 98 B 1 ATOM 1954 N N . ALA B 2 99 ? -19.112 -3.697 5.151 1.00 64.12 99 B 1 ATOM 1955 C CA . ALA B 2 99 ? -18.151 -4.133 6.152 1.00 64.62 99 B 1 ATOM 1956 C C . ALA B 2 99 ? -16.860 -3.343 5.917 1.00 67.34 99 B 1 ATOM 1957 O O . ALA B 2 99 ? -16.280 -3.400 4.829 1.00 64.90 99 B 1 ATOM 1958 C CB . ALA B 2 99 ? -17.949 -5.646 6.044 1.00 59.23 99 B 1 ATOM 1959 N N . ILE B 2 100 ? -16.487 -2.522 6.901 1.00 72.59 100 B 1 ATOM 1960 C CA . ILE B 2 100 ? -15.271 -1.728 6.818 1.00 73.19 100 B 1 ATOM 1961 C C . ILE B 2 100 ? -14.126 -2.728 6.910 1.00 74.63 100 B 1 ATOM 1962 O O . ILE B 2 100 ? -13.990 -3.426 7.908 1.00 71.40 100 B 1 ATOM 1963 C CB . ILE B 2 100 ? -15.242 -0.634 7.902 1.00 69.23 100 B 1 ATOM 1964 C CG1 . ILE B 2 100 ? -16.453 0.325 7.749 1.00 63.46 100 B 1 ATOM 1965 C CG2 . ILE B 2 100 ? -13.932 0.146 7.776 1.00 62.55 100 B 1 ATOM 1966 C CD1 . ILE B 2 100 ? -16.525 1.424 8.816 1.00 57.88 100 B 1 ATOM 1967 N N . ALA B 2 101 ? -13.350 -2.829 5.831 1.00 76.85 101 B 1 ATOM 1968 C CA . ALA B 2 101 ? -12.321 -3.852 5.676 1.00 77.67 101 B 1 ATOM 1969 C C . ALA B 2 101 ? -10.991 -3.492 6.369 1.00 81.66 101 B 1 ATOM 1970 O O . ALA B 2 101 ? -9.948 -4.029 5.998 1.00 77.08 101 B 1 ATOM 1971 C CB . ALA B 2 101 ? -12.164 -4.142 4.175 1.00 70.57 101 B 1 ATOM 1972 N N . TYR B 2 102 ? -11.017 -2.543 7.309 1.00 83.26 102 B 1 ATOM 1973 C CA . TYR B 2 102 ? -9.835 -2.068 8.023 1.00 84.45 102 B 1 ATOM 1974 C C . TYR B 2 102 ? -10.151 -1.803 9.504 1.00 86.04 102 B 1 ATOM 1975 O O . TYR B 2 102 ? -11.309 -1.593 9.880 1.00 83.75 102 B 1 ATOM 1976 C CB . TYR B 2 102 ? -9.270 -0.816 7.328 1.00 82.19 102 B 1 ATOM 1977 C CG . TYR B 2 102 ? -10.230 0.352 7.169 1.00 83.64 102 B 1 ATOM 1978 C CD1 . TYR B 2 102 ? -10.797 0.640 5.909 1.00 76.24 102 B 1 ATOM 1979 C CD2 . TYR B 2 102 ? -10.550 1.175 8.265 1.00 79.97 102 B 1 ATOM 1980 C CE1 . TYR B 2 102 ? -11.669 1.731 5.751 1.00 74.87 102 B 1 ATOM 1981 C CE2 . TYR B 2 102 ? -11.431 2.269 8.121 1.00 76.88 102 B 1 ATOM 1982 C CZ . TYR B 2 102 ? -11.988 2.543 6.861 1.00 79.70 102 B 1 ATOM 1983 O OH . TYR B 2 102 ? -12.847 3.603 6.726 1.00 76.29 102 B 1 ATOM 1984 N N . ASP B 2 103 ? -9.101 -1.791 10.326 1.00 88.76 103 B 1 ATOM 1985 C CA . ASP B 2 103 ? -9.202 -1.478 11.746 1.00 90.04 103 B 1 ATOM 1986 C C . ASP B 2 103 ? -9.695 -0.041 11.959 1.00 92.52 103 B 1 ATOM 1987 O O . ASP B 2 103 ? -9.311 0.884 11.244 1.00 91.11 103 B 1 ATOM 1988 C CB . ASP B 2 103 ? -7.843 -1.651 12.435 1.00 86.68 103 B 1 ATOM 1989 C CG . ASP B 2 103 ? -7.291 -3.071 12.348 1.00 82.92 103 B 1 ATOM 1990 O OD1 . ASP B 2 103 ? -8.093 -4.018 12.535 1.00 75.74 103 B 1 ATOM 1991 O OD2 . ASP B 2 103 ? -6.071 -3.182 12.104 1.00 76.76 103 B 1 ATOM 1992 N N . SER B 2 104 ? -10.526 0.160 12.976 1.00 93.87 104 B 1 ATOM 1993 C CA . SER B 2 104 ? -10.998 1.484 13.379 1.00 94.39 104 B 1 ATOM 1994 C C . SER B 2 104 ? -10.305 1.960 14.653 1.00 95.42 104 B 1 ATOM 1995 O O . SER B 2 104 ? -9.832 1.163 15.466 1.00 94.14 104 B 1 ATOM 1996 C CB . SER B 2 104 ? -12.524 1.490 13.516 1.00 91.70 104 B 1 ATOM 1997 O OG . SER B 2 104 ? -12.951 0.662 14.582 1.00 85.27 104 B 1 ATOM 1998 N N . LEU B 2 105 ? -10.273 3.279 14.848 1.00 96.56 105 B 1 ATOM 1999 C CA . LEU B 2 105 ? -9.777 3.909 16.068 1.00 96.76 105 B 1 ATOM 2000 C C . LEU B 2 105 ? -10.879 4.725 16.749 1.00 96.88 105 B 1 ATOM 2001 O O . LEU B 2 105 ? -11.702 5.367 16.097 1.00 96.15 105 B 1 ATOM 2002 C CB . LEU B 2 105 ? -8.544 4.770 15.757 1.00 96.51 105 B 1 ATOM 2003 C CG . LEU B 2 105 ? -7.289 3.990 15.322 1.00 95.22 105 B 1 ATOM 2004 C CD1 . LEU B 2 105 ? -6.162 4.977 15.039 1.00 93.28 105 B 1 ATOM 2005 C CD2 . LEU B 2 105 ? -6.801 3.020 16.401 1.00 93.46 105 B 1 ATOM 2006 N N . SER B 2 106 ? -10.866 4.723 18.084 1.00 96.52 106 B 1 ATOM 2007 C CA . SER B 2 106 ? -11.708 5.625 18.868 1.00 96.46 106 B 1 ATOM 2008 C C . SER B 2 106 ? -11.267 7.079 18.680 1.00 96.94 106 B 1 ATOM 2009 O O . SER B 2 106 ? -10.103 7.350 18.380 1.00 96.69 106 B 1 ATOM 2010 C CB . SER B 2 106 ? -11.687 5.252 20.357 1.00 95.61 106 B 1 ATOM 2011 O OG . SER B 2 106 ? -10.397 5.415 20.911 1.00 92.67 106 B 1 ATOM 2012 N N . ASP B 2 107 ? -12.188 8.009 18.920 1.00 96.95 107 B 1 ATOM 2013 C CA . ASP B 2 107 ? -11.897 9.445 18.851 1.00 97.07 107 B 1 ATOM 2014 C C . ASP B 2 107 ? -10.742 9.827 19.789 1.00 97.39 107 B 1 ATOM 2015 O O . ASP B 2 107 ? -9.875 10.605 19.417 1.00 96.96 107 B 1 ATOM 2016 C CB . ASP B 2 107 ? -13.158 10.252 19.214 1.00 96.44 107 B 1 ATOM 2017 C CG . ASP B 2 107 ? -14.348 10.022 18.279 1.00 95.71 107 B 1 ATOM 2018 O OD1 . ASP B 2 107 ? -14.207 9.389 17.210 1.00 92.89 107 B 1 ATOM 2019 O OD2 . ASP B 2 107 ? -15.487 10.421 18.616 1.00 92.69 107 B 1 ATOM 2020 N N . GLU B 2 108 ? -10.684 9.220 20.967 1.00 96.73 108 B 1 ATOM 2021 C CA . GLU B 2 108 ? -9.612 9.429 21.941 1.00 96.58 108 B 1 ATOM 2022 C C . GLU B 2 108 ? -8.236 9.030 21.384 1.00 96.99 108 B 1 ATOM 2023 O O . GLU B 2 108 ? -7.282 9.797 21.478 1.00 96.38 108 B 1 ATOM 2024 C CB . GLU B 2 108 ? -9.948 8.610 23.194 1.00 95.82 108 B 1 ATOM 2025 C CG . GLU B 2 108 ? -8.956 8.841 24.335 1.00 84.61 108 B 1 ATOM 2026 C CD . GLU B 2 108 ? -9.191 7.898 25.526 1.00 77.26 108 B 1 ATOM 2027 O OE1 . GLU B 2 108 ? -8.430 8.020 26.503 1.00 67.93 108 B 1 ATOM 2028 O OE2 . GLU B 2 108 ? -10.092 7.026 25.427 1.00 69.60 108 B 1 ATOM 2029 N N . LYS B 2 109 ? -8.116 7.861 20.747 1.00 97.42 109 B 1 ATOM 2030 C CA . LYS B 2 109 ? -6.845 7.409 20.160 1.00 97.28 109 B 1 ATOM 2031 C C . LYS B 2 109 ? -6.376 8.314 19.023 1.00 97.66 109 B 1 ATOM 2032 O O . LYS B 2 109 ? -5.181 8.528 18.880 1.00 97.16 109 B 1 ATOM 2033 C CB . LYS B 2 109 ? -6.971 5.969 19.655 1.00 96.86 109 B 1 ATOM 2034 C CG . LYS B 2 109 ? -6.977 4.945 20.794 1.00 94.49 109 B 1 ATOM 2035 C CD . LYS B 2 109 ? -7.072 3.537 20.197 1.00 89.43 109 B 1 ATOM 2036 C CE . LYS B 2 109 ? -7.002 2.468 21.286 1.00 84.62 109 B 1 ATOM 2037 N NZ . LYS B 2 109 ? -6.974 1.111 20.690 1.00 74.80 109 B 1 ATOM 2038 N N . ILE B 2 110 ? -7.309 8.838 18.223 1.00 97.88 110 B 1 ATOM 2039 C CA . ILE B 2 110 ? -6.998 9.797 17.159 1.00 98.01 110 B 1 ATOM 2040 C C . ILE B 2 110 ? -6.541 11.123 17.780 1.00 98.13 110 B 1 ATOM 2041 O O . ILE B 2 110 ? -5.482 11.625 17.418 1.00 97.85 110 B 1 ATOM 2042 C CB . ILE B 2 110 ? -8.205 9.964 16.208 1.00 97.83 110 B 1 ATOM 2043 C CG1 . ILE B 2 110 ? -8.527 8.625 15.496 1.00 96.93 110 B 1 ATOM 2044 C CG2 . ILE B 2 110 ? -7.933 11.061 15.158 1.00 97.19 110 B 1 ATOM 2045 C CD1 . ILE B 2 110 ? -9.902 8.600 14.818 1.00 94.20 110 B 1 ATOM 2046 N N . GLN B 2 111 ? -7.286 11.647 18.749 1.00 97.83 111 B 1 ATOM 2047 C CA . GLN B 2 111 ? -6.974 12.907 19.439 1.00 97.68 111 B 1 ATOM 2048 C C . GLN B 2 111 ? -5.622 12.872 20.159 1.00 97.94 111 B 1 ATOM 2049 O O . GLN B 2 111 ? -4.924 13.882 20.196 1.00 97.42 111 B 1 ATOM 2050 C CB . GLN B 2 111 ? -8.109 13.207 20.432 1.00 96.59 111 B 1 ATOM 2051 C CG . GLN B 2 111 ? -7.934 14.503 21.245 1.00 91.71 111 B 1 ATOM 2052 C CD . GLN B 2 111 ? -8.037 15.749 20.371 1.00 86.44 111 B 1 ATOM 2053 O OE1 . GLN B 2 111 ? -9.121 16.212 20.055 1.00 77.40 111 B 1 ATOM 2054 N NE2 . GLN B 2 111 ? -6.940 16.323 19.957 1.00 72.91 111 B 1 ATOM 2055 N N . ASN B 2 112 ? -5.235 11.714 20.707 1.00 97.59 112 B 1 ATOM 2056 C CA . ASN B 2 112 ? -4.002 11.533 21.469 1.00 97.48 112 B 1 ATOM 2057 C C . ASN B 2 112 ? -2.731 11.499 20.603 1.00 97.73 112 B 1 ATOM 2058 O O . ASN B 2 112 ? -1.631 11.475 21.155 1.00 96.73 112 B 1 ATOM 2059 C CB . ASN B 2 112 ? -4.130 10.270 22.341 1.00 96.53 112 B 1 ATOM 2060 C CG . ASN B 2 112 ? -5.082 10.441 23.516 1.00 90.74 112 B 1 ATOM 2061 O OD1 . ASN B 2 112 ? -5.518 11.521 23.855 1.00 81.74 112 B 1 ATOM 2062 N ND2 . ASN B 2 112 ? -5.419 9.360 24.185 1.00 79.93 112 B 1 ATOM 2063 N N . MET B 2 113 ? -2.836 11.501 19.267 1.00 97.95 113 B 1 ATOM 2064 C CA . MET B 2 113 ? -1.653 11.677 18.421 1.00 98.03 113 B 1 ATOM 2065 C C . MET B 2 113 ? -1.040 13.067 18.658 1.00 98.22 113 B 1 ATOM 2066 O O . MET B 2 113 ? -1.774 14.056 18.724 1.00 97.77 113 B 1 ATOM 2067 C CB . MET B 2 113 ? -1.989 11.503 16.940 1.00 97.67 113 B 1 ATOM 2068 C CG . MET B 2 113 ? -2.409 10.072 16.587 1.00 96.54 113 B 1 ATOM 2069 S SD . MET B 2 113 ? -2.633 9.797 14.806 1.00 96.07 113 B 1 ATOM 2070 C CE . MET B 2 113 ? -3.993 10.924 14.450 1.00 89.96 113 B 1 ATOM 2071 N N . PRO B 2 114 ? 0.300 13.187 18.745 1.00 98.14 114 B 1 ATOM 2072 C CA . PRO B 2 114 ? 0.964 14.448 19.084 1.00 97.91 114 B 1 ATOM 2073 C C . PRO B 2 114 ? 1.087 15.389 17.875 1.00 98.06 114 B 1 ATOM 2074 O O . PRO B 2 114 ? 2.174 15.876 17.562 1.00 97.18 114 B 1 ATOM 2075 C CB . PRO B 2 114 ? 2.305 14.013 19.683 1.00 97.20 114 B 1 ATOM 2076 C CG . PRO B 2 114 ? 2.640 12.772 18.862 1.00 96.42 114 B 1 ATOM 2077 C CD . PRO B 2 114 ? 1.274 12.110 18.675 1.00 97.62 114 B 1 ATOM 2078 N N . ILE B 2 115 ? -0.025 15.676 17.185 1.00 98.37 115 B 1 ATOM 2079 C CA . ILE B 2 115 ? -0.064 16.469 15.946 1.00 98.42 115 B 1 ATOM 2080 C C . ILE B 2 115 ? 0.542 17.862 16.153 1.00 98.31 115 B 1 ATOM 2081 O O . ILE B 2 115 ? 1.256 18.372 15.289 1.00 97.58 115 B 1 ATOM 2082 C CB . ILE B 2 115 ? -1.508 16.561 15.411 1.00 98.24 115 B 1 ATOM 2083 C CG1 . ILE B 2 115 ? -2.162 15.182 15.169 1.00 96.90 115 B 1 ATOM 2084 C CG2 . ILE B 2 115 ? -1.573 17.408 14.129 1.00 97.36 115 B 1 ATOM 2085 C CD1 . ILE B 2 115 ? -1.390 14.251 14.231 1.00 93.46 115 B 1 ATOM 2086 N N . GLN B 2 116 ? 0.345 18.449 17.327 1.00 97.83 116 B 1 ATOM 2087 C CA . GLN B 2 116 ? 0.910 19.746 17.708 1.00 97.25 116 B 1 ATOM 2088 C C . GLN B 2 116 ? 2.445 19.792 17.653 1.00 97.34 116 B 1 ATOM 2089 O O . GLN B 2 116 ? 3.009 20.874 17.512 1.00 95.70 116 B 1 ATOM 2090 C CB . GLN B 2 116 ? 0.395 20.156 19.099 1.00 95.60 116 B 1 ATOM 2091 C CG . GLN B 2 116 ? 0.872 19.306 20.303 1.00 88.38 116 B 1 ATOM 2092 C CD . GLN B 2 116 ? 0.140 17.969 20.470 1.00 86.62 116 B 1 ATOM 2093 O OE1 . GLN B 2 116 ? -0.728 17.595 19.702 1.00 76.83 116 B 1 ATOM 2094 N NE2 . GLN B 2 116 ? 0.475 17.209 21.488 1.00 73.79 116 B 1 ATOM 2095 N N . SER B 2 117 ? 3.124 18.642 17.732 1.00 97.74 117 B 1 ATOM 2096 C CA . SER B 2 117 ? 4.586 18.538 17.662 1.00 97.40 117 B 1 ATOM 2097 C C . SER B 2 117 ? 5.104 18.294 16.242 1.00 97.57 117 B 1 ATOM 2098 O O . SER B 2 117 ? 6.292 18.474 15.991 1.00 96.24 117 B 1 ATOM 2099 C CB . SER B 2 117 ? 5.079 17.418 18.585 1.00 96.37 117 B 1 ATOM 2100 O OG . SER B 2 117 ? 4.606 17.617 19.907 1.00 89.24 117 B 1 ATOM 2101 N N . LEU B 2 118 ? 4.229 17.906 15.303 1.00 98.19 118 B 1 ATOM 2102 C CA . LEU B 2 118 ? 4.600 17.580 13.919 1.00 98.17 118 B 1 ATOM 2103 C C . LEU B 2 118 ? 4.629 18.804 12.996 1.00 98.10 118 B 1 ATOM 2104 O O . LEU B 2 118 ? 5.193 18.750 11.901 1.00 97.00 118 B 1 ATOM 2105 C CB . LEU B 2 118 ? 3.626 16.521 13.372 1.00 97.95 118 B 1 ATOM 2106 C CG . LEU B 2 118 ? 3.607 15.191 14.146 1.00 97.11 118 B 1 ATOM 2107 C CD1 . LEU B 2 118 ? 2.546 14.266 13.553 1.00 95.19 118 B 1 ATOM 2108 C CD2 . LEU B 2 118 ? 4.949 14.466 14.087 1.00 94.74 118 B 1 ATOM 2109 N N . GLN B 2 119 ? 4.020 19.911 13.419 1.00 98.02 119 B 1 ATOM 2110 C CA . GLN B 2 119 ? 3.903 21.123 12.613 1.00 97.94 119 B 1 ATOM 2111 C C . GLN B 2 119 ? 4.013 22.374 13.482 1.00 97.78 119 B 1 ATOM 2112 O O . GLN B 2 119 ? 3.363 22.479 14.527 1.00 96.65 119 B 1 ATOM 2113 C CB . GLN B 2 119 ? 2.578 21.059 11.840 1.00 97.24 119 B 1 ATOM 2114 C CG . GLN B 2 119 ? 2.403 22.215 10.859 1.00 96.65 119 B 1 ATOM 2115 C CD . GLN B 2 119 ? 1.163 21.992 10.001 1.00 97.49 119 B 1 ATOM 2116 O OE1 . GLN B 2 119 ? 0.045 22.239 10.422 1.00 93.60 119 B 1 ATOM 2117 N NE2 . GLN B 2 119 ? 1.327 21.491 8.797 1.00 93.07 119 B 1 ATOM 2118 N N . GLN B 2 120 ? 4.824 23.338 13.021 1.00 97.40 120 B 1 ATOM 2119 C CA . GLN B 2 120 ? 4.943 24.659 13.634 1.00 96.84 120 B 1 ATOM 2120 C C . GLN B 2 120 ? 4.052 25.675 12.920 1.00 97.12 120 B 1 ATOM 2121 O O . GLN B 2 120 ? 3.208 26.304 13.558 1.00 95.13 120 B 1 ATOM 2122 C CB . GLN B 2 120 ? 6.420 25.079 13.641 1.00 95.11 120 B 1 ATOM 2123 C CG . GLN B 2 120 ? 6.652 26.423 14.356 1.00 84.68 120 B 1 ATOM 2124 C CD . GLN B 2 120 ? 6.241 26.398 15.832 1.00 78.55 120 B 1 ATOM 2125 O OE1 . GLN B 2 120 ? 6.229 25.367 16.495 1.00 70.53 120 B 1 ATOM 2126 N NE2 . GLN B 2 120 ? 5.883 27.530 16.386 1.00 66.20 120 B 1 ATOM 2127 N N . ASP B 2 121 ? 4.204 25.789 11.596 1.00 97.54 121 B 1 ATOM 2128 C CA . ASP B 2 121 ? 3.473 26.704 10.722 1.00 97.39 121 B 1 ATOM 2129 C C . ASP B 2 121 ? 2.942 25.929 9.517 1.00 97.53 121 B 1 ATOM 2130 O O . ASP B 2 121 ? 3.718 25.284 8.803 1.00 95.99 121 B 1 ATOM 2131 C CB . ASP B 2 121 ? 4.392 27.819 10.215 1.00 96.61 121 B 1 ATOM 2132 C CG . ASP B 2 121 ? 5.186 28.493 11.326 1.00 96.02 121 B 1 ATOM 2133 O OD1 . ASP B 2 121 ? 4.573 29.260 12.105 1.00 92.19 121 B 1 ATOM 2134 O OD2 . ASP B 2 121 ? 6.407 28.224 11.391 1.00 92.13 121 B 1 ATOM 2135 N N . GLY B 2 122 ? 1.635 25.998 9.271 1.00 97.79 122 B 1 ATOM 2136 C CA . GLY B 2 122 ? 1.044 25.310 8.132 1.00 97.98 122 B 1 ATOM 2137 C C . GLY B 2 122 ? -0.410 24.931 8.320 1.00 98.34 122 B 1 ATOM 2138 O O . GLY B 2 122 ? -1.125 25.495 9.151 1.00 97.83 122 B 1 ATOM 2139 N N . PHE B 2 123 ? -0.851 23.984 7.520 1.00 98.47 123 B 1 ATOM 2140 C CA . PHE B 2 123 ? -2.240 23.561 7.439 1.00 98.53 123 B 1 ATOM 2141 C C . PHE B 2 123 ? -2.414 22.095 7.824 1.00 98.63 123 B 1 ATOM 2142 O O . PHE B 2 123 ? -1.559 21.247 7.559 1.00 98.39 123 B 1 ATOM 2143 C CB . PHE B 2 123 ? -2.793 23.837 6.039 1.00 98.34 123 B 1 ATOM 2144 C CG . PHE B 2 123 ? -2.799 25.303 5.654 1.00 98.25 123 B 1 ATOM 2145 C CD1 . PHE B 2 123 ? -3.935 26.098 5.900 1.00 97.07 123 B 1 ATOM 2146 C CD2 . PHE B 2 123 ? -1.664 25.881 5.058 1.00 97.04 123 B 1 ATOM 2147 C CE1 . PHE B 2 123 ? -3.944 27.457 5.539 1.00 96.56 123 B 1 ATOM 2148 C CE2 . PHE B 2 123 ? -1.665 27.243 4.700 1.00 96.58 123 B 1 ATOM 2149 C CZ . PHE B 2 123 ? -2.806 28.030 4.936 1.00 96.93 123 B 1 ATOM 2150 N N . ILE B 2 124 ? -3.568 21.795 8.397 1.00 98.60 124 B 1 ATOM 2151 C CA . ILE B 2 124 ? -4.038 20.431 8.612 1.00 98.68 124 B 1 ATOM 2152 C C . ILE B 2 124 ? -5.313 20.194 7.813 1.00 98.72 124 B 1 ATOM 2153 O O . ILE B 2 124 ? -6.208 21.032 7.794 1.00 98.45 124 B 1 ATOM 2154 C CB . ILE B 2 124 ? -4.189 20.120 10.110 1.00 98.43 124 B 1 ATOM 2155 C CG1 . ILE B 2 124 ? -4.395 18.606 10.320 1.00 97.53 124 B 1 ATOM 2156 C CG2 . ILE B 2 124 ? -5.322 20.938 10.769 1.00 97.01 124 B 1 ATOM 2157 C CD1 . ILE B 2 124 ? -4.304 18.179 11.789 1.00 95.16 124 B 1 ATOM 2158 N N . PHE B 2 125 ? -5.398 19.055 7.158 1.00 98.75 125 B 1 ATOM 2159 C CA . PHE B 2 125 ? -6.544 18.590 6.389 1.00 98.77 125 B 1 ATOM 2160 C C . PHE B 2 125 ? -7.073 17.312 7.039 1.00 98.78 125 B 1 ATOM 2161 O O . PHE B 2 125 ? -6.370 16.304 7.090 1.00 98.50 125 B 1 ATOM 2162 C CB . PHE B 2 125 ? -6.111 18.336 4.939 1.00 98.62 125 B 1 ATOM 2163 C CG . PHE B 2 125 ? -5.859 19.576 4.103 1.00 98.57 125 B 1 ATOM 2164 C CD1 . PHE B 2 125 ? -6.700 19.863 3.007 1.00 97.30 125 B 1 ATOM 2165 C CD2 . PHE B 2 125 ? -4.786 20.440 4.384 1.00 97.46 125 B 1 ATOM 2166 C CE1 . PHE B 2 125 ? -6.476 21.003 2.212 1.00 96.85 125 B 1 ATOM 2167 C CE2 . PHE B 2 125 ? -4.566 21.588 3.601 1.00 96.88 125 B 1 ATOM 2168 C CZ . PHE B 2 125 ? -5.412 21.868 2.514 1.00 97.50 125 B 1 ATOM 2169 N N . VAL B 2 126 ? -8.307 17.325 7.520 1.00 98.74 126 B 1 ATOM 2170 C CA . VAL B 2 126 ? -8.917 16.157 8.169 1.00 98.72 126 B 1 ATOM 2171 C C . VAL B 2 126 ? -10.215 15.787 7.474 1.00 98.72 126 B 1 ATOM 2172 O O . VAL B 2 126 ? -11.201 16.524 7.521 1.00 98.41 126 B 1 ATOM 2173 C CB . VAL B 2 126 ? -9.129 16.358 9.679 1.00 98.55 126 B 1 ATOM 2174 C CG1 . VAL B 2 126 ? -9.545 15.035 10.337 1.00 97.72 126 B 1 ATOM 2175 C CG2 . VAL B 2 126 ? -7.860 16.855 10.383 1.00 97.76 126 B 1 ATOM 2176 N N . TRP B 2 127 ? -10.238 14.616 6.846 1.00 98.65 127 B 1 ATOM 2177 C CA . TRP B 2 127 ? -11.460 14.052 6.281 1.00 98.60 127 B 1 ATOM 2178 C C . TRP B 2 127 ? -12.409 13.616 7.400 1.00 98.35 127 B 1 ATOM 2179 O O . TRP B 2 127 ? -12.065 12.786 8.245 1.00 97.68 127 B 1 ATOM 2180 C CB . TRP B 2 127 ? -11.123 12.900 5.341 1.00 98.58 127 B 1 ATOM 2181 C CG . TRP B 2 127 ? -10.457 13.328 4.066 1.00 98.58 127 B 1 ATOM 2182 C CD1 . TRP B 2 127 ? -9.129 13.347 3.838 1.00 98.11 127 B 1 ATOM 2183 C CD2 . TRP B 2 127 ? -11.091 13.840 2.852 1.00 98.42 127 B 1 ATOM 2184 N NE1 . TRP B 2 127 ? -8.885 13.831 2.558 1.00 97.91 127 B 1 ATOM 2185 C CE2 . TRP B 2 127 ? -10.062 14.148 1.921 1.00 98.19 127 B 1 ATOM 2186 C CE3 . TRP B 2 127 ? -12.425 14.072 2.464 1.00 98.20 127 B 1 ATOM 2187 C CZ2 . TRP B 2 127 ? -10.344 14.678 0.642 1.00 97.80 127 B 1 ATOM 2188 C CZ3 . TRP B 2 127 ? -12.710 14.599 1.184 1.00 97.43 127 B 1 ATOM 2189 C CH2 . TRP B 2 127 ? -11.680 14.900 0.286 1.00 97.29 127 B 1 ATOM 2190 N N . ALA B 2 128 ? -13.628 14.142 7.385 1.00 97.69 128 B 1 ATOM 2191 C CA . ALA B 2 128 ? -14.634 13.863 8.396 1.00 97.05 128 B 1 ATOM 2192 C C . ALA B 2 128 ? -15.924 13.326 7.768 1.00 96.24 128 B 1 ATOM 2193 O O . ALA B 2 128 ? -16.536 13.943 6.899 1.00 93.81 128 B 1 ATOM 2194 C CB . ALA B 2 128 ? -14.875 15.130 9.217 1.00 96.15 128 B 1 ATOM 2195 N N . ILE B 2 129 ? -16.386 12.192 8.276 1.00 95.53 129 B 1 ATOM 2196 C CA . ILE B 2 129 ? -17.756 11.746 8.005 1.00 94.20 129 B 1 ATOM 2197 C C . ILE B 2 129 ? -18.752 12.624 8.775 1.00 94.68 129 B 1 ATOM 2198 O O . ILE B 2 129 ? -18.429 13.155 9.838 1.00 93.83 129 B 1 ATOM 2199 C CB . ILE B 2 129 ? -17.940 10.243 8.323 1.00 92.18 129 B 1 ATOM 2200 C CG1 . ILE B 2 129 ? -17.680 9.930 9.813 1.00 86.90 129 B 1 ATOM 2201 C CG2 . ILE B 2 129 ? -17.040 9.405 7.396 1.00 85.39 129 B 1 ATOM 2202 C CD1 . ILE B 2 129 ? -18.005 8.481 10.211 1.00 82.29 129 B 1 ATOM 2203 N N . ASN B 2 130 ? -19.997 12.708 8.299 1.00 92.86 130 B 1 ATOM 2204 C CA . ASN B 2 130 ? -21.033 13.561 8.913 1.00 92.48 130 B 1 ATOM 2205 C C . ASN B 2 130 ? -21.196 13.344 10.432 1.00 93.53 130 B 1 ATOM 2206 O O . ASN B 2 130 ? -21.317 14.305 11.188 1.00 92.84 130 B 1 ATOM 2207 C CB . ASN B 2 130 ? -22.378 13.304 8.203 1.00 90.88 130 B 1 ATOM 2208 C CG . ASN B 2 130 ? -22.458 13.883 6.801 1.00 86.25 130 B 1 ATOM 2209 O OD1 . ASN B 2 130 ? -21.588 14.564 6.322 1.00 78.29 130 B 1 ATOM 2210 N ND2 . ASN B 2 130 ? -23.534 13.628 6.091 1.00 76.93 130 B 1 ATOM 2211 N N . ALA B 2 131 ? -21.162 12.095 10.891 1.00 92.49 131 B 1 ATOM 2212 C CA . ALA B 2 131 ? -21.277 11.759 12.314 1.00 92.55 131 B 1 ATOM 2213 C C . ALA B 2 131 ? -20.089 12.253 13.164 1.00 94.09 131 B 1 ATOM 2214 O O . ALA B 2 131 ? -20.213 12.377 14.382 1.00 93.37 131 B 1 ATOM 2215 C CB . ALA B 2 131 ? -21.442 10.241 12.429 1.00 90.95 131 B 1 ATOM 2216 N N . LYS B 2 132 ? -18.942 12.537 12.538 1.00 95.01 132 B 1 ATOM 2217 C CA . LYS B 2 132 ? -17.702 12.970 13.193 1.00 96.13 132 B 1 ATOM 2218 C C . LYS B 2 132 ? -17.348 14.427 12.906 1.00 97.01 132 B 1 ATOM 2219 O O . LYS B 2 132 ? -16.348 14.906 13.417 1.00 96.58 132 B 1 ATOM 2220 C CB . LYS B 2 132 ? -16.564 12.004 12.822 1.00 95.83 132 B 1 ATOM 2221 C CG . LYS B 2 132 ? -16.786 10.555 13.299 1.00 94.67 132 B 1 ATOM 2222 C CD . LYS B 2 132 ? -16.827 10.443 14.825 1.00 92.56 132 B 1 ATOM 2223 C CE . LYS B 2 132 ? -16.901 8.979 15.259 1.00 90.66 132 B 1 ATOM 2224 N NZ . LYS B 2 132 ? -16.824 8.847 16.725 1.00 87.22 132 B 1 ATOM 2225 N N . TYR B 2 133 ? -18.186 15.162 12.177 1.00 96.12 133 B 1 ATOM 2226 C CA . TYR B 2 133 ? -17.921 16.551 11.790 1.00 96.70 133 B 1 ATOM 2227 C C . TYR B 2 133 ? -17.585 17.447 12.998 1.00 97.22 133 B 1 ATOM 2228 O O . TYR B 2 133 ? -16.523 18.063 13.057 1.00 96.91 133 B 1 ATOM 2229 C CB . TYR B 2 133 ? -19.137 17.067 11.018 1.00 96.47 133 B 1 ATOM 2230 C CG . TYR B 2 133 ? -18.889 18.374 10.307 1.00 96.42 133 B 1 ATOM 2231 C CD1 . TYR B 2 133 ? -18.984 19.596 11.002 1.00 93.87 133 B 1 ATOM 2232 C CD2 . TYR B 2 133 ? -18.553 18.370 8.938 1.00 94.16 133 B 1 ATOM 2233 C CE1 . TYR B 2 133 ? -18.739 20.813 10.343 1.00 93.30 133 B 1 ATOM 2234 C CE2 . TYR B 2 133 ? -18.314 19.579 8.268 1.00 93.18 133 B 1 ATOM 2235 C CZ . TYR B 2 133 ? -18.403 20.799 8.976 1.00 93.90 133 B 1 ATOM 2236 O OH . TYR B 2 133 ? -18.163 21.977 8.330 1.00 92.42 133 B 1 ATOM 2237 N N . ARG B 2 134 ? -18.446 17.459 14.017 1.00 96.62 134 B 1 ATOM 2238 C CA . ARG B 2 134 ? -18.246 18.294 15.214 1.00 96.63 134 B 1 ATOM 2239 C C . ARG B 2 134 ? -17.042 17.867 16.059 1.00 97.27 134 B 1 ATOM 2240 O O . ARG B 2 134 ? -16.380 18.727 16.626 1.00 96.67 134 B 1 ATOM 2241 C CB . ARG B 2 134 ? -19.503 18.289 16.097 1.00 95.90 134 B 1 ATOM 2242 C CG . ARG B 2 134 ? -20.686 19.023 15.454 1.00 87.15 134 B 1 ATOM 2243 C CD . ARG B 2 134 ? -21.850 19.057 16.444 1.00 83.65 134 B 1 ATOM 2244 N NE . ARG B 2 134 ? -23.026 19.746 15.890 1.00 72.41 134 B 1 ATOM 2245 C CZ . ARG B 2 134 ? -24.174 19.954 16.510 1.00 63.80 134 B 1 ATOM 2246 N NH1 . ARG B 2 134 ? -24.379 19.542 17.733 1.00 56.63 134 B 1 ATOM 2247 N NH2 . ARG B 2 134 ? -25.141 20.577 15.905 1.00 56.44 134 B 1 ATOM 2248 N N . VAL B 2 135 ? -16.785 16.566 16.190 1.00 97.16 135 B 1 ATOM 2249 C CA . VAL B 2 135 ? -15.624 16.097 16.960 1.00 97.10 135 B 1 ATOM 2250 C C . VAL B 2 135 ? -14.329 16.415 16.220 1.00 97.77 135 B 1 ATOM 2251 O O . VAL B 2 135 ? -13.361 16.789 16.862 1.00 97.28 135 B 1 ATOM 2252 C CB . VAL B 2 135 ? -15.744 14.616 17.378 1.00 95.28 135 B 1 ATOM 2253 C CG1 . VAL B 2 135 ? -15.586 13.614 16.240 1.00 86.67 135 B 1 ATOM 2254 C CG2 . VAL B 2 135 ? -14.729 14.279 18.465 1.00 86.11 135 B 1 ATOM 2255 N N . THR B 2 136 ? -14.333 16.388 14.893 1.00 97.89 136 B 1 ATOM 2256 C CA . THR B 2 136 ? -13.181 16.767 14.069 1.00 98.05 136 B 1 ATOM 2257 C C . THR B 2 136 ? -12.804 18.231 14.268 1.00 98.25 136 B 1 ATOM 2258 O O . THR B 2 136 ? -11.628 18.523 14.452 1.00 97.99 136 B 1 ATOM 2259 C CB . THR B 2 136 ? -13.448 16.485 12.590 1.00 97.76 136 B 1 ATOM 2260 O OG1 . THR B 2 136 ? -13.752 15.118 12.419 1.00 94.51 136 B 1 ATOM 2261 C CG2 . THR B 2 136 ? -12.233 16.783 11.717 1.00 95.00 136 B 1 ATOM 2262 N N . ILE B 2 137 ? -13.773 19.148 14.312 1.00 98.20 137 B 1 ATOM 2263 C CA . ILE B 2 137 ? -13.512 20.563 14.631 1.00 98.16 137 B 1 ATOM 2264 C C . ILE B 2 137 ? -12.803 20.674 15.983 1.00 98.26 137 B 1 ATOM 2265 O O . ILE B 2 137 ? -11.736 21.274 16.069 1.00 97.81 137 B 1 ATOM 2266 C CB . ILE B 2 137 ? -14.811 21.399 14.600 1.00 97.75 137 B 1 ATOM 2267 C CG1 . ILE B 2 137 ? -15.427 21.395 13.185 1.00 96.22 137 B 1 ATOM 2268 C CG2 . ILE B 2 137 ? -14.534 22.842 15.063 1.00 96.44 137 B 1 ATOM 2269 C CD1 . ILE B 2 137 ? -16.812 22.048 13.093 1.00 92.85 137 B 1 ATOM 2270 N N . LYS B 2 138 ? -13.331 20.022 17.020 1.00 98.30 138 B 1 ATOM 2271 C CA . LYS B 2 138 ? -12.718 20.030 18.355 1.00 98.20 138 B 1 ATOM 2272 C C . LYS B 2 138 ? -11.313 19.423 18.363 1.00 98.31 138 B 1 ATOM 2273 O O . LYS B 2 138 ? -10.442 19.934 19.058 1.00 97.68 138 B 1 ATOM 2274 C CB . LYS B 2 138 ? -13.598 19.281 19.358 1.00 97.73 138 B 1 ATOM 2275 C CG . LYS B 2 138 ? -14.907 20.025 19.648 1.00 84.82 138 B 1 ATOM 2276 C CD . LYS B 2 138 ? -15.697 19.250 20.700 1.00 77.81 138 B 1 ATOM 2277 C CE . LYS B 2 138 ? -16.960 20.018 21.070 1.00 66.33 138 B 1 ATOM 2278 N NZ . LYS B 2 138 ? -17.637 19.401 22.240 1.00 56.86 138 B 1 ATOM 2279 N N . MET B 2 139 ? -11.067 18.355 17.612 1.00 98.18 139 B 1 ATOM 2280 C CA . MET B 2 139 ? -9.732 17.752 17.490 1.00 98.05 139 B 1 ATOM 2281 C C . MET B 2 139 ? -8.735 18.729 16.870 1.00 98.31 139 B 1 ATOM 2282 O O . MET B 2 139 ? -7.646 18.911 17.407 1.00 97.89 139 B 1 ATOM 2283 C CB . MET B 2 139 ? -9.788 16.479 16.641 1.00 97.24 139 B 1 ATOM 2284 C CG . MET B 2 139 ? -10.415 15.296 17.375 1.00 92.63 139 B 1 ATOM 2285 S SD . MET B 2 139 ? -10.540 13.823 16.324 1.00 92.18 139 B 1 ATOM 2286 C CE . MET B 2 139 ? -11.152 12.641 17.536 1.00 83.95 139 B 1 ATOM 2287 N N . ILE B 2 140 ? -9.120 19.384 15.772 1.00 98.35 140 B 1 ATOM 2288 C CA . ILE B 2 140 ? -8.305 20.396 15.088 1.00 98.28 140 B 1 ATOM 2289 C C . ILE B 2 140 ? -7.965 21.552 16.042 1.00 98.32 140 B 1 ATOM 2290 O O . ILE B 2 140 ? -6.804 21.946 16.149 1.00 97.70 140 B 1 ATOM 2291 C CB . ILE B 2 140 ? -9.049 20.863 13.811 1.00 97.52 140 B 1 ATOM 2292 C CG1 . ILE B 2 140 ? -8.990 19.750 12.734 1.00 93.62 140 B 1 ATOM 2293 C CG2 . ILE B 2 140 ? -8.474 22.175 13.252 1.00 93.52 140 B 1 ATOM 2294 C CD1 . ILE B 2 140 ? -9.882 20.024 11.510 1.00 91.83 140 B 1 ATOM 2295 N N . GLU B 2 141 ? -8.955 22.064 16.771 1.00 98.37 141 B 1 ATOM 2296 C CA . GLU B 2 141 ? -8.766 23.131 17.762 1.00 98.28 141 B 1 ATOM 2297 C C . GLU B 2 141 ? -7.862 22.684 18.926 1.00 98.23 141 B 1 ATOM 2298 O O . GLU B 2 141 ? -6.931 23.399 19.296 1.00 97.55 141 B 1 ATOM 2299 C CB . GLU B 2 141 ? -10.137 23.587 18.287 1.00 98.02 141 B 1 ATOM 2300 C CG . GLU B 2 141 ? -10.956 24.350 17.235 1.00 96.25 141 B 1 ATOM 2301 C CD . GLU B 2 141 ? -12.405 24.646 17.663 1.00 95.07 141 B 1 ATOM 2302 O OE1 . GLU B 2 141 ? -13.026 25.530 17.031 1.00 88.80 141 B 1 ATOM 2303 O OE2 . GLU B 2 141 ? -12.921 23.982 18.597 1.00 91.04 141 B 1 ATOM 2304 N N . ASN B 2 142 ? -8.054 21.477 19.447 1.00 98.21 142 B 1 ATOM 2305 C CA . ASN B 2 142 ? -7.236 20.915 20.525 1.00 98.01 142 B 1 ATOM 2306 C C . ASN B 2 142 ? -5.770 20.702 20.114 1.00 98.03 142 B 1 ATOM 2307 O O . ASN B 2 142 ? -4.877 20.808 20.954 1.00 96.96 142 B 1 ATOM 2308 C CB . ASN B 2 142 ? -7.836 19.579 20.977 1.00 97.58 142 B 1 ATOM 2309 C CG . ASN B 2 142 ? -9.102 19.705 21.801 1.00 94.86 142 B 1 ATOM 2310 O OD1 . ASN B 2 142 ? -9.474 20.737 22.319 1.00 86.26 142 B 1 ATOM 2311 N ND2 . ASN B 2 142 ? -9.791 18.599 21.989 1.00 85.73 142 B 1 ATOM 2312 N N . TRP B 2 143 ? -5.489 20.432 18.836 1.00 98.19 143 B 1 ATOM 2313 C CA . TRP B 2 143 ? -4.123 20.384 18.302 1.00 98.19 143 B 1 ATOM 2314 C C . TRP B 2 143 ? -3.505 21.775 18.058 1.00 98.13 143 B 1 ATOM 2315 O O . TRP B 2 143 ? -2.340 21.868 17.668 1.00 97.33 143 B 1 ATOM 2316 C CB . TRP B 2 143 ? -4.098 19.508 17.046 1.00 98.13 143 B 1 ATOM 2317 C CG . TRP B 2 143 ? -4.335 18.044 17.265 1.00 98.17 143 B 1 ATOM 2318 C CD1 . TRP B 2 143 ? -3.870 17.302 18.301 1.00 97.55 143 B 1 ATOM 2319 C CD2 . TRP B 2 143 ? -5.062 17.115 16.402 1.00 98.06 143 B 1 ATOM 2320 N NE1 . TRP B 2 143 ? -4.261 15.973 18.135 1.00 97.42 143 B 1 ATOM 2321 C CE2 . TRP B 2 143 ? -4.984 15.818 16.980 1.00 97.84 143 B 1 ATOM 2322 C CE3 . TRP B 2 143 ? -5.754 17.254 15.180 1.00 97.87 143 B 1 ATOM 2323 C CZ2 . TRP B 2 143 ? -5.581 14.692 16.372 1.00 97.31 143 B 1 ATOM 2324 C CZ3 . TRP B 2 143 ? -6.351 16.126 14.578 1.00 97.08 143 B 1 ATOM 2325 C CH2 . TRP B 2 143 ? -6.263 14.863 15.170 1.00 96.86 143 B 1 ATOM 2326 N N . GLY B 2 144 ? -4.248 22.848 18.315 1.00 97.93 144 B 1 ATOM 2327 C CA . GLY B 2 144 ? -3.766 24.231 18.227 1.00 97.63 144 B 1 ATOM 2328 C C . GLY B 2 144 ? -4.007 24.902 16.879 1.00 97.96 144 B 1 ATOM 2329 O O . GLY B 2 144 ? -3.362 25.909 16.583 1.00 96.73 144 B 1 ATOM 2330 N N . TYR B 2 145 ? -4.909 24.376 16.062 1.00 98.25 145 B 1 ATOM 2331 C CA . TYR B 2 145 ? -5.292 24.966 14.784 1.00 98.43 145 B 1 ATOM 2332 C C . TYR B 2 145 ? -6.552 25.817 14.923 1.00 98.43 145 B 1 ATOM 2333 O O . TYR B 2 145 ? -7.455 25.513 15.697 1.00 97.78 145 B 1 ATOM 2334 C CB . TYR B 2 145 ? -5.507 23.888 13.720 1.00 98.37 145 B 1 ATOM 2335 C CG . TYR B 2 145 ? -4.277 23.058 13.419 1.00 98.55 145 B 1 ATOM 2336 C CD1 . TYR B 2 145 ? -3.440 23.389 12.339 1.00 97.85 145 B 1 ATOM 2337 C CD2 . TYR B 2 145 ? -3.957 21.957 14.231 1.00 97.93 145 B 1 ATOM 2338 C CE1 . TYR B 2 145 ? -2.286 22.635 12.077 1.00 97.74 145 B 1 ATOM 2339 C CE2 . TYR B 2 145 ? -2.799 21.199 13.984 1.00 97.81 145 B 1 ATOM 2340 C CZ . TYR B 2 145 ? -1.964 21.541 12.908 1.00 98.14 145 B 1 ATOM 2341 O OH . TYR B 2 145 ? -0.832 20.811 12.683 1.00 97.54 145 B 1 ATOM 2342 N N . LYS B 2 146 ? -6.646 26.849 14.080 1.00 98.28 146 B 1 ATOM 2343 C CA . LYS B 2 146 ? -7.894 27.562 13.812 1.00 98.21 146 B 1 ATOM 2344 C C . LYS B 2 146 ? -8.545 26.946 12.578 1.00 98.29 146 B 1 ATOM 2345 O O . LYS B 2 146 ? -7.903 26.866 11.537 1.00 97.49 146 B 1 ATOM 2346 C CB . LYS B 2 146 ? -7.582 29.051 13.635 1.00 97.67 146 B 1 ATOM 2347 C CG . LYS B 2 146 ? -8.845 29.877 13.373 1.00 89.38 146 B 1 ATOM 2348 C CD . LYS B 2 146 ? -8.476 31.345 13.128 1.00 85.21 146 B 1 ATOM 2349 C CE . LYS B 2 146 ? -9.731 32.134 12.773 1.00 71.28 146 B 1 ATOM 2350 N NZ . LYS B 2 146 ? -9.404 33.535 12.399 1.00 62.66 146 B 1 ATOM 2351 N N . LEU B 2 147 ? -9.815 26.549 12.668 1.00 98.28 147 B 1 ATOM 2352 C CA . LEU B 2 147 ? -10.588 26.139 11.497 1.00 98.06 147 B 1 ATOM 2353 C C . LEU B 2 147 ? -10.768 27.344 10.563 1.00 97.95 147 B 1 ATOM 2354 O O . LEU B 2 147 ? -11.210 28.403 11.011 1.00 96.63 147 B 1 ATOM 2355 C CB . LEU B 2 147 ? -11.936 25.562 11.951 1.00 97.32 147 B 1 ATOM 2356 C CG . LEU B 2 147 ? -12.763 24.943 10.797 1.00 93.00 147 B 1 ATOM 2357 C CD1 . LEU B 2 147 ? -12.188 23.592 10.365 1.00 86.71 147 B 1 ATOM 2358 C CD2 . LEU B 2 147 ? -14.200 24.713 11.260 1.00 86.82 147 B 1 ATOM 2359 N N . VAL B 2 148 ? -10.409 27.194 9.285 1.00 97.95 148 B 1 ATOM 2360 C CA . VAL B 2 148 ? -10.426 28.288 8.299 1.00 97.37 148 B 1 ATOM 2361 C C . VAL B 2 148 ? -11.180 27.960 7.026 1.00 97.29 148 B 1 ATOM 2362 O O . VAL B 2 148 ? -11.675 28.885 6.391 1.00 94.85 148 B 1 ATOM 2363 C CB . VAL B 2 148 ? -9.012 28.772 7.933 1.00 95.97 148 B 1 ATOM 2364 C CG1 . VAL B 2 148 ? -8.391 29.522 9.120 1.00 91.87 148 B 1 ATOM 2365 C CG2 . VAL B 2 148 ? -8.067 27.651 7.479 1.00 92.66 148 B 1 ATOM 2366 N N . ASP B 2 149 ? -11.273 26.700 6.649 1.00 97.41 149 B 1 ATOM 2367 C CA . ASP B 2 149 ? -11.904 26.300 5.389 1.00 97.65 149 B 1 ATOM 2368 C C . ASP B 2 149 ? -12.400 24.847 5.423 1.00 98.04 149 B 1 ATOM 2369 O O . ASP B 2 149 ? -12.150 24.096 6.372 1.00 97.20 149 B 1 ATOM 2370 C CB . ASP B 2 149 ? -10.912 26.539 4.226 1.00 96.62 149 B 1 ATOM 2371 C CG . ASP B 2 149 ? -11.596 27.099 2.978 1.00 94.42 149 B 1 ATOM 2372 O OD1 . ASP B 2 149 ? -12.793 26.775 2.785 1.00 88.64 149 B 1 ATOM 2373 O OD2 . ASP B 2 149 ? -10.931 27.866 2.251 1.00 88.68 149 B 1 ATOM 2374 N N . GLU B 2 150 ? -13.126 24.452 4.373 1.00 97.76 150 B 1 ATOM 2375 C CA . GLU B 2 150 ? -13.599 23.090 4.158 1.00 97.87 150 B 1 ATOM 2376 C C . GLU B 2 150 ? -13.617 22.778 2.660 1.00 98.18 150 B 1 ATOM 2377 O O . GLU B 2 150 ? -14.318 23.431 1.892 1.00 97.13 150 B 1 ATOM 2378 C CB . GLU B 2 150 ? -15.007 22.914 4.770 1.00 96.07 150 B 1 ATOM 2379 C CG . GLU B 2 150 ? -15.631 21.538 4.446 1.00 93.82 150 B 1 ATOM 2380 C CD . GLU B 2 150 ? -17.034 21.301 5.042 1.00 94.18 150 B 1 ATOM 2381 O OE1 . GLU B 2 150 ? -17.737 20.373 4.566 1.00 86.03 150 B 1 ATOM 2382 O OE2 . GLU B 2 150 ? -17.447 21.965 6.014 1.00 88.69 150 B 1 ATOM 2383 N N . ILE B 2 151 ? -12.938 21.721 2.246 1.00 98.21 151 B 1 ATOM 2384 C CA . ILE B 2 151 ? -13.107 21.166 0.903 1.00 98.19 151 B 1 ATOM 2385 C C . ILE B 2 151 ? -14.252 20.160 0.923 1.00 98.25 151 B 1 ATOM 2386 O O . ILE B 2 151 ? -14.244 19.176 1.671 1.00 97.74 151 B 1 ATOM 2387 C CB . ILE B 2 151 ? -11.797 20.576 0.349 1.00 97.70 151 B 1 ATOM 2388 C CG1 . ILE B 2 151 ? -10.793 21.714 0.068 1.00 95.14 151 B 1 ATOM 2389 C CG2 . ILE B 2 151 ? -12.052 19.768 -0.939 1.00 95.76 151 B 1 ATOM 2390 C CD1 . ILE B 2 151 ? -9.367 21.226 -0.199 1.00 90.12 151 B 1 ATOM 2391 N N . THR B 2 152 ? -15.233 20.361 0.037 1.00 98.06 152 B 1 ATOM 2392 C CA . THR B 2 152 ? -16.315 19.410 -0.195 1.00 97.94 152 B 1 ATOM 2393 C C . THR B 2 152 ? -16.028 18.571 -1.435 1.00 98.11 152 B 1 ATOM 2394 O O . THR B 2 152 ? -16.045 19.064 -2.561 1.00 97.44 152 B 1 ATOM 2395 C CB . THR B 2 152 ? -17.664 20.129 -0.288 1.00 97.10 152 B 1 ATOM 2396 O OG1 . THR B 2 152 ? -17.992 20.686 0.970 1.00 92.76 152 B 1 ATOM 2397 C CG2 . THR B 2 152 ? -18.804 19.178 -0.635 1.00 92.83 152 B 1 ATOM 2398 N N . TRP B 2 153 ? -15.829 17.262 -1.251 1.00 97.98 153 B 1 ATOM 2399 C CA . TRP B 2 153 ? -15.805 16.329 -2.373 1.00 97.91 153 B 1 ATOM 2400 C C . TRP B 2 153 ? -17.228 15.916 -2.741 1.00 97.68 153 B 1 ATOM 2401 O O . TRP B 2 153 ? -17.843 15.076 -2.078 1.00 96.87 153 B 1 ATOM 2402 C CB . TRP B 2 153 ? -14.920 15.124 -2.063 1.00 97.66 153 B 1 ATOM 2403 C CG . TRP B 2 153 ? -14.931 14.058 -3.125 1.00 97.66 153 B 1 ATOM 2404 C CD1 . TRP B 2 153 ? -15.103 14.250 -4.458 1.00 96.73 153 B 1 ATOM 2405 C CD2 . TRP B 2 153 ? -14.780 12.617 -2.946 1.00 97.30 153 B 1 ATOM 2406 N NE1 . TRP B 2 153 ? -15.069 13.021 -5.114 1.00 96.42 153 B 1 ATOM 2407 C CE2 . TRP B 2 153 ? -14.858 11.996 -4.225 1.00 96.75 153 B 1 ATOM 2408 C CE3 . TRP B 2 153 ? -14.564 11.783 -1.826 1.00 96.51 153 B 1 ATOM 2409 C CZ2 . TRP B 2 153 ? -14.730 10.599 -4.395 1.00 95.89 153 B 1 ATOM 2410 C CZ3 . TRP B 2 153 ? -14.436 10.392 -1.993 1.00 95.45 153 B 1 ATOM 2411 C CH2 . TRP B 2 153 ? -14.516 9.812 -3.267 1.00 95.10 153 B 1 ATOM 2412 N N . VAL B 2 154 ? -17.738 16.459 -3.839 1.00 97.35 154 B 1 ATOM 2413 C CA . VAL B 2 154 ? -19.010 16.066 -4.452 1.00 97.03 154 B 1 ATOM 2414 C C . VAL B 2 154 ? -18.766 14.873 -5.373 1.00 97.05 154 B 1 ATOM 2415 O O . VAL B 2 154 ? -18.015 14.942 -6.345 1.00 96.37 154 B 1 ATOM 2416 C CB . VAL B 2 154 ? -19.665 17.239 -5.198 1.00 96.38 154 B 1 ATOM 2417 C CG1 . VAL B 2 154 ? -21.013 16.822 -5.798 1.00 93.72 154 B 1 ATOM 2418 C CG2 . VAL B 2 154 ? -19.924 18.421 -4.253 1.00 94.34 154 B 1 ATOM 2419 N N . LYS B 2 155 ? -19.424 13.760 -5.082 1.00 96.40 155 B 1 ATOM 2420 C CA . LYS B 2 155 ? -19.251 12.511 -5.824 1.00 95.75 155 B 1 ATOM 2421 C C . LYS B 2 155 ? -20.034 12.548 -7.131 1.00 95.57 155 B 1 ATOM 2422 O O . LYS B 2 155 ? -21.254 12.721 -7.137 1.00 94.32 155 B 1 ATOM 2423 C CB . LYS B 2 155 ? -19.645 11.316 -4.948 1.00 94.60 155 B 1 ATOM 2424 C CG . LYS B 2 155 ? -18.739 11.216 -3.714 1.00 92.15 155 B 1 ATOM 2425 C CD . LYS B 2 155 ? -19.192 10.096 -2.772 1.00 87.43 155 B 1 ATOM 2426 C CE . LYS B 2 155 ? -18.288 10.146 -1.543 1.00 83.15 155 B 1 ATOM 2427 N NZ . LYS B 2 155 ? -18.708 9.217 -0.475 1.00 76.55 155 B 1 ATOM 2428 N N . LYS B 2 156 ? -19.320 12.335 -8.212 1.00 96.15 156 B 1 ATOM 2429 C CA . LYS B 2 156 ? -19.834 12.314 -9.580 1.00 96.05 156 B 1 ATOM 2430 C C . LYS B 2 156 ? -20.178 10.884 -10.001 1.00 96.02 156 B 1 ATOM 2431 O O . LYS B 2 156 ? -19.501 9.927 -9.637 1.00 94.64 156 B 1 ATOM 2432 C CB . LYS B 2 156 ? -18.765 12.962 -10.472 1.00 94.39 156 B 1 ATOM 2433 C CG . LYS B 2 156 ? -19.209 13.232 -11.917 1.00 90.67 156 B 1 ATOM 2434 C CD . LYS B 2 156 ? -18.037 13.872 -12.671 1.00 90.01 156 B 1 ATOM 2435 C CE . LYS B 2 156 ? -18.362 14.127 -14.136 1.00 82.99 156 B 1 ATOM 2436 N NZ . LYS B 2 156 ? -17.184 14.686 -14.845 1.00 78.11 156 B 1 ATOM 2437 N N . THR B 2 157 ? -21.252 10.726 -10.783 1.00 94.94 157 B 1 ATOM 2438 C CA . THR B 2 157 ? -21.543 9.476 -11.496 1.00 94.22 157 B 1 ATOM 2439 C C . THR B 2 157 ? -20.790 9.435 -12.827 1.00 94.58 157 B 1 ATOM 2440 O O . THR B 2 157 ? -20.431 10.481 -13.364 1.00 93.22 157 B 1 ATOM 2441 C CB . THR B 2 157 ? -23.045 9.301 -11.765 1.00 92.60 157 B 1 ATOM 2442 O OG1 . THR B 2 157 ? -23.530 10.296 -12.630 1.00 86.41 157 B 1 ATOM 2443 C CG2 . THR B 2 157 ? -23.884 9.345 -10.489 1.00 85.73 157 B 1 ATOM 2444 N N . VAL B 2 158 ? -20.678 8.244 -13.433 1.00 93.75 158 B 1 ATOM 2445 C CA . VAL B 2 158 ? -20.116 8.070 -14.791 1.00 92.87 158 B 1 ATOM 2446 C C . VAL B 2 158 ? -20.796 8.962 -15.847 1.00 93.52 158 B 1 ATOM 2447 O O . VAL B 2 158 ? -20.166 9.435 -16.776 1.00 91.03 158 B 1 ATOM 2448 C CB . VAL B 2 158 ? -20.187 6.596 -15.234 1.00 91.35 158 B 1 ATOM 2449 C CG1 . VAL B 2 158 ? -19.311 5.714 -14.327 1.00 80.47 158 B 1 ATOM 2450 C CG2 . VAL B 2 158 ? -21.617 6.028 -15.224 1.00 80.88 158 B 1 ATOM 2451 N N . ASN B 2 159 ? -22.078 9.287 -15.651 1.00 93.92 159 B 1 ATOM 2452 C CA . ASN B 2 159 ? -22.850 10.176 -16.534 1.00 93.59 159 B 1 ATOM 2453 C C . ASN B 2 159 ? -22.719 11.670 -16.168 1.00 94.15 159 B 1 ATOM 2454 O O . ASN B 2 159 ? -23.551 12.485 -16.573 1.00 90.87 159 B 1 ATOM 2455 C CB . ASN B 2 159 ? -24.317 9.707 -16.550 1.00 92.29 159 B 1 ATOM 2456 C CG . ASN B 2 159 ? -24.495 8.308 -17.116 1.00 88.49 159 B 1 ATOM 2457 O OD1 . ASN B 2 159 ? -23.675 7.775 -17.821 1.00 78.25 159 B 1 ATOM 2458 N ND2 . ASN B 2 159 ? -25.602 7.660 -16.826 1.00 77.92 159 B 1 ATOM 2459 N N . GLY B 2 160 ? -21.746 12.040 -15.342 1.00 93.03 160 B 1 ATOM 2460 C CA . GLY B 2 160 ? -21.490 13.435 -14.960 1.00 92.42 160 B 1 ATOM 2461 C C . GLY B 2 160 ? -22.491 14.045 -13.976 1.00 93.86 160 B 1 ATOM 2462 O O . GLY B 2 160 ? -22.442 15.254 -13.743 1.00 90.56 160 B 1 ATOM 2463 N N . LYS B 2 161 ? -23.391 13.248 -13.395 1.00 93.54 161 B 1 ATOM 2464 C CA . LYS B 2 161 ? -24.402 13.708 -12.430 1.00 93.60 161 B 1 ATOM 2465 C C . LYS B 2 161 ? -23.919 13.530 -10.990 1.00 94.65 161 B 1 ATOM 2466 O O . LYS B 2 161 ? -23.053 12.704 -10.715 1.00 92.81 161 B 1 ATOM 2467 C CB . LYS B 2 161 ? -25.742 12.993 -12.667 1.00 92.11 161 B 1 ATOM 2468 C CG . LYS B 2 161 ? -26.314 13.292 -14.064 1.00 88.85 161 B 1 ATOM 2469 C CD . LYS B 2 161 ? -27.708 12.674 -14.244 1.00 81.22 161 B 1 ATOM 2470 C CE . LYS B 2 161 ? -28.219 13.007 -15.646 1.00 73.79 161 B 1 ATOM 2471 N NZ . LYS B 2 161 ? -29.595 12.500 -15.897 1.00 62.84 161 B 1 ATOM 2472 N N . ILE B 2 162 ? -24.537 14.261 -10.065 1.00 93.76 162 B 1 ATOM 2473 C CA . ILE B 2 162 ? -24.314 14.079 -8.629 1.00 93.35 162 B 1 ATOM 2474 C C . ILE B 2 162 ? -24.772 12.671 -8.224 1.00 92.83 162 B 1 ATOM 2475 O O . ILE B 2 162 ? -25.901 12.258 -8.513 1.00 89.72 162 B 1 ATOM 2476 C CB . ILE B 2 162 ? -25.011 15.187 -7.812 1.00 92.16 162 B 1 ATOM 2477 C CG1 . ILE B 2 162 ? -24.452 16.579 -8.202 1.00 88.54 162 B 1 ATOM 2478 C CG2 . ILE B 2 162 ? -24.824 14.939 -6.304 1.00 88.87 162 B 1 ATOM 2479 C CD1 . ILE B 2 162 ? -25.166 17.755 -7.526 1.00 86.49 162 B 1 ATOM 2480 N N . ALA B 2 163 ? -23.890 11.932 -7.552 1.00 93.10 163 B 1 ATOM 2481 C CA . ALA B 2 163 ? -24.187 10.595 -7.063 1.00 90.63 163 B 1 ATOM 2482 C C . ALA B 2 163 ? -25.289 10.627 -5.993 1.00 90.60 163 B 1 ATOM 2483 O O . ALA B 2 163 ? -25.482 11.609 -5.284 1.00 86.58 163 B 1 ATOM 2484 C CB . ALA B 2 163 ? -22.898 9.948 -6.545 1.00 87.56 163 B 1 ATOM 2485 N N . LYS B 2 164 ? -26.013 9.511 -5.855 1.00 89.97 164 B 1 ATOM 2486 C CA . LYS B 2 164 ? -27.033 9.334 -4.821 1.00 87.30 164 B 1 ATOM 2487 C C . LYS B 2 164 ? -26.592 8.217 -3.885 1.00 86.31 164 B 1 ATOM 2488 O O . LYS B 2 164 ? -26.512 7.058 -4.297 1.00 78.28 164 B 1 ATOM 2489 C CB . LYS B 2 164 ? -28.403 9.056 -5.459 1.00 82.66 164 B 1 ATOM 2490 C CG . LYS B 2 164 ? -28.918 10.248 -6.283 1.00 76.49 164 B 1 ATOM 2491 C CD . LYS B 2 164 ? -30.325 9.961 -6.815 1.00 70.76 164 B 1 ATOM 2492 C CE . LYS B 2 164 ? -30.855 11.162 -7.594 1.00 63.79 164 B 1 ATOM 2493 N NZ . LYS B 2 164 ? -32.267 10.965 -8.010 1.00 54.51 164 B 1 ATOM 2494 N N . GLY B 2 165 ? -26.279 8.578 -2.633 1.00 87.75 165 B 1 ATOM 2495 C CA . GLY B 2 165 ? -25.960 7.636 -1.570 1.00 85.59 165 B 1 ATOM 2496 C C . GLY B 2 165 ? -27.073 7.539 -0.532 1.00 86.79 165 B 1 ATOM 2497 O O . GLY B 2 165 ? -28.004 8.344 -0.518 1.00 82.62 165 B 1 ATOM 2498 N N . HIS B 2 166 ? -26.975 6.552 0.343 1.00 86.77 166 B 1 ATOM 2499 C CA . HIS B 2 166 ? -27.904 6.407 1.457 1.00 86.07 166 B 1 ATOM 2500 C C . HIS B 2 166 ? -27.712 7.524 2.488 1.00 87.24 166 B 1 ATOM 2501 O O . HIS B 2 166 ? -26.591 7.884 2.835 1.00 82.54 166 B 1 ATOM 2502 C CB . HIS B 2 166 ? -27.766 5.020 2.087 1.00 81.88 166 B 1 ATOM 2503 C CG . HIS B 2 166 ? -28.291 3.932 1.187 1.00 74.77 166 B 1 ATOM 2504 N ND1 . HIS B 2 166 ? -29.615 3.696 0.888 1.00 64.07 166 B 1 ATOM 2505 C CD2 . HIS B 2 166 ? -27.561 3.000 0.483 1.00 63.94 166 B 1 ATOM 2506 C CE1 . HIS B 2 166 ? -29.678 2.657 0.037 1.00 59.72 166 B 1 ATOM 2507 N NE2 . HIS B 2 166 ? -28.453 2.211 -0.232 1.00 61.60 166 B 1 ATOM 2508 N N . GLY B 2 167 ? -28.827 8.039 2.990 1.00 86.39 167 B 1 ATOM 2509 C CA . GLY B 2 167 ? -28.885 8.990 4.090 1.00 85.54 167 B 1 ATOM 2510 C C . GLY B 2 167 ? -30.222 8.859 4.806 1.00 86.76 167 B 1 ATOM 2511 O O . GLY B 2 167 ? -31.159 8.267 4.263 1.00 83.19 167 B 1 ATOM 2512 N N . PHE B 2 168 ? -30.309 9.384 6.031 1.00 86.32 168 B 1 ATOM 2513 C CA . PHE B 2 168 ? -31.529 9.263 6.835 1.00 86.39 168 B 1 ATOM 2514 C C . PHE B 2 168 ? -32.585 10.303 6.435 1.00 88.17 168 B 1 ATOM 2515 O O . PHE B 2 168 ? -33.700 9.939 6.072 1.00 85.06 168 B 1 ATOM 2516 C CB . PHE B 2 168 ? -31.165 9.336 8.325 1.00 82.99 168 B 1 ATOM 2517 C CG . PHE B 2 168 ? -32.323 8.973 9.225 1.00 77.70 168 B 1 ATOM 2518 C CD1 . PHE B 2 168 ? -33.085 9.979 9.844 1.00 72.41 168 B 1 ATOM 2519 C CD2 . PHE B 2 168 ? -32.656 7.624 9.434 1.00 71.92 168 B 1 ATOM 2520 C CE1 . PHE B 2 168 ? -34.171 9.643 10.669 1.00 67.54 168 B 1 ATOM 2521 C CE2 . PHE B 2 168 ? -33.742 7.283 10.260 1.00 68.20 168 B 1 ATOM 2522 C CZ . PHE B 2 168 ? -34.501 8.292 10.877 1.00 66.80 168 B 1 ATOM 2523 N N . TYR B 2 169 ? -32.211 11.595 6.425 1.00 88.56 169 B 1 ATOM 2524 C CA . TYR B 2 169 ? -33.093 12.685 5.994 1.00 90.09 169 B 1 ATOM 2525 C C . TYR B 2 169 ? -32.885 13.040 4.518 1.00 91.35 169 B 1 ATOM 2526 O O . TYR B 2 169 ? -33.824 13.029 3.726 1.00 88.88 169 B 1 ATOM 2527 C CB . TYR B 2 169 ? -32.865 13.912 6.885 1.00 89.49 169 B 1 ATOM 2528 C CG . TYR B 2 169 ? -33.161 13.671 8.353 1.00 89.86 169 B 1 ATOM 2529 C CD1 . TYR B 2 169 ? -34.495 13.592 8.796 1.00 85.69 169 B 1 ATOM 2530 C CD2 . TYR B 2 169 ? -32.113 13.533 9.282 1.00 86.83 169 B 1 ATOM 2531 C CE1 . TYR B 2 169 ? -34.786 13.379 10.151 1.00 85.43 169 B 1 ATOM 2532 C CE2 . TYR B 2 169 ? -32.396 13.317 10.644 1.00 85.80 169 B 1 ATOM 2533 C CZ . TYR B 2 169 ? -33.736 13.243 11.073 1.00 86.27 169 B 1 ATOM 2534 O OH . TYR B 2 169 ? -34.014 13.038 12.400 1.00 83.46 169 B 1 ATOM 2535 N N . LEU B 2 170 ? -31.628 13.335 4.143 1.00 92.51 170 B 1 ATOM 2536 C CA . LEU B 2 170 ? -31.224 13.649 2.777 1.00 92.53 170 B 1 ATOM 2537 C C . LEU B 2 170 ? -30.323 12.542 2.226 1.00 91.91 170 B 1 ATOM 2538 O O . LEU B 2 170 ? -29.617 11.857 2.970 1.00 90.23 170 B 1 ATOM 2539 C CB . LEU B 2 170 ? -30.527 15.018 2.729 1.00 92.49 170 B 1 ATOM 2540 C CG . LEU B 2 170 ? -31.384 16.213 3.196 1.00 92.07 170 B 1 ATOM 2541 C CD1 . LEU B 2 170 ? -30.553 17.486 3.137 1.00 88.92 170 B 1 ATOM 2542 C CD2 . LEU B 2 170 ? -32.629 16.413 2.331 1.00 88.74 170 B 1 ATOM 2543 N N . GLN B 2 171 ? -30.309 12.385 0.896 1.00 92.02 171 B 1 ATOM 2544 C CA . GLN B 2 171 ? -29.337 11.518 0.243 1.00 91.38 171 B 1 ATOM 2545 C C . GLN B 2 171 ? -27.934 12.118 0.371 1.00 92.06 171 B 1 ATOM 2546 O O . GLN B 2 171 ? -27.745 13.310 0.150 1.00 90.61 171 B 1 ATOM 2547 C CB . GLN B 2 171 ? -29.718 11.290 -1.227 1.00 89.57 171 B 1 ATOM 2548 C CG . GLN B 2 171 ? -31.019 10.484 -1.348 1.00 84.94 171 B 1 ATOM 2549 C CD . GLN B 2 171 ? -31.393 10.155 -2.793 1.00 82.76 171 B 1 ATOM 2550 O OE1 . GLN B 2 171 ? -31.244 10.925 -3.723 1.00 74.92 171 B 1 ATOM 2551 N NE2 . GLN B 2 171 ? -31.921 8.975 -3.031 1.00 73.07 171 B 1 ATOM 2552 N N . HIS B 2 172 ? -26.946 11.292 0.693 1.00 93.09 172 B 1 ATOM 2553 C CA . HIS B 2 172 ? -25.559 11.730 0.808 1.00 92.53 172 B 1 ATOM 2554 C C . HIS B 2 172 ? -24.855 11.626 -0.545 1.00 92.94 172 B 1 ATOM 2555 O O . HIS B 2 172 ? -24.872 10.580 -1.192 1.00 91.19 172 B 1 ATOM 2556 C CB . HIS B 2 172 ? -24.836 10.919 1.895 1.00 90.65 172 B 1 ATOM 2557 C CG . HIS B 2 172 ? -25.372 11.110 3.291 1.00 88.18 172 B 1 ATOM 2558 N ND1 . HIS B 2 172 ? -24.974 10.381 4.396 1.00 76.09 172 B 1 ATOM 2559 C CD2 . HIS B 2 172 ? -26.300 12.011 3.740 1.00 76.30 172 B 1 ATOM 2560 C CE1 . HIS B 2 172 ? -25.646 10.831 5.462 1.00 78.20 172 B 1 ATOM 2561 N NE2 . HIS B 2 172 ? -26.461 11.825 5.101 1.00 80.29 172 B 1 ATOM 2562 N N . ALA B 2 173 ? -24.224 12.713 -0.961 1.00 93.87 173 B 1 ATOM 2563 C CA . ALA B 2 173 ? -23.492 12.795 -2.222 1.00 93.87 173 B 1 ATOM 2564 C C . ALA B 2 173 ? -22.115 13.452 -2.086 1.00 95.08 173 B 1 ATOM 2565 O O . ALA B 2 173 ? -21.436 13.645 -3.089 1.00 93.62 173 B 1 ATOM 2566 C CB . ALA B 2 173 ? -24.374 13.531 -3.232 1.00 91.60 173 B 1 ATOM 2567 N N . LYS B 2 174 ? -21.700 13.803 -0.862 1.00 95.28 174 B 1 ATOM 2568 C CA . LYS B 2 174 ? -20.441 14.491 -0.575 1.00 95.39 174 B 1 ATOM 2569 C C . LYS B 2 174 ? -19.700 13.881 0.609 1.00 95.81 174 B 1 ATOM 2570 O O . LYS B 2 174 ? -20.297 13.194 1.436 1.00 95.12 174 B 1 ATOM 2571 C CB . LYS B 2 174 ? -20.698 16.004 -0.397 1.00 93.59 174 B 1 ATOM 2572 C CG . LYS B 2 174 ? -21.466 16.375 0.885 1.00 91.12 174 B 1 ATOM 2573 C CD . LYS B 2 174 ? -21.627 17.900 1.015 1.00 89.49 174 B 1 ATOM 2574 C CE . LYS B 2 174 ? -22.080 18.339 2.413 1.00 82.95 174 B 1 ATOM 2575 N NZ . LYS B 2 174 ? -21.032 19.126 3.123 1.00 78.63 174 B 1 ATOM 2576 N N . GLU B 2 175 ? -18.414 14.166 0.684 1.00 96.38 175 B 1 ATOM 2577 C CA . GLU B 2 175 ? -17.587 14.063 1.889 1.00 96.30 175 B 1 ATOM 2578 C C . GLU B 2 175 ? -16.897 15.403 2.125 1.00 97.11 175 B 1 ATOM 2579 O O . GLU B 2 175 ? -16.704 16.166 1.182 1.00 96.59 175 B 1 ATOM 2580 C CB . GLU B 2 175 ? -16.578 12.914 1.770 1.00 95.04 175 B 1 ATOM 2581 C CG . GLU B 2 175 ? -17.280 11.556 1.860 1.00 91.06 175 B 1 ATOM 2582 C CD . GLU B 2 175 ? -16.354 10.340 1.724 1.00 90.68 175 B 1 ATOM 2583 O OE1 . GLU B 2 175 ? -16.870 9.290 1.267 1.00 82.74 175 B 1 ATOM 2584 O OE2 . GLU B 2 175 ? -15.153 10.421 2.031 1.00 85.50 175 B 1 ATOM 2585 N N . SER B 2 176 ? -16.546 15.682 3.380 1.00 97.47 176 B 1 ATOM 2586 C CA . SER B 2 176 ? -15.944 16.947 3.786 1.00 97.66 176 B 1 ATOM 2587 C C . SER B 2 176 ? -14.524 16.722 4.299 1.00 98.18 176 B 1 ATOM 2588 O O . SER B 2 176 ? -14.276 15.767 5.038 1.00 97.73 176 B 1 ATOM 2589 C CB . SER B 2 176 ? -16.800 17.624 4.859 1.00 96.50 176 B 1 ATOM 2590 O OG . SER B 2 176 ? -18.066 18.008 4.343 1.00 89.42 176 B 1 ATOM 2591 N N . CYS B 2 177 ? -13.607 17.603 3.906 1.00 98.30 177 B 1 ATOM 2592 C CA . CYS B 2 177 ? -12.249 17.689 4.422 1.00 98.42 177 B 1 ATOM 2593 C C . CYS B 2 177 ? -12.088 19.039 5.116 1.00 98.50 177 B 1 ATOM 2594 O O . CYS B 2 177 ? -12.063 20.074 4.454 1.00 98.11 177 B 1 ATOM 2595 C CB . CYS B 2 177 ? -11.268 17.504 3.264 1.00 98.29 177 B 1 ATOM 2596 S SG . CYS B 2 177 ? -9.583 17.369 3.919 1.00 97.83 177 B 1 ATOM 2597 N N . LEU B 2 178 ? -12.021 19.032 6.448 1.00 98.58 178 B 1 ATOM 2598 C CA . LEU B 2 178 ? -11.903 20.249 7.249 1.00 98.64 178 B 1 ATOM 2599 C C . LEU B 2 178 ? -10.458 20.730 7.257 1.00 98.68 178 B 1 ATOM 2600 O O . LEU B 2 178 ? -9.546 19.914 7.407 1.00 98.33 178 B 1 ATOM 2601 C CB . LEU B 2 178 ? -12.413 19.994 8.673 1.00 98.45 178 B 1 ATOM 2602 C CG . LEU B 2 178 ? -13.889 19.564 8.768 1.00 96.54 178 B 1 ATOM 2603 C CD1 . LEU B 2 178 ? -14.284 19.391 10.233 1.00 89.42 178 B 1 ATOM 2604 C CD2 . LEU B 2 178 ? -14.833 20.598 8.155 1.00 89.53 178 B 1 ATOM 2605 N N . ILE B 2 179 ? -10.249 22.043 7.131 1.00 98.47 179 B 1 ATOM 2606 C CA . ILE B 2 179 ? -8.930 22.665 7.031 1.00 98.42 179 B 1 ATOM 2607 C C . ILE B 2 179 ? -8.697 23.596 8.218 1.00 98.38 179 B 1 ATOM 2608 O O . ILE B 2 179 ? -9.435 24.563 8.438 1.00 97.81 179 B 1 ATOM 2609 C CB . ILE B 2 179 ? -8.737 23.378 5.678 1.00 98.07 179 B 1 ATOM 2610 C CG1 . ILE B 2 179 ? -9.034 22.410 4.505 1.00 96.80 179 B 1 ATOM 2611 C CG2 . ILE B 2 179 ? -7.301 23.932 5.581 1.00 97.04 179 B 1 ATOM 2612 C CD1 . ILE B 2 179 ? -8.964 23.062 3.126 1.00 91.72 179 B 1 ATOM 2613 N N . GLY B 2 180 ? -7.644 23.313 8.970 1.00 98.46 180 B 1 ATOM 2614 C CA . GLY B 2 180 ? -7.134 24.161 10.036 1.00 98.41 180 B 1 ATOM 2615 C C . GLY B 2 180 ? -5.811 24.813 9.662 1.00 98.55 180 B 1 ATOM 2616 O O . GLY B 2 180 ? -5.030 24.250 8.897 1.00 98.17 180 B 1 ATOM 2617 N N . VAL B 2 181 ? -5.535 25.984 10.232 1.00 98.39 181 B 1 ATOM 2618 C CA . VAL B 2 181 ? -4.260 26.703 10.108 1.00 98.36 181 B 1 ATOM 2619 C C . VAL B 2 181 ? -3.620 26.907 11.478 1.00 98.39 181 B 1 ATOM 2620 O O . VAL B 2 181 ? -4.313 27.106 12.482 1.00 97.68 181 B 1 ATOM 2621 C CB . VAL B 2 181 ? -4.441 28.027 9.340 1.00 97.40 181 B 1 ATOM 2622 C CG1 . VAL B 2 181 ? -5.183 29.097 10.150 1.00 91.43 181 B 1 ATOM 2623 C CG2 . VAL B 2 181 ? -3.098 28.604 8.891 1.00 90.87 181 B 1 ATOM 2624 N N . LYS B 2 182 ? -2.279 26.881 11.518 1.00 98.01 182 B 1 ATOM 2625 C CA . LYS B 2 182 ? -1.476 27.116 12.716 1.00 97.65 182 B 1 ATOM 2626 C C . LYS B 2 182 ? -0.236 27.936 12.374 1.00 97.87 182 B 1 ATOM 2627 O O . LYS B 2 182 ? 0.372 27.725 11.328 1.00 96.52 182 B 1 ATOM 2628 C CB . LYS B 2 182 ? -1.102 25.750 13.316 1.00 94.94 182 B 1 ATOM 2629 C CG . LYS B 2 182 ? -0.234 25.846 14.580 1.00 91.23 182 B 1 ATOM 2630 C CD . LYS B 2 182 ? 0.206 24.447 15.011 1.00 91.35 182 B 1 ATOM 2631 C CE . LYS B 2 182 ? 1.183 24.536 16.179 1.00 86.74 182 B 1 ATOM 2632 N NZ . LYS B 2 182 ? 1.844 23.234 16.414 1.00 84.35 182 B 1 ATOM 2633 N N . GLY B 2 183 ? 0.162 28.821 13.290 1.00 96.66 183 B 1 ATOM 2634 C CA . GLY B 2 183 ? 1.385 29.607 13.173 1.00 96.48 183 B 1 ATOM 2635 C C . GLY B 2 183 ? 1.339 30.645 12.054 1.00 96.96 183 B 1 ATOM 2636 O O . GLY B 2 183 ? 0.271 31.160 11.709 1.00 94.27 183 B 1 ATOM 2637 N N . ASP B 2 184 ? 2.516 30.968 11.509 1.00 95.75 184 B 1 ATOM 2638 C CA . ASP B 2 184 ? 2.690 31.938 10.431 1.00 95.66 184 B 1 ATOM 2639 C C . ASP B 2 184 ? 2.704 31.237 9.065 1.00 95.74 184 B 1 ATOM 2640 O O . ASP B 2 184 ? 3.661 30.549 8.699 1.00 93.00 184 B 1 ATOM 2641 C CB . ASP B 2 184 ? 3.969 32.752 10.668 1.00 94.08 184 B 1 ATOM 2642 C CG . ASP B 2 184 ? 4.233 33.760 9.542 1.00 91.55 184 B 1 ATOM 2643 O OD1 . ASP B 2 184 ? 3.286 34.061 8.780 1.00 85.75 184 B 1 ATOM 2644 O OD2 . ASP B 2 184 ? 5.397 34.205 9.425 1.00 85.27 184 B 1 ATOM 2645 N N . VAL B 2 185 ? 1.638 31.439 8.289 1.00 96.05 185 B 1 ATOM 2646 C CA . VAL B 2 185 ? 1.516 30.943 6.909 1.00 95.61 185 B 1 ATOM 2647 C C . VAL B 2 185 ? 1.752 32.036 5.861 1.00 95.52 185 B 1 ATOM 2648 O O . VAL B 2 185 ? 1.644 31.777 4.665 1.00 91.28 185 B 1 ATOM 2649 C CB . VAL B 2 185 ? 0.189 30.197 6.677 1.00 93.46 185 B 1 ATOM 2650 C CG1 . VAL B 2 185 ? 0.114 28.945 7.567 1.00 87.66 185 B 1 ATOM 2651 C CG2 . VAL B 2 185 ? -1.030 31.083 6.940 1.00 89.34 185 B 1 ATOM 2652 N N . ASP B 2 186 ? 2.142 33.238 6.298 1.00 95.01 186 B 1 ATOM 2653 C CA . ASP B 2 186 ? 2.531 34.368 5.444 1.00 94.19 186 B 1 ATOM 2654 C C . ASP B 2 186 ? 4.056 34.435 5.239 1.00 93.87 186 B 1 ATOM 2655 O O . ASP B 2 186 ? 4.591 35.386 4.682 1.00 89.23 186 B 1 ATOM 2656 C CB . ASP B 2 186 ? 1.908 35.671 5.981 1.00 92.39 186 B 1 ATOM 2657 C CG . ASP B 2 186 ? 0.384 35.715 5.807 1.00 88.73 186 B 1 ATOM 2658 O OD1 . ASP B 2 186 ? -0.191 34.813 5.162 1.00 82.88 186 B 1 ATOM 2659 O OD2 . ASP B 2 186 ? -0.270 36.719 6.154 1.00 83.95 186 B 1 ATOM 2660 N N . ASN B 2 187 ? 4.767 33.365 5.595 1.00 93.10 187 B 1 ATOM 2661 C CA . ASN B 2 187 ? 6.224 33.205 5.479 1.00 91.16 187 B 1 ATOM 2662 C C . ASN B 2 187 ? 6.741 32.955 4.042 1.00 91.85 187 B 1 ATOM 2663 O O . ASN B 2 187 ? 7.918 32.638 3.848 1.00 87.04 187 B 1 ATOM 2664 C CB . ASN B 2 187 ? 6.658 32.106 6.463 1.00 86.02 187 B 1 ATOM 2665 C CG . ASN B 2 187 ? 6.021 30.751 6.174 1.00 83.95 187 B 1 ATOM 2666 O OD1 . ASN B 2 187 ? 5.818 30.325 5.046 1.00 76.64 187 B 1 ATOM 2667 N ND2 . ASN B 2 187 ? 5.678 30.028 7.221 1.00 79.22 187 B 1 ATOM 2668 N N . GLY B 2 188 ? 5.878 33.048 3.031 1.00 91.96 188 B 1 ATOM 2669 C CA . GLY B 2 188 ? 6.228 32.867 1.616 1.00 91.95 188 B 1 ATOM 2670 C C . GLY B 2 188 ? 6.268 31.412 1.127 1.00 93.49 188 B 1 ATOM 2671 O O . GLY B 2 188 ? 6.448 31.186 -0.072 1.00 89.90 188 B 1 ATOM 2672 N N . ARG B 2 189 ? 6.079 30.420 2.001 1.00 93.81 189 B 1 ATOM 2673 C CA . ARG B 2 189 ? 5.998 29.000 1.606 1.00 93.60 189 B 1 ATOM 2674 C C . ARG B 2 189 ? 4.621 28.616 1.063 1.00 94.77 189 B 1 ATOM 2675 O O . ARG B 2 189 ? 4.524 27.689 0.263 1.00 93.11 189 B 1 ATOM 2676 C CB . ARG B 2 189 ? 6.379 28.090 2.779 1.00 91.45 189 B 1 ATOM 2677 C CG . ARG B 2 189 ? 7.854 28.276 3.177 1.00 86.02 189 B 1 ATOM 2678 C CD . ARG B 2 189 ? 8.259 27.313 4.290 1.00 81.02 189 B 1 ATOM 2679 N NE . ARG B 2 189 ? 7.612 27.645 5.568 1.00 75.19 189 B 1 ATOM 2680 C CZ . ARG B 2 189 ? 7.376 26.805 6.559 1.00 70.56 189 B 1 ATOM 2681 N NH1 . ARG B 2 189 ? 7.735 25.559 6.502 1.00 62.91 189 B 1 ATOM 2682 N NH2 . ARG B 2 189 ? 6.772 27.204 7.637 1.00 62.93 189 B 1 ATOM 2683 N N . PHE B 2 190 ? 3.594 29.338 1.476 1.00 95.83 190 B 1 ATOM 2684 C CA . PHE B 2 190 ? 2.209 29.071 1.101 1.00 95.85 190 B 1 ATOM 2685 C C . PHE B 2 190 ? 1.696 30.099 0.096 1.00 95.79 190 B 1 ATOM 2686 O O . PHE B 2 190 ? 2.047 31.279 0.143 1.00 93.42 190 B 1 ATOM 2687 C CB . PHE B 2 190 ? 1.329 29.024 2.353 1.00 95.31 190 B 1 ATOM 2688 C CG . PHE B 2 190 ? 1.784 27.991 3.363 1.00 96.52 190 B 1 ATOM 2689 C CD1 . PHE B 2 190 ? 1.365 26.653 3.249 1.00 95.52 190 B 1 ATOM 2690 C CD2 . PHE B 2 190 ? 2.658 28.357 4.401 1.00 95.92 190 B 1 ATOM 2691 C CE1 . PHE B 2 190 ? 1.810 25.690 4.165 1.00 95.54 190 B 1 ATOM 2692 C CE2 . PHE B 2 190 ? 3.108 27.393 5.321 1.00 95.85 190 B 1 ATOM 2693 C CZ . PHE B 2 190 ? 2.685 26.059 5.203 1.00 96.16 190 B 1 ATOM 2694 N N . LYS B 2 191 ? 0.828 29.653 -0.807 1.00 95.95 191 B 1 ATOM 2695 C CA . LYS B 2 191 ? 0.083 30.509 -1.724 1.00 95.59 191 B 1 ATOM 2696 C C . LYS B 2 191 ? -1.327 30.742 -1.196 1.00 95.68 191 B 1 ATOM 2697 O O . LYS B 2 191 ? -1.877 29.933 -0.454 1.00 92.97 191 B 1 ATOM 2698 C CB . LYS B 2 191 ? 0.081 29.916 -3.139 1.00 94.77 191 B 1 ATOM 2699 C CG . LYS B 2 191 ? 1.494 29.877 -3.733 1.00 91.11 191 B 1 ATOM 2700 C CD . LYS B 2 191 ? 1.431 29.462 -5.201 1.00 83.59 191 B 1 ATOM 2701 C CE . LYS B 2 191 ? 2.831 29.479 -5.810 1.00 77.51 191 B 1 ATOM 2702 N NZ . LYS B 2 191 ? 2.798 29.065 -7.232 1.00 66.95 191 B 1 ATOM 2703 N N . LYS B 2 192 ? -1.921 31.868 -1.623 1.00 95.80 192 B 1 ATOM 2704 C CA . LYS B 2 192 ? -3.298 32.240 -1.281 1.00 95.02 192 B 1 ATOM 2705 C C . LYS B 2 192 ? -4.180 32.205 -2.523 1.00 95.27 192 B 1 ATOM 2706 O O . LYS B 2 192 ? -3.673 32.353 -3.639 1.00 90.92 192 B 1 ATOM 2707 C CB . LYS B 2 192 ? -3.321 33.622 -0.596 1.00 91.83 192 B 1 ATOM 2708 C CG . LYS B 2 192 ? -2.585 33.614 0.754 1.00 87.11 192 B 1 ATOM 2709 C CD . LYS B 2 192 ? -2.682 34.965 1.475 1.00 80.75 192 B 1 ATOM 2710 C CE . LYS B 2 192 ? -1.942 34.851 2.809 1.00 73.64 192 B 1 ATOM 2711 N NZ . LYS B 2 192 ? -1.968 36.091 3.627 1.00 63.64 192 B 1 ATOM 2712 N N . ASN B 2 193 ? -5.488 32.065 -2.317 1.00 95.06 193 B 1 ATOM 2713 C CA . ASN B 2 193 ? -6.497 32.100 -3.376 1.00 95.06 193 B 1 ATOM 2714 C C . ASN B 2 193 ? -6.224 31.075 -4.500 1.00 95.23 193 B 1 ATOM 2715 O O . ASN B 2 193 ? -6.154 31.411 -5.684 1.00 91.72 193 B 1 ATOM 2716 C CB . ASN B 2 193 ? -6.645 33.557 -3.854 1.00 93.98 193 B 1 ATOM 2717 C CG . ASN B 2 193 ? -7.884 33.747 -4.708 1.00 92.54 193 B 1 ATOM 2718 O OD1 . ASN B 2 193 ? -8.968 33.344 -4.362 1.00 85.04 193 B 1 ATOM 2719 N ND2 . ASN B 2 193 ? -7.765 34.399 -5.842 1.00 84.97 193 B 1 ATOM 2720 N N . ILE B 2 194 ? -5.987 29.831 -4.108 1.00 95.60 194 B 1 ATOM 2721 C CA . ILE B 2 194 ? -5.659 28.717 -5.006 1.00 94.63 194 B 1 ATOM 2722 C C . ILE B 2 194 ? -6.781 27.678 -5.039 1.00 94.95 194 B 1 ATOM 2723 O O . ILE B 2 194 ? -7.603 27.616 -4.126 1.00 91.42 194 B 1 ATOM 2724 C CB . ILE B 2 194 ? -4.295 28.094 -4.653 1.00 91.93 194 B 1 ATOM 2725 C CG1 . ILE B 2 194 ? -4.187 27.509 -3.225 1.00 82.90 194 B 1 ATOM 2726 C CG2 . ILE B 2 194 ? -3.169 29.142 -4.863 1.00 79.69 194 B 1 ATOM 2727 C CD1 . ILE B 2 194 ? -4.782 26.111 -3.054 1.00 77.44 194 B 1 ATOM 2728 N N . ALA B 2 195 ? -6.774 26.855 -6.073 1.00 94.90 195 B 1 ATOM 2729 C CA . ALA B 2 195 ? -7.679 25.716 -6.230 1.00 94.30 195 B 1 ATOM 2730 C C . ALA B 2 195 ? -9.170 26.094 -6.067 1.00 95.10 195 B 1 ATOM 2731 O O . ALA B 2 195 ? -9.621 27.128 -6.565 1.00 90.99 195 B 1 ATOM 2732 C CB . ALA B 2 195 ? -7.184 24.573 -5.328 1.00 91.71 195 B 1 ATOM 2733 N N . SER B 2 196 ? -9.942 25.231 -5.416 1.00 94.63 196 B 1 ATOM 2734 C CA . SER B 2 196 ? -11.364 25.406 -5.122 1.00 95.23 196 B 1 ATOM 2735 C C . SER B 2 196 ? -11.683 24.702 -3.805 1.00 96.26 196 B 1 ATOM 2736 O O . SER B 2 196 ? -11.023 23.731 -3.443 1.00 93.84 196 B 1 ATOM 2737 C CB . SER B 2 196 ? -12.190 24.803 -6.265 1.00 93.08 196 B 1 ATOM 2738 O OG . SER B 2 196 ? -13.582 24.903 -6.022 1.00 89.57 196 B 1 ATOM 2739 N N . ASP B 2 197 ? -12.732 25.147 -3.127 1.00 97.00 197 B 1 ATOM 2740 C CA . ASP B 2 197 ? -13.318 24.449 -1.976 1.00 97.21 197 B 1 ATOM 2741 C C . ASP B 2 197 ? -14.214 23.263 -2.380 1.00 97.66 197 B 1 ATOM 2742 O O . ASP B 2 197 ? -14.778 22.560 -1.543 1.00 96.39 197 B 1 ATOM 2743 C CB . ASP B 2 197 ? -14.078 25.476 -1.118 1.00 95.99 197 B 1 ATOM 2744 C CG . ASP B 2 197 ? -15.316 26.064 -1.812 1.00 95.98 197 B 1 ATOM 2745 O OD1 . ASP B 2 197 ? -15.409 25.988 -3.064 1.00 91.90 197 B 1 ATOM 2746 O OD2 . ASP B 2 197 ? -16.196 26.573 -1.086 1.00 92.17 197 B 1 ATOM 2747 N N . VAL B 2 198 ? -14.334 22.990 -3.686 1.00 97.35 198 B 1 ATOM 2748 C CA . VAL B 2 198 ? -15.099 21.871 -4.234 1.00 97.25 198 B 1 ATOM 2749 C C . VAL B 2 198 ? -14.224 20.990 -5.122 1.00 97.41 198 B 1 ATOM 2750 O O . VAL B 2 198 ? -13.614 21.443 -6.089 1.00 96.39 198 B 1 ATOM 2751 C CB . VAL B 2 198 ? -16.357 22.355 -4.981 1.00 96.12 198 B 1 ATOM 2752 C CG1 . VAL B 2 198 ? -17.152 21.185 -5.579 1.00 91.93 198 B 1 ATOM 2753 C CG2 . VAL B 2 198 ? -17.306 23.113 -4.045 1.00 92.41 198 B 1 ATOM 2754 N N . ILE B 2 199 ? -14.249 19.697 -4.860 1.00 97.72 199 B 1 ATOM 2755 C CA . ILE B 2 199 ? -13.784 18.655 -5.781 1.00 97.74 199 B 1 ATOM 2756 C C . ILE B 2 199 ? -15.014 17.945 -6.341 1.00 97.58 199 B 1 ATOM 2757 O O . ILE B 2 199 ? -15.858 17.458 -5.588 1.00 96.92 199 B 1 ATOM 2758 C CB . ILE B 2 199 ? -12.808 17.683 -5.084 1.00 97.71 199 B 1 ATOM 2759 C CG1 . ILE B 2 199 ? -11.538 18.426 -4.599 1.00 96.76 199 B 1 ATOM 2760 C CG2 . ILE B 2 199 ? -12.436 16.536 -6.040 1.00 96.66 199 B 1 ATOM 2761 C CD1 . ILE B 2 199 ? -10.615 17.577 -3.710 1.00 95.81 199 B 1 ATOM 2762 N N . PHE B 2 200 ? -15.129 17.865 -7.667 1.00 96.89 200 B 1 ATOM 2763 C CA . PHE B 2 200 ? -16.222 17.155 -8.333 1.00 96.49 200 B 1 ATOM 2764 C C . PHE B 2 200 ? -15.675 16.013 -9.187 1.00 96.43 200 B 1 ATOM 2765 O O . PHE B 2 200 ? -15.388 16.177 -10.374 1.00 94.92 200 B 1 ATOM 2766 C CB . PHE B 2 200 ? -17.091 18.136 -9.133 1.00 95.45 200 B 1 ATOM 2767 C CG . PHE B 2 200 ? -18.307 17.491 -9.791 1.00 94.85 200 B 1 ATOM 2768 C CD1 . PHE B 2 200 ? -18.559 17.680 -11.167 1.00 90.22 200 B 1 ATOM 2769 C CD2 . PHE B 2 200 ? -19.199 16.712 -9.035 1.00 91.02 200 B 1 ATOM 2770 C CE1 . PHE B 2 200 ? -19.700 17.114 -11.767 1.00 90.27 200 B 1 ATOM 2771 C CE2 . PHE B 2 200 ? -20.336 16.131 -9.633 1.00 89.66 200 B 1 ATOM 2772 C CZ . PHE B 2 200 ? -20.591 16.340 -10.998 1.00 90.92 200 B 1 ATOM 2773 N N . SER B 2 201 ? -15.549 14.834 -8.586 1.00 97.08 201 B 1 ATOM 2774 C CA . SER B 2 201 ? -14.984 13.666 -9.261 1.00 96.96 201 B 1 ATOM 2775 C C . SER B 2 201 ? -15.635 12.343 -8.852 1.00 96.99 201 B 1 ATOM 2776 O O . SER B 2 201 ? -16.440 12.254 -7.914 1.00 96.43 201 B 1 ATOM 2777 C CB . SER B 2 201 ? -13.460 13.639 -9.102 1.00 96.08 201 B 1 ATOM 2778 O OG . SER B 2 201 ? -13.048 13.349 -7.788 1.00 93.46 201 B 1 ATOM 2779 N N . GLU B 2 202 ? -15.343 11.311 -9.631 1.00 96.48 202 B 1 ATOM 2780 C CA . GLU B 2 202 ? -15.905 9.984 -9.429 1.00 96.14 202 B 1 ATOM 2781 C C . GLU B 2 202 ? -15.277 9.280 -8.228 1.00 96.03 202 B 1 ATOM 2782 O O . GLU B 2 202 ? -14.096 9.421 -7.917 1.00 94.94 202 B 1 ATOM 2783 C CB . GLU B 2 202 ? -15.775 9.129 -10.699 1.00 95.30 202 B 1 ATOM 2784 C CG . GLU B 2 202 ? -16.644 9.687 -11.836 1.00 89.73 202 B 1 ATOM 2785 C CD . GLU B 2 202 ? -16.639 8.823 -13.101 1.00 87.88 202 B 1 ATOM 2786 O OE1 . GLU B 2 202 ? -16.896 9.401 -14.182 1.00 80.32 202 B 1 ATOM 2787 O OE2 . GLU B 2 202 ? -16.452 7.591 -12.982 1.00 81.58 202 B 1 ATOM 2788 N N . ARG B 2 203 ? -16.083 8.453 -7.571 1.00 95.63 203 B 1 ATOM 2789 C CA . ARG B 2 203 ? -15.573 7.541 -6.557 1.00 94.40 203 B 1 ATOM 2790 C C . ARG B 2 203 ? -14.730 6.461 -7.237 1.00 94.51 203 B 1 ATOM 2791 O O . ARG B 2 203 ? -15.201 5.780 -8.136 1.00 92.54 203 B 1 ATOM 2792 C CB . ARG B 2 203 ? -16.744 6.951 -5.757 1.00 92.04 203 B 1 ATOM 2793 C CG . ARG B 2 203 ? -16.239 6.121 -4.574 1.00 82.81 203 B 1 ATOM 2794 C CD . ARG B 2 203 ? -17.402 5.508 -3.810 1.00 79.74 203 B 1 ATOM 2795 N NE . ARG B 2 203 ? -16.913 4.738 -2.655 1.00 70.71 203 B 1 ATOM 2796 C CZ . ARG B 2 203 ? -17.616 3.936 -1.880 1.00 64.09 203 B 1 ATOM 2797 N NH1 . ARG B 2 203 ? -18.883 3.723 -2.073 1.00 58.74 203 B 1 ATOM 2798 N NH2 . ARG B 2 203 ? -17.038 3.342 -0.885 1.00 56.79 203 B 1 ATOM 2799 N N . ARG B 2 204 ? -13.517 6.257 -6.724 1.00 94.60 204 B 1 ATOM 2800 C CA . ARG B 2 204 ? -12.594 5.184 -7.136 1.00 92.95 204 B 1 ATOM 2801 C C . ARG B 2 204 ? -12.753 3.966 -6.213 1.00 91.84 204 B 1 ATOM 2802 O O . ARG B 2 204 ? -13.841 3.368 -6.145 1.00 86.30 204 B 1 ATOM 2803 C CB . ARG B 2 204 ? -11.164 5.759 -7.234 1.00 90.86 204 B 1 ATOM 2804 C CG . ARG B 2 204 ? -11.038 6.906 -8.266 1.00 88.77 204 B 1 ATOM 2805 C CD . ARG B 2 204 ? -9.585 7.401 -8.397 1.00 86.72 204 B 1 ATOM 2806 N NE . ARG B 2 204 ? -9.111 8.112 -7.186 1.00 83.85 204 B 1 ATOM 2807 C CZ . ARG B 2 204 ? -7.855 8.397 -6.878 1.00 82.85 204 B 1 ATOM 2808 N NH1 . ARG B 2 204 ? -6.851 8.056 -7.638 1.00 72.40 204 B 1 ATOM 2809 N NH2 . ARG B 2 204 ? -7.569 9.056 -5.793 1.00 76.12 204 B 1 ATOM 2810 N N . GLY B 2 205 ? -11.706 3.591 -5.491 1.00 92.87 205 B 1 ATOM 2811 C CA . GLY B 2 205 ? -11.729 2.467 -4.555 1.00 91.89 205 B 1 ATOM 2812 C C . GLY B 2 205 ? -12.597 2.687 -3.305 1.00 93.20 205 B 1 ATOM 2813 O O . GLY B 2 205 ? -13.119 3.772 -3.039 1.00 91.14 205 B 1 ATOM 2814 N N . GLN B 2 206 ? -12.742 1.637 -2.504 1.00 89.67 206 B 1 ATOM 2815 C CA . GLN B 2 206 ? -13.420 1.708 -1.209 1.00 89.58 206 B 1 ATOM 2816 C C . GLN B 2 206 ? -12.717 2.720 -0.294 1.00 90.95 206 B 1 ATOM 2817 O O . GLN B 2 206 ? -11.513 2.619 -0.088 1.00 88.33 206 B 1 ATOM 2818 C CB . GLN B 2 206 ? -13.444 0.308 -0.579 1.00 86.46 206 B 1 ATOM 2819 C CG . GLN B 2 206 ? -14.121 0.255 0.811 1.00 77.75 206 B 1 ATOM 2820 C CD . GLN B 2 206 ? -15.608 0.615 0.796 1.00 71.15 206 B 1 ATOM 2821 O OE1 . GLN B 2 206 ? -16.265 0.668 -0.232 1.00 66.01 206 B 1 ATOM 2822 N NE2 . GLN B 2 206 ? -16.188 0.877 1.946 1.00 62.02 206 B 1 ATOM 2823 N N . SER B 2 207 ? -13.472 3.678 0.246 1.00 91.82 207 B 1 ATOM 2824 C CA . SER B 2 207 ? -12.961 4.758 1.112 1.00 92.66 207 B 1 ATOM 2825 C C . SER B 2 207 ? -11.840 5.616 0.505 1.00 94.33 207 B 1 ATOM 2826 O O . SER B 2 207 ? -11.310 6.485 1.188 1.00 92.66 207 B 1 ATOM 2827 C CB . SER B 2 207 ? -12.581 4.222 2.502 1.00 89.98 207 B 1 ATOM 2828 O OG . SER B 2 207 ? -13.684 3.535 3.068 1.00 80.11 207 B 1 ATOM 2829 N N . GLN B 2 208 ? -11.502 5.423 -0.773 1.00 94.92 208 B 1 ATOM 2830 C CA . GLN B 2 208 ? -10.438 6.165 -1.447 1.00 95.92 208 B 1 ATOM 2831 C C . GLN B 2 208 ? -10.865 7.611 -1.691 1.00 96.58 208 B 1 ATOM 2832 O O . GLN B 2 208 ? -11.898 7.860 -2.321 1.00 96.05 208 B 1 ATOM 2833 C CB . GLN B 2 208 ? -10.060 5.454 -2.749 1.00 95.27 208 B 1 ATOM 2834 C CG . GLN B 2 208 ? -8.798 6.052 -3.386 1.00 92.58 208 B 1 ATOM 2835 C CD . GLN B 2 208 ? -8.368 5.316 -4.655 1.00 90.89 208 B 1 ATOM 2836 O OE1 . GLN B 2 208 ? -9.087 4.518 -5.232 1.00 85.00 208 B 1 ATOM 2837 N NE2 . GLN B 2 208 ? -7.175 5.571 -5.149 1.00 82.52 208 B 1 ATOM 2838 N N . LYS B 2 209 ? -10.043 8.551 -1.209 1.00 97.09 209 B 1 ATOM 2839 C CA . LYS B 2 209 ? -10.226 9.987 -1.421 1.00 97.18 209 B 1 ATOM 2840 C C . LYS B 2 209 ? -9.800 10.391 -2.837 1.00 97.23 209 B 1 ATOM 2841 O O . LYS B 2 209 ? -9.090 9.620 -3.505 1.00 96.42 209 B 1 ATOM 2842 C CB . LYS B 2 209 ? -9.512 10.762 -0.306 1.00 96.30 209 B 1 ATOM 2843 C CG . LYS B 2 209 ? -10.085 10.466 1.102 1.00 94.58 209 B 1 ATOM 2844 C CD . LYS B 2 209 ? -11.591 10.751 1.223 1.00 91.58 209 B 1 ATOM 2845 C CE . LYS B 2 209 ? -12.107 10.581 2.652 1.00 90.07 209 B 1 ATOM 2846 N NZ . LYS B 2 209 ? -12.191 9.162 3.064 1.00 85.44 209 B 1 ATOM 2847 N N . PRO B 2 210 ? -10.303 11.532 -3.347 1.00 98.01 210 B 1 ATOM 2848 C CA . PRO B 2 210 ? -10.012 11.967 -4.706 1.00 97.97 210 B 1 ATOM 2849 C C . PRO B 2 210 ? -8.539 12.365 -4.861 1.00 98.04 210 B 1 ATOM 2850 O O . PRO B 2 210 ? -7.922 12.847 -3.918 1.00 97.31 210 B 1 ATOM 2851 C CB . PRO B 2 210 ? -10.973 13.128 -4.964 1.00 97.32 210 B 1 ATOM 2852 C CG . PRO B 2 210 ? -11.168 13.731 -3.577 1.00 96.04 210 B 1 ATOM 2853 C CD . PRO B 2 210 ? -11.149 12.505 -2.672 1.00 97.54 210 B 1 ATOM 2854 N N . GLU B 2 211 ? -8.000 12.179 -6.063 1.00 97.75 211 B 1 ATOM 2855 C CA . GLU B 2 211 ? -6.606 12.517 -6.395 1.00 97.56 211 B 1 ATOM 2856 C C . GLU B 2 211 ? -6.342 14.026 -6.336 1.00 97.84 211 B 1 ATOM 2857 O O . GLU B 2 211 ? -5.256 14.477 -5.997 1.00 97.17 211 B 1 ATOM 2858 C CB . GLU B 2 211 ? -6.337 11.984 -7.815 1.00 96.54 211 B 1 ATOM 2859 C CG . GLU B 2 211 ? -4.856 12.069 -8.227 1.00 90.80 211 B 1 ATOM 2860 C CD . GLU B 2 211 ? -3.958 11.216 -7.314 1.00 90.54 211 B 1 ATOM 2861 O OE1 . GLU B 2 211 ? -2.776 11.565 -7.194 1.00 82.52 211 B 1 ATOM 2862 O OE2 . GLU B 2 211 ? -4.461 10.209 -6.741 1.00 84.23 211 B 1 ATOM 2863 N N . GLU B 2 212 ? -7.372 14.815 -6.635 1.00 97.40 212 B 1 ATOM 2864 C CA . GLU B 2 212 ? -7.328 16.272 -6.699 1.00 97.36 212 B 1 ATOM 2865 C C . GLU B 2 212 ? -6.861 16.892 -5.374 1.00 97.71 212 B 1 ATOM 2866 O O . GLU B 2 212 ? -6.259 17.960 -5.386 1.00 97.10 212 B 1 ATOM 2867 C CB . GLU B 2 212 ? -8.720 16.801 -7.092 1.00 96.90 212 B 1 ATOM 2868 C CG . GLU B 2 212 ? -9.210 16.368 -8.495 1.00 94.04 212 B 1 ATOM 2869 C CD . GLU B 2 212 ? -10.013 15.047 -8.531 1.00 93.64 212 B 1 ATOM 2870 O OE1 . GLU B 2 212 ? -10.888 14.910 -9.408 1.00 85.55 212 B 1 ATOM 2871 O OE2 . GLU B 2 212 ? -9.811 14.153 -7.677 1.00 87.85 212 B 1 ATOM 2872 N N . ILE B 2 213 ? -7.049 16.211 -4.239 1.00 98.05 213 B 1 ATOM 2873 C CA . ILE B 2 213 ? -6.620 16.738 -2.940 1.00 98.23 213 B 1 ATOM 2874 C C . ILE B 2 213 ? -5.102 16.940 -2.875 1.00 98.29 213 B 1 ATOM 2875 O O . ILE B 2 213 ? -4.640 17.959 -2.366 1.00 98.08 213 B 1 ATOM 2876 C CB . ILE B 2 213 ? -7.147 15.853 -1.787 1.00 98.01 213 B 1 ATOM 2877 C CG1 . ILE B 2 213 ? -7.096 16.564 -0.416 1.00 96.46 213 B 1 ATOM 2878 C CG2 . ILE B 2 213 ? -6.407 14.506 -1.683 1.00 97.10 213 B 1 ATOM 2879 C CD1 . ILE B 2 213 ? -7.986 17.803 -0.334 1.00 95.13 213 B 1 ATOM 2880 N N . TYR B 2 214 ? -4.316 16.026 -3.465 1.00 98.39 214 B 1 ATOM 2881 C CA . TYR B 2 214 ? -2.856 16.141 -3.518 1.00 98.35 214 B 1 ATOM 2882 C C . TYR B 2 214 ? -2.425 17.299 -4.420 1.00 98.16 214 B 1 ATOM 2883 O O . TYR B 2 214 ? -1.482 18.027 -4.107 1.00 97.52 214 B 1 ATOM 2884 C CB . TYR B 2 214 ? -2.251 14.824 -4.017 1.00 98.28 214 B 1 ATOM 2885 C CG . TYR B 2 214 ? -2.578 13.629 -3.146 1.00 98.43 214 B 1 ATOM 2886 C CD1 . TYR B 2 214 ? -1.892 13.413 -1.935 1.00 97.73 214 B 1 ATOM 2887 C CD2 . TYR B 2 214 ? -3.593 12.739 -3.537 1.00 97.78 214 B 1 ATOM 2888 C CE1 . TYR B 2 214 ? -2.218 12.317 -1.116 1.00 97.56 214 B 1 ATOM 2889 C CE2 . TYR B 2 214 ? -3.933 11.639 -2.725 1.00 97.57 214 B 1 ATOM 2890 C CZ . TYR B 2 214 ? -3.243 11.436 -1.512 1.00 97.98 214 B 1 ATOM 2891 O OH . TYR B 2 214 ? -3.597 10.378 -0.723 1.00 97.18 214 B 1 ATOM 2892 N N . GLN B 2 215 ? -3.152 17.516 -5.524 1.00 97.91 215 B 1 ATOM 2893 C CA . GLN B 2 215 ? -2.906 18.636 -6.432 1.00 97.39 215 B 1 ATOM 2894 C C . GLN B 2 215 ? -3.201 19.974 -5.745 1.00 97.54 215 B 1 ATOM 2895 O O . GLN B 2 215 ? -2.426 20.917 -5.884 1.00 96.78 215 B 1 ATOM 2896 C CB . GLN B 2 215 ? -3.769 18.499 -7.696 1.00 96.62 215 B 1 ATOM 2897 C CG . GLN B 2 215 ? -3.487 17.205 -8.478 1.00 90.85 215 B 1 ATOM 2898 C CD . GLN B 2 215 ? -4.423 17.036 -9.681 1.00 85.31 215 B 1 ATOM 2899 O OE1 . GLN B 2 215 ? -5.249 17.881 -10.001 1.00 77.76 215 B 1 ATOM 2900 N NE2 . GLN B 2 215 ? -4.331 15.933 -10.387 1.00 73.87 215 B 1 ATOM 2901 N N . TYR B 2 216 ? -4.284 20.055 -4.975 1.00 97.66 216 B 1 ATOM 2902 C CA . TYR B 2 216 ? -4.653 21.260 -4.227 1.00 97.59 216 B 1 ATOM 2903 C C . TYR B 2 216 ? -3.619 21.587 -3.145 1.00 97.64 216 B 1 ATOM 2904 O O . TYR B 2 216 ? -3.185 22.733 -3.038 1.00 97.05 216 B 1 ATOM 2905 C CB . TYR B 2 216 ? -6.054 21.086 -3.622 1.00 97.19 216 B 1 ATOM 2906 C CG . TYR B 2 216 ? -7.231 21.131 -4.582 1.00 95.34 216 B 1 ATOM 2907 C CD1 . TYR B 2 216 ? -7.083 21.035 -5.983 1.00 90.91 216 B 1 ATOM 2908 C CD2 . TYR B 2 216 ? -8.528 21.288 -4.042 1.00 91.51 216 B 1 ATOM 2909 C CE1 . TYR B 2 216 ? -8.199 21.107 -6.838 1.00 89.95 216 B 1 ATOM 2910 C CE2 . TYR B 2 216 ? -9.650 21.362 -4.886 1.00 90.27 216 B 1 ATOM 2911 C CZ . TYR B 2 216 ? -9.484 21.274 -6.287 1.00 89.34 216 B 1 ATOM 2912 O OH . TYR B 2 216 ? -10.577 21.372 -7.106 1.00 84.93 216 B 1 ATOM 2913 N N . ILE B 2 217 ? -3.147 20.579 -2.410 1.00 98.04 217 B 1 ATOM 2914 C CA . ILE B 2 217 ? -2.092 20.746 -1.406 1.00 98.07 217 B 1 ATOM 2915 C C . ILE B 2 217 ? -0.778 21.197 -2.061 1.00 97.81 217 B 1 ATOM 2916 O O . ILE B 2 217 ? -0.133 22.121 -1.565 1.00 97.31 217 B 1 ATOM 2917 C CB . ILE B 2 217 ? -1.941 19.450 -0.582 1.00 98.17 217 B 1 ATOM 2918 C CG1 . ILE B 2 217 ? -3.179 19.300 0.339 1.00 97.60 217 B 1 ATOM 2919 C CG2 . ILE B 2 217 ? -0.647 19.455 0.248 1.00 97.80 217 B 1 ATOM 2920 C CD1 . ILE B 2 217 ? -3.328 17.910 0.965 1.00 96.53 217 B 1 ATOM 2921 N N . ASN B 2 218 ? -0.409 20.627 -3.210 1.00 97.77 218 B 1 ATOM 2922 C CA . ASN B 2 218 ? 0.769 21.064 -3.958 1.00 97.25 218 B 1 ATOM 2923 C C . ASN B 2 218 ? 0.642 22.511 -4.476 1.00 97.28 218 B 1 ATOM 2924 O O . ASN B 2 218 ? 1.626 23.252 -4.513 1.00 96.59 218 B 1 ATOM 2925 C CB . ASN B 2 218 ? 1.006 20.074 -5.107 1.00 96.17 218 B 1 ATOM 2926 C CG . ASN B 2 218 ? 2.295 20.378 -5.852 1.00 87.35 218 B 1 ATOM 2927 O OD1 . ASN B 2 218 ? 3.351 20.561 -5.280 1.00 77.18 218 B 1 ATOM 2928 N ND2 . ASN B 2 218 ? 2.245 20.456 -7.163 1.00 74.60 218 B 1 ATOM 2929 N N . GLN B 2 219 ? -0.562 22.959 -4.853 1.00 97.47 219 B 1 ATOM 2930 C CA . GLN B 2 219 ? -0.810 24.358 -5.219 1.00 97.24 219 B 1 ATOM 2931 C C . GLN B 2 219 ? -0.736 25.293 -4.005 1.00 97.30 219 B 1 ATOM 2932 O O . GLN B 2 219 ? -0.209 26.399 -4.135 1.00 96.46 219 B 1 ATOM 2933 C CB . GLN B 2 219 ? -2.181 24.498 -5.894 1.00 96.88 219 B 1 ATOM 2934 C CG . GLN B 2 219 ? -2.219 23.908 -7.311 1.00 93.09 219 B 1 ATOM 2935 C CD . GLN B 2 219 ? -3.638 23.919 -7.889 1.00 90.12 219 B 1 ATOM 2936 O OE1 . GLN B 2 219 ? -4.439 24.814 -7.646 1.00 81.85 219 B 1 ATOM 2937 N NE2 . GLN B 2 219 ? -4.000 22.938 -8.681 1.00 78.52 219 B 1 ATOM 2938 N N . LEU B 2 220 ? -1.224 24.842 -2.848 1.00 97.48 220 B 1 ATOM 2939 C CA . LEU B 2 220 ? -1.197 25.598 -1.593 1.00 97.38 220 B 1 ATOM 2940 C C . LEU B 2 220 ? 0.232 25.776 -1.067 1.00 97.37 220 B 1 ATOM 2941 O O . LEU B 2 220 ? 0.604 26.870 -0.647 1.00 96.67 220 B 1 ATOM 2942 C CB . LEU B 2 220 ? -2.088 24.869 -0.571 1.00 97.32 220 B 1 ATOM 2943 C CG . LEU B 2 220 ? -2.156 25.539 0.818 1.00 96.90 220 B 1 ATOM 2944 C CD1 . LEU B 2 220 ? -2.803 26.923 0.759 1.00 95.44 220 B 1 ATOM 2945 C CD2 . LEU B 2 220 ? -2.969 24.658 1.765 1.00 95.27 220 B 1 ATOM 2946 N N . CYS B 2 221 ? 1.041 24.722 -1.104 1.00 97.24 221 B 1 ATOM 2947 C CA . CYS B 2 221 ? 2.421 24.730 -0.627 1.00 97.03 221 B 1 ATOM 2948 C C . CYS B 2 221 ? 3.351 24.020 -1.630 1.00 96.95 221 B 1 ATOM 2949 O O . CYS B 2 221 ? 3.696 22.851 -1.439 1.00 96.19 221 B 1 ATOM 2950 C CB . CYS B 2 221 ? 2.447 24.103 0.773 1.00 96.70 221 B 1 ATOM 2951 S SG . CYS B 2 221 ? 4.092 24.324 1.514 1.00 95.35 221 B 1 ATOM 2952 N N . PRO B 2 222 ? 3.776 24.705 -2.710 1.00 96.84 222 B 1 ATOM 2953 C CA . PRO B 2 222 ? 4.684 24.115 -3.686 1.00 95.98 222 B 1 ATOM 2954 C C . PRO B 2 222 ? 6.016 23.713 -3.043 1.00 95.24 222 B 1 ATOM 2955 O O . PRO B 2 222 ? 6.589 24.480 -2.276 1.00 92.32 222 B 1 ATOM 2956 C CB . PRO B 2 222 ? 4.885 25.184 -4.769 1.00 94.89 222 B 1 ATOM 2957 C CG . PRO B 2 222 ? 3.653 26.079 -4.623 1.00 93.69 222 B 1 ATOM 2958 C CD . PRO B 2 222 ? 3.373 26.036 -3.127 1.00 96.24 222 B 1 ATOM 2959 N N . ASN B 2 223 ? 6.531 22.528 -3.393 1.00 95.84 223 B 1 ATOM 2960 C CA . ASN B 2 223 ? 7.775 21.979 -2.836 1.00 95.50 223 B 1 ATOM 2961 C C . ASN B 2 223 ? 7.771 21.893 -1.295 1.00 96.00 223 B 1 ATOM 2962 O O . ASN B 2 223 ? 8.823 22.004 -0.657 1.00 93.84 223 B 1 ATOM 2963 C CB . ASN B 2 223 ? 8.989 22.747 -3.385 1.00 93.63 223 B 1 ATOM 2964 C CG . ASN B 2 223 ? 9.012 22.838 -4.899 1.00 90.14 223 B 1 ATOM 2965 O OD1 . ASN B 2 223 ? 8.712 21.910 -5.623 1.00 80.43 223 B 1 ATOM 2966 N ND2 . ASN B 2 223 ? 9.364 23.991 -5.432 1.00 78.38 223 B 1 ATOM 2967 N N . GLY B 2 224 ? 6.590 21.732 -0.696 1.00 96.04 224 B 1 ATOM 2968 C CA . GLY B 2 224 ? 6.435 21.577 0.740 1.00 96.47 224 B 1 ATOM 2969 C C . GLY B 2 224 ? 6.852 20.200 1.253 1.00 97.16 224 B 1 ATOM 2970 O O . GLY B 2 224 ? 7.064 19.253 0.492 1.00 96.31 224 B 1 ATOM 2971 N N . ASN B 2 225 ? 6.936 20.101 2.571 1.00 97.38 225 B 1 ATOM 2972 C CA . ASN B 2 225 ? 7.020 18.825 3.271 1.00 97.87 225 B 1 ATOM 2973 C C . ASN B 2 225 ? 5.614 18.390 3.692 1.00 98.26 225 B 1 ATOM 2974 O O . ASN B 2 225 ? 4.956 19.095 4.464 1.00 97.74 225 B 1 ATOM 2975 C CB . ASN B 2 225 ? 7.966 18.951 4.469 1.00 97.46 225 B 1 ATOM 2976 C CG . ASN B 2 225 ? 9.413 19.083 4.039 1.00 96.75 225 B 1 ATOM 2977 O OD1 . ASN B 2 225 ? 9.989 20.150 4.030 1.00 87.30 225 B 1 ATOM 2978 N ND2 . ASN B 2 225 ? 10.053 17.989 3.682 1.00 86.90 225 B 1 ATOM 2979 N N . TYR B 2 226 ? 5.169 17.242 3.201 1.00 98.35 226 B 1 ATOM 2980 C CA . TYR B 2 226 ? 3.808 16.752 3.405 1.00 98.50 226 B 1 ATOM 2981 C C . TYR B 2 226 ? 3.808 15.468 4.234 1.00 98.61 226 B 1 ATOM 2982 O O . TYR B 2 226 ? 4.626 14.572 4.018 1.00 98.22 226 B 1 ATOM 2983 C CB . TYR B 2 226 ? 3.119 16.537 2.055 1.00 98.25 226 B 1 ATOM 2984 C CG . TYR B 2 226 ? 3.328 17.616 1.012 1.00 98.18 226 B 1 ATOM 2985 C CD1 . TYR B 2 226 ? 2.953 18.953 1.264 1.00 96.78 226 B 1 ATOM 2986 C CD2 . TYR B 2 226 ? 3.899 17.279 -0.233 1.00 96.68 226 B 1 ATOM 2987 C CE1 . TYR B 2 226 ? 3.138 19.944 0.278 1.00 96.00 226 B 1 ATOM 2988 C CE2 . TYR B 2 226 ? 4.084 18.260 -1.223 1.00 96.08 226 B 1 ATOM 2989 C CZ . TYR B 2 226 ? 3.699 19.591 -0.968 1.00 96.60 226 B 1 ATOM 2990 O OH . TYR B 2 226 ? 3.872 20.537 -1.940 1.00 95.14 226 B 1 ATOM 2991 N N . LEU B 2 227 ? 2.862 15.357 5.149 1.00 98.70 227 B 1 ATOM 2992 C CA . LEU B 2 227 ? 2.620 14.158 5.947 1.00 98.81 227 B 1 ATOM 2993 C C . LEU B 2 227 ? 1.176 13.701 5.766 1.00 98.87 227 B 1 ATOM 2994 O O . LEU B 2 227 ? 0.247 14.461 6.028 1.00 98.72 227 B 1 ATOM 2995 C CB . LEU B 2 227 ? 2.944 14.469 7.417 1.00 98.68 227 B 1 ATOM 2996 C CG . LEU B 2 227 ? 2.621 13.331 8.407 1.00 98.32 227 B 1 ATOM 2997 C CD1 . LEU B 2 227 ? 3.494 12.099 8.184 1.00 97.44 227 B 1 ATOM 2998 C CD2 . LEU B 2 227 ? 2.858 13.813 9.835 1.00 97.26 227 B 1 ATOM 2999 N N . GLU B 2 228 ? 0.975 12.441 5.404 1.00 98.83 228 B 1 ATOM 3000 C CA . GLU B 2 228 ? -0.335 11.799 5.428 1.00 98.83 228 B 1 ATOM 3001 C C . GLU B 2 228 ? -0.389 10.739 6.528 1.00 98.83 228 B 1 ATOM 3002 O O . GLU B 2 228 ? 0.458 9.848 6.611 1.00 98.52 228 B 1 ATOM 3003 C CB . GLU B 2 228 ? -0.688 11.234 4.045 1.00 98.64 228 B 1 ATOM 3004 C CG . GLU B 2 228 ? -2.123 10.678 4.022 1.00 98.04 228 B 1 ATOM 3005 C CD . GLU B 2 228 ? -2.614 10.279 2.622 1.00 97.94 228 B 1 ATOM 3006 O OE1 . GLU B 2 228 ? -3.835 10.023 2.483 1.00 94.88 228 B 1 ATOM 3007 O OE2 . GLU B 2 228 ? -1.804 10.220 1.674 1.00 95.95 228 B 1 ATOM 3008 N N . ILE B 2 229 ? -1.413 10.804 7.363 1.00 98.78 229 B 1 ATOM 3009 C CA . ILE B 2 229 ? -1.688 9.812 8.401 1.00 98.75 229 B 1 ATOM 3010 C C . ILE B 2 229 ? -2.925 9.003 7.997 1.00 98.70 229 B 1 ATOM 3011 O O . ILE B 2 229 ? -3.902 9.551 7.495 1.00 98.28 229 B 1 ATOM 3012 C CB . ILE B 2 229 ? -1.823 10.474 9.792 1.00 98.61 229 B 1 ATOM 3013 C CG1 . ILE B 2 229 ? -0.626 11.413 10.082 1.00 97.91 229 B 1 ATOM 3014 C CG2 . ILE B 2 229 ? -1.930 9.381 10.872 1.00 98.06 229 B 1 ATOM 3015 C CD1 . ILE B 2 229 ? -0.693 12.125 11.439 1.00 96.23 229 B 1 ATOM 3016 N N . PHE B 2 230 ? -2.882 7.694 8.237 1.00 98.54 230 B 1 ATOM 3017 C CA . PHE B 2 230 ? -3.883 6.723 7.784 1.00 98.38 230 B 1 ATOM 3018 C C . PHE B 2 230 ? -3.873 6.482 6.270 1.00 98.02 230 B 1 ATOM 3019 O O . PHE B 2 230 ? -4.901 6.172 5.661 1.00 97.00 230 B 1 ATOM 3020 C CB . PHE B 2 230 ? -5.271 7.057 8.354 1.00 98.25 230 B 1 ATOM 3021 C CG . PHE B 2 230 ? -5.285 7.328 9.841 1.00 98.37 230 B 1 ATOM 3022 C CD1 . PHE B 2 230 ? -4.954 6.301 10.742 1.00 97.92 230 B 1 ATOM 3023 C CD2 . PHE B 2 230 ? -5.617 8.604 10.331 1.00 97.96 230 B 1 ATOM 3024 C CE1 . PHE B 2 230 ? -4.967 6.538 12.125 1.00 97.72 230 B 1 ATOM 3025 C CE2 . PHE B 2 230 ? -5.639 8.844 11.717 1.00 97.66 230 B 1 ATOM 3026 C CZ . PHE B 2 230 ? -5.315 7.810 12.615 1.00 97.78 230 B 1 ATOM 3027 N N . ALA B 2 231 ? -2.690 6.582 5.677 1.00 98.19 231 B 1 ATOM 3028 C CA . ALA B 2 231 ? -2.474 6.278 4.275 1.00 97.99 231 B 1 ATOM 3029 C C . ALA B 2 231 ? -2.576 4.772 3.985 1.00 97.45 231 B 1 ATOM 3030 O O . ALA B 2 231 ? -2.260 3.908 4.809 1.00 96.06 231 B 1 ATOM 3031 C CB . ALA B 2 231 ? -1.110 6.826 3.852 1.00 97.74 231 B 1 ATOM 3032 N N . ARG B 2 232 ? -2.958 4.477 2.747 1.00 97.31 232 B 1 ATOM 3033 C CA . ARG B 2 232 ? -2.849 3.162 2.115 1.00 96.93 232 B 1 ATOM 3034 C C . ARG B 2 232 ? -1.902 3.254 0.922 1.00 97.19 232 B 1 ATOM 3035 O O . ARG B 2 232 ? -1.520 4.347 0.516 1.00 96.59 232 B 1 ATOM 3036 C CB . ARG B 2 232 ? -4.242 2.673 1.702 1.00 95.53 232 B 1 ATOM 3037 C CG . ARG B 2 232 ? -5.202 2.565 2.899 1.00 92.96 232 B 1 ATOM 3038 C CD . ARG B 2 232 ? -6.560 2.007 2.461 1.00 90.66 232 B 1 ATOM 3039 N NE . ARG B 2 232 ? -7.185 2.868 1.451 1.00 86.31 232 B 1 ATOM 3040 C CZ . ARG B 2 232 ? -8.417 2.773 0.983 1.00 85.60 232 B 1 ATOM 3041 N NH1 . ARG B 2 232 ? -9.253 1.876 1.422 1.00 77.76 232 B 1 ATOM 3042 N NH2 . ARG B 2 232 ? -8.816 3.588 0.055 1.00 78.67 232 B 1 ATOM 3043 N N . ARG B 2 233 ? -1.585 2.128 0.308 1.00 96.85 233 B 1 ATOM 3044 C CA . ARG B 2 233 ? -0.672 2.090 -0.855 1.00 96.59 233 B 1 ATOM 3045 C C . ARG B 2 233 ? -1.086 3.019 -2.006 1.00 96.85 233 B 1 ATOM 3046 O O . ARG B 2 233 ? -0.232 3.575 -2.674 1.00 95.65 233 B 1 ATOM 3047 C CB . ARG B 2 233 ? -0.553 0.651 -1.372 1.00 95.57 233 B 1 ATOM 3048 C CG . ARG B 2 233 ? 0.189 -0.247 -0.374 1.00 94.14 233 B 1 ATOM 3049 C CD . ARG B 2 233 ? 0.350 -1.643 -0.954 1.00 92.64 233 B 1 ATOM 3050 N NE . ARG B 2 233 ? 1.150 -2.487 -0.048 1.00 91.54 233 B 1 ATOM 3051 C CZ . ARG B 2 233 ? 1.682 -3.656 -0.348 1.00 91.14 233 B 1 ATOM 3052 N NH1 . ARG B 2 233 ? 1.464 -4.254 -1.484 1.00 87.57 233 B 1 ATOM 3053 N NH2 . ARG B 2 233 ? 2.470 -4.236 0.504 1.00 87.20 233 B 1 ATOM 3054 N N . ASN B 2 234 ? -2.390 3.201 -2.230 1.00 96.71 234 B 1 ATOM 3055 C CA . ASN B 2 234 ? -2.902 4.108 -3.261 1.00 96.62 234 B 1 ATOM 3056 C C . ASN B 2 234 ? -2.794 5.604 -2.894 1.00 97.40 234 B 1 ATOM 3057 O O . ASN B 2 234 ? -3.126 6.436 -3.735 1.00 96.98 234 B 1 ATOM 3058 C CB . ASN B 2 234 ? -4.359 3.723 -3.589 1.00 95.58 234 B 1 ATOM 3059 C CG . ASN B 2 234 ? -5.278 3.916 -2.392 1.00 93.87 234 B 1 ATOM 3060 O OD1 . ASN B 2 234 ? -5.592 2.982 -1.665 1.00 86.78 234 B 1 ATOM 3061 N ND2 . ASN B 2 234 ? -5.744 5.120 -2.143 1.00 86.76 234 B 1 ATOM 3062 N N . ASN B 2 235 ? -2.402 5.930 -1.666 1.00 97.64 235 B 1 ATOM 3063 C CA . ASN B 2 235 ? -2.169 7.298 -1.212 1.00 98.00 235 B 1 ATOM 3064 C C . ASN B 2 235 ? -0.693 7.701 -1.311 1.00 98.28 235 B 1 ATOM 3065 O O . ASN B 2 235 ? -0.371 8.861 -1.093 1.00 97.88 235 B 1 ATOM 3066 C CB . ASN B 2 235 ? -2.652 7.452 0.242 1.00 97.76 235 B 1 ATOM 3067 C CG . ASN B 2 235 ? -4.135 7.172 0.413 1.00 97.36 235 B 1 ATOM 3068 O OD1 . ASN B 2 235 ? -4.557 6.185 1.004 1.00 90.22 235 B 1 ATOM 3069 N ND2 . ASN B 2 235 ? -4.975 8.039 -0.100 1.00 90.00 235 B 1 ATOM 3070 N N . LEU B 2 236 ? 0.204 6.765 -1.615 1.00 98.17 236 B 1 ATOM 3071 C CA . LEU B 2 236 ? 1.629 7.056 -1.701 1.00 98.22 236 B 1 ATOM 3072 C C . LEU B 2 236 ? 1.896 7.981 -2.893 1.00 98.22 236 B 1 ATOM 3073 O O . LEU B 2 236 ? 1.574 7.641 -4.027 1.00 97.52 236 B 1 ATOM 3074 C CB . LEU B 2 236 ? 2.431 5.749 -1.780 1.00 97.95 236 B 1 ATOM 3075 C CG . LEU B 2 236 ? 2.256 4.821 -0.561 1.00 97.39 236 B 1 ATOM 3076 C CD1 . LEU B 2 236 ? 3.043 3.528 -0.762 1.00 96.73 236 B 1 ATOM 3077 C CD2 . LEU B 2 236 ? 2.732 5.467 0.738 1.00 96.36 236 B 1 ATOM 3078 N N . HIS B 2 237 ? 2.496 9.145 -2.605 1.00 98.48 237 B 1 ATOM 3079 C CA . HIS B 2 237 ? 2.851 10.173 -3.581 1.00 98.50 237 B 1 ATOM 3080 C C . HIS B 2 237 ? 4.296 10.620 -3.356 1.00 98.53 237 B 1 ATOM 3081 O O . HIS B 2 237 ? 4.838 10.484 -2.253 1.00 98.04 237 B 1 ATOM 3082 C CB . HIS B 2 237 ? 1.891 11.367 -3.474 1.00 98.26 237 B 1 ATOM 3083 C CG . HIS B 2 237 ? 0.512 11.084 -3.998 1.00 97.89 237 B 1 ATOM 3084 N ND1 . HIS B 2 237 ? -0.449 10.309 -3.369 1.00 87.15 237 B 1 ATOM 3085 C CD2 . HIS B 2 237 ? -0.015 11.507 -5.187 1.00 89.67 237 B 1 ATOM 3086 C CE1 . HIS B 2 237 ? -1.517 10.255 -4.171 1.00 90.99 237 B 1 ATOM 3087 N NE2 . HIS B 2 237 ? -1.298 10.977 -5.274 1.00 93.42 237 B 1 ATOM 3088 N N . ASP B 2 238 ? 4.909 11.161 -4.407 1.00 97.83 238 B 1 ATOM 3089 C CA . ASP B 2 238 ? 6.240 11.743 -4.295 1.00 97.57 238 B 1 ATOM 3090 C C . ASP B 2 238 ? 6.271 12.863 -3.245 1.00 97.56 238 B 1 ATOM 3091 O O . ASP B 2 238 ? 5.379 13.710 -3.168 1.00 96.49 238 B 1 ATOM 3092 C CB . ASP B 2 238 ? 6.722 12.264 -5.655 1.00 96.89 238 B 1 ATOM 3093 C CG . ASP B 2 238 ? 7.234 11.147 -6.572 1.00 96.14 238 B 1 ATOM 3094 O OD1 . ASP B 2 238 ? 7.824 10.173 -6.048 1.00 93.43 238 B 1 ATOM 3095 O OD2 . ASP B 2 238 ? 7.068 11.277 -7.800 1.00 93.27 238 B 1 ATOM 3096 N N . ASN B 2 239 ? 7.327 12.848 -2.438 1.00 97.20 239 B 1 ATOM 3097 C CA . ASN B 2 239 ? 7.606 13.820 -1.373 1.00 97.03 239 B 1 ATOM 3098 C C . ASN B 2 239 ? 6.651 13.758 -0.167 1.00 97.54 239 B 1 ATOM 3099 O O . ASN B 2 239 ? 6.801 14.550 0.764 1.00 96.51 239 B 1 ATOM 3100 C CB . ASN B 2 239 ? 7.733 15.236 -1.963 1.00 95.59 239 B 1 ATOM 3101 C CG . ASN B 2 239 ? 8.532 15.279 -3.260 1.00 93.73 239 B 1 ATOM 3102 O OD1 . ASN B 2 239 ? 9.488 14.549 -3.472 1.00 86.02 239 B 1 ATOM 3103 N ND2 . ASN B 2 239 ? 8.149 16.128 -4.182 1.00 84.71 239 B 1 ATOM 3104 N N . TRP B 2 240 ? 5.725 12.805 -0.143 1.00 98.49 240 B 1 ATOM 3105 C CA . TRP B 2 240 ? 4.845 12.560 0.997 1.00 98.67 240 B 1 ATOM 3106 C C . TRP B 2 240 ? 5.438 11.513 1.937 1.00 98.67 240 B 1 ATOM 3107 O O . TRP B 2 240 ? 5.725 10.379 1.528 1.00 98.30 240 B 1 ATOM 3108 C CB . TRP B 2 240 ? 3.453 12.146 0.522 1.00 98.63 240 B 1 ATOM 3109 C CG . TRP B 2 240 ? 2.603 13.273 0.011 1.00 98.63 240 B 1 ATOM 3110 C CD1 . TRP B 2 240 ? 2.709 13.866 -1.201 1.00 98.25 240 B 1 ATOM 3111 C CD2 . TRP B 2 240 ? 1.516 13.961 0.707 1.00 98.52 240 B 1 ATOM 3112 N NE1 . TRP B 2 240 ? 1.759 14.883 -1.307 1.00 98.15 240 B 1 ATOM 3113 C CE2 . TRP B 2 240 ? 1.008 14.970 -0.154 1.00 98.33 240 B 1 ATOM 3114 C CE3 . TRP B 2 240 ? 0.923 13.820 1.979 1.00 98.37 240 B 1 ATOM 3115 C CZ2 . TRP B 2 240 ? -0.052 15.821 0.232 1.00 97.98 240 B 1 ATOM 3116 C CZ3 . TRP B 2 240 ? -0.137 14.663 2.365 1.00 97.80 240 B 1 ATOM 3117 C CH2 . TRP B 2 240 ? -0.610 15.656 1.499 1.00 97.64 240 B 1 ATOM 3118 N N . VAL B 2 241 ? 5.534 11.854 3.214 1.00 98.73 241 B 1 ATOM 3119 C CA . VAL B 2 241 ? 5.663 10.868 4.290 1.00 98.73 241 B 1 ATOM 3120 C C . VAL B 2 241 ? 4.269 10.319 4.573 1.00 98.78 241 B 1 ATOM 3121 O O . VAL B 2 241 ? 3.358 11.079 4.881 1.00 98.58 241 B 1 ATOM 3122 C CB . VAL B 2 241 ? 6.278 11.479 5.555 1.00 98.53 241 B 1 ATOM 3123 C CG1 . VAL B 2 241 ? 6.429 10.429 6.659 1.00 97.76 241 B 1 ATOM 3124 C CG2 . VAL B 2 241 ? 7.668 12.056 5.272 1.00 97.87 241 B 1 ATOM 3125 N N . SER B 2 242 ? 4.090 9.016 4.463 1.00 98.72 242 B 1 ATOM 3126 C CA . SER B 2 242 ? 2.773 8.385 4.549 1.00 98.66 242 B 1 ATOM 3127 C C . SER B 2 242 ? 2.769 7.277 5.594 1.00 98.59 242 B 1 ATOM 3128 O O . SER B 2 242 ? 3.505 6.300 5.471 1.00 98.01 242 B 1 ATOM 3129 C CB . SER B 2 242 ? 2.369 7.840 3.181 1.00 98.40 242 B 1 ATOM 3130 O OG . SER B 2 242 ? 2.282 8.878 2.223 1.00 96.10 242 B 1 ATOM 3131 N N . ILE B 2 243 ? 1.935 7.401 6.614 1.00 98.59 243 B 1 ATOM 3132 C CA . ILE B 2 243 ? 1.838 6.454 7.726 1.00 98.59 243 B 1 ATOM 3133 C C . ILE B 2 243 ? 0.530 5.675 7.617 1.00 98.51 243 B 1 ATOM 3134 O O . ILE B 2 243 ? -0.550 6.261 7.568 1.00 98.06 243 B 1 ATOM 3135 C CB . ILE B 2 243 ? 1.952 7.169 9.087 1.00 98.52 243 B 1 ATOM 3136 C CG1 . ILE B 2 243 ? 3.230 8.035 9.179 1.00 97.91 243 B 1 ATOM 3137 C CG2 . ILE B 2 243 ? 1.917 6.131 10.228 1.00 97.95 243 B 1 ATOM 3138 C CD1 . ILE B 2 243 ? 3.247 8.979 10.385 1.00 96.60 243 B 1 ATOM 3139 N N . GLY B 2 244 ? 0.607 4.354 7.649 1.00 97.72 244 B 1 ATOM 3140 C CA . GLY B 2 244 ? -0.584 3.507 7.685 1.00 97.43 244 B 1 ATOM 3141 C C . GLY B 2 244 ? -0.269 2.081 8.106 1.00 97.09 244 B 1 ATOM 3142 O O . GLY B 2 244 ? 0.803 1.555 7.820 1.00 95.86 244 B 1 ATOM 3143 N N . ASN B 2 245 ? -1.218 1.427 8.772 1.00 96.56 245 B 1 ATOM 3144 C CA . ASN B 2 245 ? -1.050 0.038 9.214 1.00 95.70 245 B 1 ATOM 3145 C C . ASN B 2 245 ? -1.289 -0.998 8.102 1.00 95.08 245 B 1 ATOM 3146 O O . ASN B 2 245 ? -1.114 -2.186 8.346 1.00 92.33 245 B 1 ATOM 3147 C CB . ASN B 2 245 ? -1.933 -0.232 10.452 1.00 94.63 245 B 1 ATOM 3148 C CG . ASN B 2 245 ? -3.415 -0.332 10.137 1.00 95.03 245 B 1 ATOM 3149 O OD1 . ASN B 2 245 ? -3.901 0.201 9.153 1.00 89.70 245 B 1 ATOM 3150 N ND2 . ASN B 2 245 ? -4.179 -1.021 10.963 1.00 89.18 245 B 1 ATOM 3151 N N . GLU B 2 246 ? -1.675 -0.568 6.896 1.00 94.73 246 B 1 ATOM 3152 C CA . GLU B 2 246 ? -1.921 -1.425 5.718 1.00 93.85 246 B 1 ATOM 3153 C C . GLU B 2 246 ? -0.881 -1.248 4.596 1.00 94.96 246 B 1 ATOM 3154 O O . GLU B 2 246 ? -1.028 -1.839 3.526 1.00 92.74 246 B 1 ATOM 3155 C CB . GLU B 2 246 ? -3.336 -1.178 5.162 1.00 90.66 246 B 1 ATOM 3156 C CG . GLU B 2 246 ? -4.468 -1.529 6.138 1.00 85.81 246 B 1 ATOM 3157 C CD . GLU B 2 246 ? -5.851 -1.361 5.483 1.00 80.12 246 B 1 ATOM 3158 O OE1 . GLU B 2 246 ? -6.731 -2.210 5.735 1.00 71.83 246 B 1 ATOM 3159 O OE2 . GLU B 2 246 ? -6.045 -0.393 4.701 1.00 71.47 246 B 1 ATOM 3160 N N . LEU B 2 247 ? 0.167 -0.444 4.833 1.00 96.06 247 B 1 ATOM 3161 C CA . LEU B 2 247 ? 1.214 -0.182 3.849 1.00 96.31 247 B 1 ATOM 3162 C C . LEU B 2 247 ? 2.096 -1.404 3.584 1.00 94.86 247 B 1 ATOM 3163 O O . LEU B 2 247 ? 2.314 -2.233 4.488 1.00 89.71 247 B 1 ATOM 3164 C CB . LEU B 2 247 ? 2.020 1.075 4.235 1.00 95.91 247 B 1 ATOM 3165 C CG . LEU B 2 247 ? 1.217 2.392 4.115 1.00 96.73 247 B 1 ATOM 3166 C CD1 . LEU B 2 247 ? 2.083 3.560 4.583 1.00 95.01 247 B 1 ATOM 3167 C CD2 . LEU B 2 247 ? 0.774 2.677 2.671 1.00 94.37 247 B 1 ATOM 3168 O OXT . LEU B 2 247 ? 2.514 -1.546 2.406 1.00 92.92 247 B 1 HETATM 3169 N N . SAM C 3 . ? -7.378 7.996 2.565 1.00 95.78 1 C 1 HETATM 3170 C CA . SAM C 3 . ? -7.356 6.585 2.169 1.00 96.59 1 C 1 HETATM 3171 C C . SAM C 3 . ? -7.640 6.456 0.687 1.00 96.44 1 C 1 HETATM 3172 O O . SAM C 3 . ? -7.815 7.470 0.010 1.00 94.19 1 C 1 HETATM 3173 O OXT . SAM C 3 . ? -7.636 5.326 0.173 1.00 92.21 1 C 1 HETATM 3174 C CB . SAM C 3 . ? -8.325 5.751 2.991 1.00 95.79 1 C 1 HETATM 3175 C CG . SAM C 3 . ? -7.907 5.656 4.449 1.00 95.60 1 C 1 HETATM 3176 S SD . SAM C 3 . ? -8.978 4.533 5.389 1.00 95.75 1 C 1 HETATM 3177 C CE . SAM C 3 . ? -10.394 5.580 5.694 1.00 94.64 1 C 1 HETATM 3178 C "C5'" . SAM C 3 . ? -8.199 4.544 7.003 1.00 96.10 1 C 1 HETATM 3179 C "C4'" . SAM C 3 . ? -6.902 3.768 7.028 1.00 96.99 1 C 1 HETATM 3180 O "O4'" . SAM C 3 . ? -6.366 3.820 8.350 1.00 97.06 1 C 1 HETATM 3181 C "C3'" . SAM C 3 . ? -7.038 2.283 6.688 1.00 96.07 1 C 1 HETATM 3182 O "O3'" . SAM C 3 . ? -6.115 1.972 5.650 1.00 95.05 1 C 1 HETATM 3183 C "C2'" . SAM C 3 . ? -6.653 1.561 7.964 1.00 96.04 1 C 1 HETATM 3184 O "O2'" . SAM C 3 . ? -5.991 0.337 7.721 1.00 94.88 1 C 1 HETATM 3185 C "C1'" . SAM C 3 . ? -5.742 2.572 8.608 1.00 97.04 1 C 1 HETATM 3186 N N9 . SAM C 3 . ? -5.606 2.388 10.043 1.00 97.24 1 C 1 HETATM 3187 C C8 . SAM C 3 . ? -6.527 1.919 10.908 1.00 96.80 1 C 1 HETATM 3188 N N7 . SAM C 3 . ? -6.053 1.890 12.148 1.00 96.91 1 C 1 HETATM 3189 C C5 . SAM C 3 . ? -4.774 2.336 12.077 1.00 97.46 1 C 1 HETATM 3190 C C6 . SAM C 3 . ? -3.730 2.523 13.020 1.00 97.53 1 C 1 HETATM 3191 N N6 . SAM C 3 . ? -3.917 2.240 14.317 1.00 97.00 1 C 1 HETATM 3192 N N1 . SAM C 3 . ? -2.532 2.992 12.602 1.00 97.33 1 C 1 HETATM 3193 C C2 . SAM C 3 . ? -2.334 3.275 11.290 1.00 97.38 1 C 1 HETATM 3194 N N3 . SAM C 3 . ? -3.277 3.110 10.347 1.00 97.42 1 C 1 HETATM 3195 C C4 . SAM C 3 . ? -4.482 2.655 10.730 1.00 97.44 1 C 1 #