# 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_7f4q # _entry.id 7f4q # 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" "C14 H20 N6 O5 S" 384.411 SAH . S-ADENOSYL-L-HOMOCYSTEINE c1nc(c2c(n1)n(cn2)[C@H]3[C@@H]([C@@H]([C@H](O3)CSCC[C@@H](C(=O)O)N)O)O)N ? 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 03:25:47)" _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 88.77 _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 35.82 1 1 A LYS 2 2 33.54 1 2 A LYS 3 2 32.12 1 3 A ASN 4 2 33.51 1 4 A GLY 5 2 38.65 1 5 A LYS 6 2 35.25 1 6 A SER 7 2 46.84 1 7 A GLN 8 2 41.86 1 8 A ASN 9 2 53.96 1 9 A GLN 10 2 58.85 1 10 A PRO 11 2 79.61 1 11 A LEU 12 2 90.38 1 12 A ASP 13 2 93.07 1 13 A PHE 14 2 92.38 1 14 A THR 15 2 94.30 1 15 A GLN 16 2 91.56 1 16 A TYR 17 2 97.69 1 17 A ALA 18 2 98.00 1 18 A LYS 19 2 93.65 1 19 A ASN 20 2 96.09 1 20 A MET 21 2 97.22 1 21 A ARG 22 2 95.32 1 22 A LYS 23 2 91.75 1 23 A ASP 24 2 95.40 1 24 A LEU 25 2 96.16 1 25 A SER 26 2 93.24 1 26 A ASN 27 2 84.34 1 27 A GLN 28 2 78.64 1 28 A ASP 29 2 91.79 1 29 A ILE 30 2 95.02 1 30 A CYS 31 2 94.68 1 31 A LEU 32 2 92.34 1 32 A GLU 33 2 83.07 1 33 A ASP 34 2 91.53 1 34 A GLY 35 2 96.01 1 35 A ALA 36 2 95.78 1 36 A LEU 37 2 94.11 1 37 A ASN 38 2 94.55 1 38 A HIS 39 2 93.68 1 39 A SER 40 2 92.56 1 40 A TYR 41 2 95.69 1 41 A PHE 42 2 95.56 1 42 A LEU 43 2 93.16 1 43 A THR 44 2 88.17 1 44 A LYS 45 2 79.27 1 45 A LYS 46 2 77.76 1 46 A GLY 47 2 85.59 1 47 A GLN 48 2 82.71 1 48 A TYR 49 2 93.11 1 49 A TRP 50 2 96.10 1 50 A THR 51 2 94.19 1 51 A PRO 52 2 94.10 1 52 A LEU 53 2 91.12 1 53 A ASN 54 2 95.14 1 54 A GLN 55 2 95.76 1 55 A LYS 56 2 88.19 1 56 A ALA 57 2 98.48 1 57 A LEU 58 2 98.46 1 58 A GLN 59 2 96.56 1 59 A ARG 60 2 88.79 1 60 A GLY 61 2 98.62 1 61 A ILE 62 2 98.09 1 62 A GLU 63 2 95.77 1 63 A LEU 64 2 96.21 1 64 A PHE 65 2 97.67 1 65 A GLY 66 2 98.17 1 66 A VAL 67 2 97.75 1 67 A GLY 68 2 97.22 1 68 A ASN 69 2 95.39 1 69 A TRP 70 2 96.79 1 70 A LYS 71 2 87.60 1 71 A GLU 72 2 91.27 1 72 A ILE 73 2 98.23 1 73 A ASN 74 2 97.14 1 74 A TYR 75 2 86.07 1 75 A ASP 76 2 93.41 1 76 A GLU 77 2 94.65 1 77 A PHE 78 2 97.29 1 78 A SER 79 2 95.39 1 79 A GLY 80 2 96.36 1 80 A LYS 81 2 86.74 1 81 A ALA 82 2 95.30 1 82 A ASN 83 2 90.93 1 83 A ILE 84 2 88.97 1 84 A VAL 85 2 92.01 1 85 A GLU 86 2 93.82 1 86 A LEU 87 2 97.17 1 87 A GLU 88 2 89.67 1 88 A LEU 89 2 94.78 1 89 A ARG 90 2 94.21 1 90 A THR 91 2 97.77 1 91 A CYS 92 2 97.48 1 92 A MET 93 2 93.40 1 93 A ILE 94 2 98.00 1 94 A LEU 95 2 98.06 1 95 A GLY 96 2 97.60 1 96 A ILE 97 2 95.97 1 97 A ASN 98 2 92.25 1 98 A ASP 99 2 91.48 1 99 A ILE 100 2 94.85 1 100 A THR 101 2 90.98 1 101 A GLU 102 2 87.77 1 102 A TYR 103 2 97.36 1 103 A TYR 104 2 90.64 1 104 A GLY 105 2 97.14 1 105 A LYS 106 2 92.27 1 106 A LYS 107 2 96.72 1 107 A ILE 108 2 97.91 1 108 A SER 109 2 98.08 1 109 A GLU 110 2 90.24 1 110 A GLU 111 2 87.49 1 111 A GLU 112 2 87.32 1 112 A GLN 113 2 97.65 1 113 A GLU 114 2 85.40 1 114 A GLU 115 2 88.04 1 115 A ILE 116 2 97.98 1 116 A LYS 117 2 95.38 1 117 A LYS 118 2 91.13 1 118 A SER 119 2 95.71 1 119 A ASN 120 2 97.35 1 120 A ILE 121 2 95.99 1 121 A ALA 122 2 97.84 1 122 A LYS 123 2 88.87 1 123 A GLY 124 2 97.03 1 124 A LYS 125 2 89.97 1 125 A LYS 126 2 87.93 1 126 A GLU 127 2 92.78 1 127 A ASN 128 2 89.90 1 128 A LYS 129 2 90.39 1 129 A LEU 130 2 93.95 1 130 A LYS 131 2 87.13 1 131 A ASP 132 2 94.09 1 132 A ASN 133 2 90.09 1 133 A ILE 134 2 94.05 1 134 A TYR 135 2 95.42 1 135 A GLN 136 2 89.62 1 136 A LYS 137 2 77.30 1 137 A LEU 138 2 67.17 1 138 A GLN 139 2 55.59 1 139 A GLN 140 2 41.97 1 140 A MET 141 2 41.53 1 141 A GLN 142 2 28.84 1 142 B ASP 1 2 54.22 1 143 B ASP 2 2 62.00 1 144 B TYR 3 2 65.66 1 145 B LEU 4 2 77.73 1 146 B ASP 5 2 75.25 1 147 B ARG 6 2 68.28 1 148 B LEU 7 2 82.07 1 149 B PRO 8 2 81.32 1 150 B LYS 9 2 74.06 1 151 B SER 10 2 84.55 1 152 B LYS 11 2 81.07 1 153 B LYS 12 2 80.13 1 154 B GLY 13 2 91.05 1 155 B LEU 14 2 88.73 1 156 B GLN 15 2 84.77 1 157 B GLY 16 2 91.56 1 158 B LEU 17 2 89.87 1 159 B LEU 18 2 87.39 1 160 B GLN 19 2 85.52 1 161 B ASP 20 2 87.54 1 162 B ILE 21 2 89.48 1 163 B GLU 22 2 85.49 1 164 B LYS 23 2 84.05 1 165 B ARG 24 2 78.27 1 166 B ILE 25 2 86.87 1 167 B LEU 26 2 84.80 1 168 B HIS 27 2 86.35 1 169 B TYR 28 2 81.26 1 170 B LYS 29 2 88.95 1 171 B GLN 30 2 85.66 1 172 B LEU 31 2 90.84 1 173 B PHE 32 2 94.54 1 174 B PHE 33 2 95.42 1 175 B LYS 34 2 90.49 1 176 B GLU 35 2 86.84 1 177 B GLN 36 2 92.27 1 178 B ASN 37 2 92.13 1 179 B GLU 38 2 92.37 1 180 B ILE 39 2 91.37 1 181 B ALA 40 2 91.92 1 182 B ASN 41 2 88.84 1 183 B GLY 42 2 92.41 1 184 B LYS 43 2 90.74 1 185 B ARG 44 2 83.01 1 186 B SER 45 2 95.52 1 187 B MET 46 2 88.08 1 188 B VAL 47 2 96.05 1 189 B PRO 48 2 97.14 1 190 B ASP 49 2 93.12 1 191 B ASN 50 2 94.57 1 192 B SER 51 2 97.12 1 193 B ILE 52 2 97.62 1 194 B PRO 53 2 97.67 1 195 B ILE 54 2 97.27 1 196 B CYS 55 2 95.63 1 197 B SER 56 2 94.78 1 198 B ASP 57 2 94.85 1 199 B VAL 58 2 95.70 1 200 B THR 59 2 93.69 1 201 B LYS 60 2 88.80 1 202 B LEU 61 2 95.53 1 203 B ASN 62 2 93.96 1 204 B PHE 63 2 97.09 1 205 B GLN 64 2 93.63 1 206 B ALA 65 2 97.49 1 207 B LEU 66 2 97.36 1 208 B ILE 67 2 96.75 1 209 B ASP 68 2 96.26 1 210 B ALA 69 2 97.90 1 211 B GLN 70 2 96.47 1 212 B MET 71 2 93.61 1 213 B ARG 72 2 86.83 1 214 B HIS 73 2 94.29 1 215 B ALA 74 2 95.95 1 216 B GLY 75 2 95.24 1 217 B LYS 76 2 90.62 1 218 B MET 77 2 92.99 1 219 B PHE 78 2 97.83 1 220 B ASP 79 2 96.45 1 221 B VAL 80 2 97.85 1 222 B ILE 81 2 98.20 1 223 B MET 82 2 96.57 1 224 B MET 83 2 93.48 1 225 B ASP 84 2 96.66 1 226 B PRO 85 2 97.18 1 227 B PRO 86 2 96.13 1 228 B TRP 87 2 95.29 1 229 B GLN 88 2 85.94 1 230 B LEU 89 2 79.66 1 231 B SER 90 2 69.66 1 232 B SER 91 2 60.39 1 233 B SER 92 2 53.15 1 234 B GLN 93 2 44.55 1 235 B PRO 94 2 49.86 1 236 B SER 95 2 49.64 1 237 B ARG 96 2 38.66 1 238 B GLY 97 2 55.16 1 239 B VAL 98 2 55.80 1 240 B ALA 99 2 61.27 1 241 B ILE 100 2 62.62 1 242 B ALA 101 2 68.43 1 243 B TYR 102 2 74.93 1 244 B ASP 103 2 82.34 1 245 B SER 104 2 91.29 1 246 B LEU 105 2 94.78 1 247 B SER 106 2 95.06 1 248 B ASP 107 2 95.20 1 249 B GLU 108 2 86.38 1 250 B LYS 109 2 91.49 1 251 B ILE 110 2 96.70 1 252 B GLN 111 2 91.01 1 253 B ASN 112 2 91.69 1 254 B MET 113 2 95.99 1 255 B PRO 114 2 97.24 1 256 B ILE 115 2 96.85 1 257 B GLN 116 2 90.02 1 258 B SER 117 2 95.41 1 259 B LEU 118 2 96.63 1 260 B GLN 119 2 95.89 1 261 B GLN 120 2 86.46 1 262 B ASP 121 2 95.19 1 263 B GLY 122 2 97.71 1 264 B PHE 123 2 97.43 1 265 B ILE 124 2 97.68 1 266 B PHE 125 2 97.72 1 267 B VAL 126 2 98.09 1 268 B TRP 127 2 97.88 1 269 B ALA 128 2 95.70 1 270 B ILE 129 2 90.47 1 271 B ASN 130 2 87.41 1 272 B ALA 131 2 92.25 1 273 B LYS 132 2 93.22 1 274 B TYR 133 2 94.26 1 275 B ARG 134 2 81.86 1 276 B VAL 135 2 93.47 1 277 B THR 136 2 96.57 1 278 B ILE 137 2 96.53 1 279 B LYS 138 2 85.63 1 280 B MET 139 2 94.38 1 281 B ILE 140 2 95.55 1 282 B GLU 141 2 95.70 1 283 B ASN 142 2 94.19 1 284 B TRP 143 2 97.33 1 285 B GLY 144 2 97.34 1 286 B TYR 145 2 97.82 1 287 B LYS 146 2 88.07 1 288 B LEU 147 2 93.83 1 289 B VAL 148 2 94.67 1 290 B ASP 149 2 93.86 1 291 B GLU 150 2 93.69 1 292 B ILE 151 2 95.77 1 293 B THR 152 2 95.64 1 294 B TRP 153 2 96.38 1 295 B VAL 154 2 95.32 1 296 B LYS 155 2 90.13 1 297 B LYS 156 2 90.23 1 298 B THR 157 2 90.60 1 299 B VAL 158 2 87.90 1 300 B ASN 159 2 87.08 1 301 B GLY 160 2 90.89 1 302 B LYS 161 2 83.91 1 303 B ILE 162 2 88.82 1 304 B ALA 163 2 88.38 1 305 B LYS 164 2 74.78 1 306 B GLY 165 2 84.04 1 307 B HIS 166 2 74.03 1 308 B GLY 167 2 84.77 1 309 B PHE 168 2 76.38 1 310 B TYR 169 2 86.09 1 311 B LEU 170 2 89.66 1 312 B GLN 171 2 84.14 1 313 B HIS 172 2 84.94 1 314 B ALA 173 2 92.71 1 315 B LYS 174 2 90.03 1 316 B GLU 175 2 92.20 1 317 B SER 176 2 95.73 1 318 B CYS 177 2 97.90 1 319 B LEU 178 2 95.61 1 320 B ILE 179 2 96.64 1 321 B GLY 180 2 98.21 1 322 B VAL 181 2 95.72 1 323 B LYS 182 2 92.91 1 324 B GLY 183 2 95.42 1 325 B ASP 184 2 90.93 1 326 B VAL 185 2 90.94 1 327 B ASP 186 2 88.12 1 328 B ASN 187 2 83.61 1 329 B GLY 188 2 90.56 1 330 B ARG 189 2 80.77 1 331 B PHE 190 2 94.63 1 332 B LYS 191 2 86.97 1 333 B LYS 192 2 84.81 1 334 B ASN 193 2 89.90 1 335 B ILE 194 2 87.19 1 336 B ALA 195 2 91.87 1 337 B SER 196 2 92.30 1 338 B ASP 197 2 94.31 1 339 B VAL 198 2 94.56 1 340 B ILE 199 2 96.40 1 341 B PHE 200 2 92.61 1 342 B SER 201 2 95.39 1 343 B GLU 202 2 90.37 1 344 B ARG 203 2 79.81 1 345 B ARG 204 2 84.52 1 346 B GLY 205 2 91.70 1 347 B GLN 206 2 79.78 1 348 B SER 207 2 90.01 1 349 B GLN 208 2 91.18 1 350 B LYS 209 2 93.01 1 351 B PRO 210 2 97.00 1 352 B GLU 211 2 92.14 1 353 B GLU 212 2 93.72 1 354 B ILE 213 2 96.88 1 355 B TYR 214 2 97.52 1 356 B GLN 215 2 90.19 1 357 B TYR 216 2 92.94 1 358 B ILE 217 2 97.03 1 359 B ASN 218 2 89.92 1 360 B GLN 219 2 91.51 1 361 B LEU 220 2 96.10 1 362 B CYS 221 2 96.19 1 363 B PRO 222 2 94.17 1 364 B ASN 223 2 89.55 1 365 B GLY 224 2 95.98 1 366 B ASN 225 2 94.46 1 367 B TYR 226 2 96.82 1 368 B LEU 227 2 98.15 1 369 B GLU 228 2 97.63 1 370 B ILE 229 2 97.99 1 371 B PHE 230 2 97.80 1 372 B ALA 231 2 97.36 1 373 B ARG 232 2 90.16 1 374 B ARG 233 2 92.61 1 375 B ASN 234 2 92.85 1 376 B ASN 235 2 95.20 1 377 B LEU 236 2 97.25 1 378 B HIS 237 2 94.75 1 379 B ASP 238 2 95.81 1 380 B ASN 239 2 93.00 1 381 B TRP 240 2 98.00 1 382 B VAL 241 2 98.24 1 383 B SER 242 2 97.99 1 384 B ILE 243 2 97.88 1 385 B GLY 244 2 96.72 1 386 B ASN 245 2 92.67 1 387 B GLU 246 2 87.55 1 388 B LEU 247 2 94.09 1 389 C SAH . 2 95.72 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 SAH _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 ? 27.434 -36.270 32.899 1.00 29.65 1 A 1 ATOM 2 C CA . MET A 1 1 ? 27.404 -34.792 32.828 1.00 37.73 1 A 1 ATOM 3 C C . MET A 1 1 ? 26.173 -34.373 32.030 1.00 42.70 1 A 1 ATOM 4 O O . MET A 1 1 ? 26.167 -34.523 30.820 1.00 41.53 1 A 1 ATOM 5 C CB . MET A 1 1 ? 28.673 -34.260 32.154 1.00 36.36 1 A 1 ATOM 6 C CG . MET A 1 1 ? 29.896 -34.375 33.071 1.00 35.11 1 A 1 ATOM 7 S SD . MET A 1 1 ? 31.435 -34.011 32.218 1.00 33.65 1 A 1 ATOM 8 C CE . MET A 1 1 ? 32.598 -33.929 33.610 1.00 29.80 1 A 1 ATOM 9 N N . LYS A 1 2 ? 25.086 -33.944 32.695 1.00 36.29 2 A 1 ATOM 10 C CA . LYS A 1 2 ? 23.863 -33.479 32.023 1.00 37.97 2 A 1 ATOM 11 C C . LYS A 1 2 ? 24.196 -32.149 31.342 1.00 37.10 2 A 1 ATOM 12 O O . LYS A 1 2 ? 24.399 -31.158 32.034 1.00 34.97 2 A 1 ATOM 13 C CB . LYS A 1 2 ? 22.700 -33.324 33.026 1.00 37.04 2 A 1 ATOM 14 C CG . LYS A 1 2 ? 22.088 -34.665 33.485 1.00 33.99 2 A 1 ATOM 15 C CD . LYS A 1 2 ? 20.904 -34.447 34.452 1.00 32.02 2 A 1 ATOM 16 C CE . LYS A 1 2 ? 20.251 -35.784 34.850 1.00 27.56 2 A 1 ATOM 17 N NZ . LYS A 1 2 ? 19.106 -35.615 35.782 1.00 24.95 2 A 1 ATOM 18 N N . LYS A 1 3 ? 24.322 -32.133 30.014 1.00 35.11 3 A 1 ATOM 19 C CA . LYS A 1 3 ? 24.415 -30.876 29.262 1.00 35.97 3 A 1 ATOM 20 C C . LYS A 1 3 ? 23.103 -30.128 29.509 1.00 34.60 3 A 1 ATOM 21 O O . LYS A 1 3 ? 22.069 -30.520 28.982 1.00 31.48 3 A 1 ATOM 22 C CB . LYS A 1 3 ? 24.659 -31.125 27.759 1.00 34.77 3 A 1 ATOM 23 C CG . LYS A 1 3 ? 26.129 -31.458 27.427 1.00 32.75 3 A 1 ATOM 24 C CD . LYS A 1 3 ? 26.332 -31.590 25.907 1.00 31.30 3 A 1 ATOM 25 C CE . LYS A 1 3 ? 27.811 -31.828 25.547 1.00 27.62 3 A 1 ATOM 26 N NZ . LYS A 1 3 ? 28.034 -31.944 24.083 1.00 25.50 3 A 1 ATOM 27 N N . ASN A 1 4 ? 23.140 -29.109 30.364 1.00 38.37 4 A 1 ATOM 28 C CA . ASN A 1 4 ? 22.041 -28.167 30.548 1.00 37.79 4 A 1 ATOM 29 C C . ASN A 1 4 ? 21.862 -27.417 29.223 1.00 36.99 4 A 1 ATOM 30 O O . ASN A 1 4 ? 22.454 -26.365 29.012 1.00 33.16 4 A 1 ATOM 31 C CB . ASN A 1 4 ? 22.354 -27.211 31.721 1.00 34.55 4 A 1 ATOM 32 C CG . ASN A 1 4 ? 21.964 -27.758 33.086 1.00 30.04 4 A 1 ATOM 33 O OD1 . ASN A 1 4 ? 21.202 -28.690 33.218 1.00 28.93 4 A 1 ATOM 34 N ND2 . ASN A 1 4 ? 22.461 -27.163 34.150 1.00 28.22 4 A 1 ATOM 35 N N . GLY A 1 5 ? 21.066 -27.991 28.327 1.00 38.95 5 A 1 ATOM 36 C CA . GLY A 1 5 ? 20.577 -27.336 27.127 1.00 39.06 5 A 1 ATOM 37 C C . GLY A 1 5 ? 19.581 -26.244 27.504 1.00 39.96 5 A 1 ATOM 38 O O . GLY A 1 5 ? 18.410 -26.342 27.171 1.00 36.64 5 A 1 ATOM 39 N N . LYS A 1 6 ? 20.031 -25.231 28.253 1.00 38.97 6 A 1 ATOM 40 C CA . LYS A 1 6 ? 19.348 -23.949 28.321 1.00 39.71 6 A 1 ATOM 41 C C . LYS A 1 6 ? 19.453 -23.346 26.923 1.00 40.25 6 A 1 ATOM 42 O O . LYS A 1 6 ? 20.333 -22.528 26.667 1.00 37.76 6 A 1 ATOM 43 C CB . LYS A 1 6 ? 19.964 -23.023 29.389 1.00 38.18 6 A 1 ATOM 44 C CG . LYS A 1 6 ? 19.627 -23.411 30.837 1.00 35.00 6 A 1 ATOM 45 C CD . LYS A 1 6 ? 20.205 -22.357 31.794 1.00 32.74 6 A 1 ATOM 46 C CE . LYS A 1 6 ? 19.852 -22.667 33.255 1.00 28.67 6 A 1 ATOM 47 N NZ . LYS A 1 6 ? 20.358 -21.617 34.177 1.00 26.01 6 A 1 ATOM 48 N N . SER A 1 7 ? 18.574 -23.763 26.009 1.00 47.63 7 A 1 ATOM 49 C CA . SER A 1 7 ? 18.158 -22.900 24.913 1.00 48.87 7 A 1 ATOM 50 C C . SER A 1 7 ? 17.582 -21.655 25.585 1.00 50.09 7 A 1 ATOM 51 O O . SER A 1 7 ? 16.434 -21.650 26.033 1.00 47.32 7 A 1 ATOM 52 C CB . SER A 1 7 ? 17.125 -23.606 24.019 1.00 45.71 7 A 1 ATOM 53 O OG . SER A 1 7 ? 16.092 -24.185 24.793 1.00 41.40 7 A 1 ATOM 54 N N . GLN A 1 8 ? 18.437 -20.647 25.809 1.00 45.98 8 A 1 ATOM 55 C CA . GLN A 1 8 ? 17.995 -19.343 26.254 1.00 48.00 8 A 1 ATOM 56 C C . GLN A 1 8 ? 17.156 -18.808 25.100 1.00 51.67 8 A 1 ATOM 57 O O . GLN A 1 8 ? 17.702 -18.280 24.136 1.00 48.55 8 A 1 ATOM 58 C CB . GLN A 1 8 ? 19.198 -18.440 26.574 1.00 43.10 8 A 1 ATOM 59 C CG . GLN A 1 8 ? 19.873 -18.794 27.912 1.00 38.75 8 A 1 ATOM 60 C CD . GLN A 1 8 ? 21.054 -17.874 28.231 1.00 34.68 8 A 1 ATOM 61 O OE1 . GLN A 1 8 ? 21.606 -17.198 27.389 1.00 33.23 8 A 1 ATOM 62 N NE2 . GLN A 1 8 ? 21.508 -17.827 29.462 1.00 32.81 8 A 1 ATOM 63 N N . ASN A 1 9 ? 15.832 -19.009 25.194 1.00 59.83 9 A 1 ATOM 64 C CA . ASN A 1 9 ? 14.857 -18.337 24.347 1.00 60.43 9 A 1 ATOM 65 C C . ASN A 1 9 ? 14.939 -16.839 24.664 1.00 62.70 9 A 1 ATOM 66 O O . ASN A 1 9 ? 14.113 -16.305 25.399 1.00 58.65 9 A 1 ATOM 67 C CB . ASN A 1 9 ? 13.444 -18.912 24.599 1.00 54.49 9 A 1 ATOM 68 C CG . ASN A 1 9 ? 13.137 -20.199 23.847 1.00 48.13 9 A 1 ATOM 69 O OD1 . ASN A 1 9 ? 13.832 -20.617 22.949 1.00 44.96 9 A 1 ATOM 70 N ND2 . ASN A 1 9 ? 12.049 -20.859 24.195 1.00 42.47 9 A 1 ATOM 71 N N . GLN A 1 10 ? 16.003 -16.180 24.197 1.00 67.16 10 A 1 ATOM 72 C CA . GLN A 1 10 ? 16.037 -14.733 24.204 1.00 70.82 10 A 1 ATOM 73 C C . GLN A 1 10 ? 14.855 -14.263 23.360 1.00 74.58 10 A 1 ATOM 74 O O . GLN A 1 10 ? 14.630 -14.811 22.272 1.00 69.50 10 A 1 ATOM 75 C CB . GLN A 1 10 ? 17.372 -14.189 23.689 1.00 63.00 10 A 1 ATOM 76 C CG . GLN A 1 10 ? 18.442 -14.253 24.793 1.00 53.68 10 A 1 ATOM 77 C CD . GLN A 1 10 ? 19.732 -13.536 24.406 1.00 46.82 10 A 1 ATOM 78 O OE1 . GLN A 1 10 ? 20.079 -13.373 23.252 1.00 43.51 10 A 1 ATOM 79 N NE2 . GLN A 1 10 ? 20.503 -13.086 25.370 1.00 40.62 10 A 1 ATOM 80 N N . PRO A 1 11 ? 14.059 -13.314 23.875 1.00 80.93 11 A 1 ATOM 81 C CA . PRO A 1 11 ? 12.952 -12.769 23.114 1.00 83.80 11 A 1 ATOM 82 C C . PRO A 1 11 ? 13.489 -12.207 21.794 1.00 87.60 11 A 1 ATOM 83 O O . PRO A 1 11 ? 14.537 -11.554 21.766 1.00 83.94 11 A 1 ATOM 84 C CB . PRO A 1 11 ? 12.322 -11.704 24.018 1.00 76.57 11 A 1 ATOM 85 C CG . PRO A 1 11 ? 13.456 -11.300 24.958 1.00 70.86 11 A 1 ATOM 86 C CD . PRO A 1 11 ? 14.254 -12.584 25.117 1.00 73.55 11 A 1 ATOM 87 N N . LEU A 1 12 ? 12.782 -12.478 20.712 1.00 88.51 12 A 1 ATOM 88 C CA . LEU A 1 12 ? 13.127 -11.953 19.394 1.00 92.23 12 A 1 ATOM 89 C C . LEU A 1 12 ? 13.117 -10.416 19.440 1.00 94.08 12 A 1 ATOM 90 O O . LEU A 1 12 ? 12.114 -9.816 19.830 1.00 92.22 12 A 1 ATOM 91 C CB . LEU A 1 12 ? 12.123 -12.519 18.369 1.00 90.22 12 A 1 ATOM 92 C CG . LEU A 1 12 ? 12.372 -12.079 16.911 1.00 90.33 12 A 1 ATOM 93 C CD1 . LEU A 1 12 ? 13.693 -12.630 16.373 1.00 87.78 12 A 1 ATOM 94 C CD2 . LEU A 1 12 ? 11.246 -12.614 16.019 1.00 87.66 12 A 1 ATOM 95 N N . ASP A 1 13 ? 14.207 -9.792 19.022 1.00 94.16 13 A 1 ATOM 96 C CA . ASP A 1 13 ? 14.209 -8.351 18.766 1.00 95.52 13 A 1 ATOM 97 C C . ASP A 1 13 ? 13.411 -8.081 17.486 1.00 96.48 13 A 1 ATOM 98 O O . ASP A 1 13 ? 13.921 -8.186 16.367 1.00 95.73 13 A 1 ATOM 99 C CB . ASP A 1 13 ? 15.639 -7.799 18.692 1.00 93.75 13 A 1 ATOM 100 C CG . ASP A 1 13 ? 15.693 -6.289 18.389 1.00 92.68 13 A 1 ATOM 101 O OD1 . ASP A 1 13 ? 14.636 -5.664 18.130 1.00 88.67 13 A 1 ATOM 102 O OD2 . ASP A 1 13 ? 16.821 -5.747 18.374 1.00 87.55 13 A 1 ATOM 103 N N . PHE A 1 14 ? 12.135 -7.753 17.655 1.00 96.18 14 A 1 ATOM 104 C CA . PHE A 1 14 ? 11.232 -7.502 16.538 1.00 96.39 14 A 1 ATOM 105 C C . PHE A 1 14 ? 11.635 -6.290 15.693 1.00 97.07 14 A 1 ATOM 106 O O . PHE A 1 14 ? 11.343 -6.270 14.499 1.00 96.41 14 A 1 ATOM 107 C CB . PHE A 1 14 ? 9.799 -7.355 17.057 1.00 94.93 14 A 1 ATOM 108 C CG . PHE A 1 14 ? 9.133 -8.678 17.357 1.00 92.60 14 A 1 ATOM 109 C CD1 . PHE A 1 14 ? 8.662 -9.478 16.300 1.00 89.89 14 A 1 ATOM 110 C CD2 . PHE A 1 14 ? 8.973 -9.117 18.682 1.00 89.67 14 A 1 ATOM 111 C CE1 . PHE A 1 14 ? 8.023 -10.701 16.560 1.00 88.16 14 A 1 ATOM 112 C CE2 . PHE A 1 14 ? 8.335 -10.341 18.950 1.00 87.70 14 A 1 ATOM 113 C CZ . PHE A 1 14 ? 7.858 -11.131 17.889 1.00 87.18 14 A 1 ATOM 114 N N . THR A 1 15 ? 12.336 -5.306 16.261 1.00 96.88 15 A 1 ATOM 115 C CA . THR A 1 15 ? 12.812 -4.153 15.485 1.00 96.69 15 A 1 ATOM 116 C C . THR A 1 15 ? 13.920 -4.578 14.525 1.00 97.26 15 A 1 ATOM 117 O O . THR A 1 15 ? 13.869 -4.260 13.334 1.00 96.59 15 A 1 ATOM 118 C CB . THR A 1 15 ? 13.301 -3.030 16.407 1.00 95.47 15 A 1 ATOM 119 O OG1 . THR A 1 15 ? 12.240 -2.612 17.240 1.00 89.31 15 A 1 ATOM 120 C CG2 . THR A 1 15 ? 13.760 -1.799 15.631 1.00 87.88 15 A 1 ATOM 121 N N . GLN A 1 16 ? 14.893 -5.344 15.017 1.00 96.61 16 A 1 ATOM 122 C CA . GLN A 1 16 ? 15.962 -5.866 14.171 1.00 96.87 16 A 1 ATOM 123 C C . GLN A 1 16 ? 15.450 -6.926 13.195 1.00 97.46 16 A 1 ATOM 124 O O . GLN A 1 16 ? 15.822 -6.914 12.021 1.00 97.30 16 A 1 ATOM 125 C CB . GLN A 1 16 ? 17.102 -6.401 15.052 1.00 96.18 16 A 1 ATOM 126 C CG . GLN A 1 16 ? 18.350 -6.746 14.221 1.00 90.48 16 A 1 ATOM 127 C CD . GLN A 1 16 ? 18.873 -5.526 13.442 1.00 89.26 16 A 1 ATOM 128 O OE1 . GLN A 1 16 ? 19.064 -4.447 13.979 1.00 81.11 16 A 1 ATOM 129 N NE2 . GLN A 1 16 ? 19.085 -5.643 12.151 1.00 78.74 16 A 1 ATOM 130 N N . TYR A 1 17 ? 14.550 -7.794 13.653 1.00 97.31 17 A 1 ATOM 131 C CA . TYR A 1 17 ? 13.858 -8.766 12.808 1.00 97.74 17 A 1 ATOM 132 C C . TYR A 1 17 ? 13.140 -8.081 11.640 1.00 98.17 17 A 1 ATOM 133 O O . TYR A 1 17 ? 13.369 -8.440 10.487 1.00 97.99 17 A 1 ATOM 134 C CB . TYR A 1 17 ? 12.875 -9.576 13.668 1.00 97.53 17 A 1 ATOM 135 C CG . TYR A 1 17 ? 11.890 -10.403 12.869 1.00 98.05 17 A 1 ATOM 136 C CD1 . TYR A 1 17 ? 10.546 -9.989 12.745 1.00 97.56 17 A 1 ATOM 137 C CD2 . TYR A 1 17 ? 12.310 -11.586 12.232 1.00 97.76 17 A 1 ATOM 138 C CE1 . TYR A 1 17 ? 9.633 -10.754 12.008 1.00 97.58 17 A 1 ATOM 139 C CE2 . TYR A 1 17 ? 11.400 -12.360 11.491 1.00 97.48 17 A 1 ATOM 140 C CZ . TYR A 1 17 ? 10.060 -11.941 11.386 1.00 97.84 17 A 1 ATOM 141 O OH . TYR A 1 17 ? 9.163 -12.698 10.674 1.00 97.26 17 A 1 ATOM 142 N N . ALA A 1 18 ? 12.345 -7.053 11.907 1.00 98.18 18 A 1 ATOM 143 C CA . ALA A 1 18 ? 11.618 -6.331 10.868 1.00 98.11 18 A 1 ATOM 144 C C . ALA A 1 18 ? 12.566 -5.674 9.852 1.00 98.17 18 A 1 ATOM 145 O O . ALA A 1 18 ? 12.319 -5.753 8.648 1.00 97.83 18 A 1 ATOM 146 C CB . ALA A 1 18 ? 10.688 -5.307 11.530 1.00 97.73 18 A 1 ATOM 147 N N . LYS A 1 19 ? 13.666 -5.081 10.306 1.00 97.99 19 A 1 ATOM 148 C CA . LYS A 1 19 ? 14.698 -4.529 9.411 1.00 97.91 19 A 1 ATOM 149 C C . LYS A 1 19 ? 15.314 -5.606 8.519 1.00 97.91 19 A 1 ATOM 150 O O . LYS A 1 19 ? 15.384 -5.420 7.308 1.00 97.34 19 A 1 ATOM 151 C CB . LYS A 1 19 ? 15.794 -3.819 10.213 1.00 97.50 19 A 1 ATOM 152 C CG . LYS A 1 19 ? 15.335 -2.468 10.774 1.00 94.98 19 A 1 ATOM 153 C CD . LYS A 1 19 ? 16.502 -1.786 11.490 1.00 93.27 19 A 1 ATOM 154 C CE . LYS A 1 19 ? 16.096 -0.398 11.977 1.00 86.44 19 A 1 ATOM 155 N NZ . LYS A 1 19 ? 17.292 0.432 12.271 1.00 79.54 19 A 1 ATOM 156 N N . ASN A 1 20 ? 15.707 -6.728 9.106 1.00 97.95 20 A 1 ATOM 157 C CA . ASN A 1 20 ? 16.326 -7.831 8.371 1.00 97.87 20 A 1 ATOM 158 C C . ASN A 1 20 ? 15.370 -8.430 7.328 1.00 97.93 20 A 1 ATOM 159 O O . ASN A 1 20 ? 15.733 -8.563 6.162 1.00 97.37 20 A 1 ATOM 160 C CB . ASN A 1 20 ? 16.783 -8.898 9.374 1.00 97.64 20 A 1 ATOM 161 C CG . ASN A 1 20 ? 17.945 -8.468 10.253 1.00 96.90 20 A 1 ATOM 162 O OD1 . ASN A 1 20 ? 18.612 -7.469 10.054 1.00 91.87 20 A 1 ATOM 163 N ND2 . ASN A 1 20 ? 18.238 -9.261 11.268 1.00 91.21 20 A 1 ATOM 164 N N . MET A 1 21 ? 14.132 -8.709 7.727 1.00 98.27 21 A 1 ATOM 165 C CA . MET A 1 21 ? 13.108 -9.253 6.828 1.00 98.21 21 A 1 ATOM 166 C C . MET A 1 21 ? 12.803 -8.300 5.670 1.00 98.09 21 A 1 ATOM 167 O O . MET A 1 21 ? 12.704 -8.736 4.527 1.00 97.54 21 A 1 ATOM 168 C CB . MET A 1 21 ? 11.831 -9.557 7.620 1.00 98.11 21 A 1 ATOM 169 C CG . MET A 1 21 ? 11.996 -10.737 8.585 1.00 97.24 21 A 1 ATOM 170 S SD . MET A 1 21 ? 12.265 -12.352 7.793 1.00 97.14 21 A 1 ATOM 171 C CE . MET A 1 21 ? 10.595 -12.700 7.185 1.00 93.13 21 A 1 ATOM 172 N N . ARG A 1 22 ? 12.702 -6.994 5.938 1.00 98.33 22 A 1 ATOM 173 C CA . ARG A 1 22 ? 12.494 -5.995 4.879 1.00 98.11 22 A 1 ATOM 174 C C . ARG A 1 22 ? 13.666 -5.939 3.903 1.00 97.87 22 A 1 ATOM 175 O O . ARG A 1 22 ? 13.422 -5.898 2.702 1.00 97.07 22 A 1 ATOM 176 C CB . ARG A 1 22 ? 12.228 -4.609 5.472 1.00 97.68 22 A 1 ATOM 177 C CG . ARG A 1 22 ? 10.788 -4.469 6.000 1.00 96.37 22 A 1 ATOM 178 C CD . ARG A 1 22 ? 10.479 -3.023 6.370 1.00 95.92 22 A 1 ATOM 179 N NE . ARG A 1 22 ? 11.328 -2.533 7.469 1.00 94.16 22 A 1 ATOM 180 C CZ . ARG A 1 22 ? 10.969 -2.312 8.720 1.00 95.87 22 A 1 ATOM 181 N NH1 . ARG A 1 22 ? 9.759 -2.523 9.156 1.00 87.78 22 A 1 ATOM 182 N NH2 . ARG A 1 22 ? 11.829 -1.850 9.577 1.00 89.33 22 A 1 ATOM 183 N N . LYS A 1 23 ? 14.900 -5.984 4.379 1.00 97.58 23 A 1 ATOM 184 C CA . LYS A 1 23 ? 16.084 -5.994 3.505 1.00 97.08 23 A 1 ATOM 185 C C . LYS A 1 23 ? 16.100 -7.196 2.565 1.00 96.85 23 A 1 ATOM 186 O O . LYS A 1 23 ? 16.503 -7.055 1.417 1.00 95.53 23 A 1 ATOM 187 C CB . LYS A 1 23 ? 17.371 -5.971 4.338 1.00 96.51 23 A 1 ATOM 188 C CG . LYS A 1 23 ? 17.610 -4.587 4.965 1.00 92.92 23 A 1 ATOM 189 C CD . LYS A 1 23 ? 18.878 -4.545 5.813 1.00 90.34 23 A 1 ATOM 190 C CE . LYS A 1 23 ? 20.119 -4.651 4.906 1.00 82.17 23 A 1 ATOM 191 N NZ . LYS A 1 23 ? 21.333 -4.154 5.589 1.00 76.73 23 A 1 ATOM 192 N N . ASP A 1 24 ? 15.650 -8.351 3.047 1.00 97.30 24 A 1 ATOM 193 C CA . ASP A 1 24 ? 15.672 -9.590 2.268 1.00 96.83 24 A 1 ATOM 194 C C . ASP A 1 24 ? 14.480 -9.737 1.313 1.00 96.70 24 A 1 ATOM 195 O O . ASP A 1 24 ? 14.614 -10.364 0.258 1.00 94.83 24 A 1 ATOM 196 C CB . ASP A 1 24 ? 15.684 -10.781 3.229 1.00 96.18 24 A 1 ATOM 197 C CG . ASP A 1 24 ? 17.012 -11.026 3.943 1.00 95.62 24 A 1 ATOM 198 O OD1 . ASP A 1 24 ? 18.041 -10.365 3.691 1.00 92.95 24 A 1 ATOM 199 O OD2 . ASP A 1 24 ? 17.047 -12.002 4.724 1.00 92.76 24 A 1 ATOM 200 N N . LEU A 1 25 ? 13.306 -9.214 1.686 1.00 97.22 25 A 1 ATOM 201 C CA . LEU A 1 25 ? 12.032 -9.585 1.055 1.00 96.95 25 A 1 ATOM 202 C C . LEU A 1 25 ? 11.217 -8.416 0.501 1.00 96.51 25 A 1 ATOM 203 O O . LEU A 1 25 ? 10.384 -8.618 -0.387 1.00 94.46 25 A 1 ATOM 204 C CB . LEU A 1 25 ? 11.176 -10.340 2.084 1.00 96.82 25 A 1 ATOM 205 C CG . LEU A 1 25 ? 11.819 -11.601 2.691 1.00 96.68 25 A 1 ATOM 206 C CD1 . LEU A 1 25 ? 10.917 -12.110 3.810 1.00 95.50 25 A 1 ATOM 207 C CD2 . LEU A 1 25 ? 11.992 -12.711 1.653 1.00 95.17 25 A 1 ATOM 208 N N . SER A 1 26 ? 11.378 -7.218 1.052 1.00 96.45 26 A 1 ATOM 209 C CA . SER A 1 26 ? 10.590 -6.066 0.622 1.00 95.27 26 A 1 ATOM 210 C C . SER A 1 26 ? 11.149 -5.482 -0.671 1.00 93.60 26 A 1 ATOM 211 O O . SER A 1 26 ? 12.339 -5.567 -0.954 1.00 89.00 26 A 1 ATOM 212 C CB . SER A 1 26 ? 10.514 -4.980 1.698 1.00 94.64 26 A 1 ATOM 213 O OG . SER A 1 26 ? 9.971 -5.497 2.896 1.00 90.47 26 A 1 ATOM 214 N N . ASN A 1 27 ? 10.287 -4.820 -1.430 1.00 92.90 27 A 1 ATOM 215 C CA . ASN A 1 27 ? 10.750 -3.981 -2.534 1.00 90.59 27 A 1 ATOM 216 C C . ASN A 1 27 ? 11.684 -2.877 -1.999 1.00 90.69 27 A 1 ATOM 217 O O . ASN A 1 27 ? 11.472 -2.354 -0.909 1.00 87.41 27 A 1 ATOM 218 C CB . ASN A 1 27 ? 9.510 -3.423 -3.261 1.00 87.23 27 A 1 ATOM 219 C CG . ASN A 1 27 ? 9.862 -2.655 -4.521 1.00 80.12 27 A 1 ATOM 220 O OD1 . ASN A 1 27 ? 10.653 -1.743 -4.520 1.00 72.93 27 A 1 ATOM 221 N ND2 . ASN A 1 27 ? 9.290 -3.004 -5.646 1.00 72.86 27 A 1 ATOM 222 N N . GLN A 1 28 ? 12.691 -2.509 -2.798 1.00 89.73 28 A 1 ATOM 223 C CA . GLN A 1 28 ? 13.682 -1.482 -2.440 1.00 88.22 28 A 1 ATOM 224 C C . GLN A 1 28 ? 13.052 -0.134 -2.054 1.00 90.05 28 A 1 ATOM 225 O O . GLN A 1 28 ? 13.600 0.584 -1.228 1.00 85.98 28 A 1 ATOM 226 C CB . GLN A 1 28 ? 14.644 -1.273 -3.616 1.00 84.04 28 A 1 ATOM 227 C CG . GLN A 1 28 ? 15.541 -2.496 -3.861 1.00 75.81 28 A 1 ATOM 228 C CD . GLN A 1 28 ? 16.521 -2.282 -5.017 1.00 69.64 28 A 1 ATOM 229 O OE1 . GLN A 1 28 ? 16.450 -1.338 -5.786 1.00 63.10 28 A 1 ATOM 230 N NE2 . GLN A 1 28 ? 17.471 -3.168 -5.189 1.00 61.20 28 A 1 ATOM 231 N N . ASP A 1 29 ? 11.883 0.190 -2.593 1.00 93.16 29 A 1 ATOM 232 C CA . ASP A 1 29 ? 11.181 1.430 -2.253 1.00 94.23 29 A 1 ATOM 233 C C . ASP A 1 29 ? 10.521 1.385 -0.859 1.00 95.48 29 A 1 ATOM 234 O O . ASP A 1 29 ? 10.242 2.429 -0.267 1.00 94.37 29 A 1 ATOM 235 C CB . ASP A 1 29 ? 10.119 1.721 -3.321 1.00 92.76 29 A 1 ATOM 236 C CG . ASP A 1 29 ? 10.683 1.984 -4.721 1.00 90.91 29 A 1 ATOM 237 O OD1 . ASP A 1 29 ? 11.841 2.450 -4.830 1.00 86.96 29 A 1 ATOM 238 O OD2 . ASP A 1 29 ? 9.923 1.758 -5.691 1.00 86.43 29 A 1 ATOM 239 N N . ILE A 1 30 ? 10.251 0.189 -0.319 1.00 96.53 30 A 1 ATOM 240 C CA . ILE A 1 30 ? 9.540 -0.015 0.954 1.00 96.54 30 A 1 ATOM 241 C C . ILE A 1 30 ? 10.444 0.224 2.168 1.00 96.28 30 A 1 ATOM 242 O O . ILE A 1 30 ? 9.961 0.645 3.227 1.00 94.51 30 A 1 ATOM 243 C CB . ILE A 1 30 ? 8.898 -1.425 0.973 1.00 96.18 30 A 1 ATOM 244 C CG1 . ILE A 1 30 ? 7.693 -1.443 0.005 1.00 94.39 30 A 1 ATOM 245 C CG2 . ILE A 1 30 ? 8.469 -1.867 2.387 1.00 93.87 30 A 1 ATOM 246 C CD1 . ILE A 1 30 ? 7.009 -2.800 -0.159 1.00 91.82 30 A 1 ATOM 247 N N . CYS A 1 31 ? 11.733 -0.052 2.044 1.00 96.01 31 A 1 ATOM 248 C CA . CYS A 1 31 ? 12.695 0.132 3.120 1.00 95.59 31 A 1 ATOM 249 C C . CYS A 1 31 ? 13.902 0.957 2.672 1.00 95.18 31 A 1 ATOM 250 O O . CYS A 1 31 ? 14.236 1.027 1.489 1.00 93.77 31 A 1 ATOM 251 C CB . CYS A 1 31 ? 13.081 -1.228 3.725 1.00 94.02 31 A 1 ATOM 252 S SG . CYS A 1 31 ? 14.006 -2.261 2.544 1.00 93.52 31 A 1 ATOM 253 N N . LEU A 1 32 ? 14.556 1.582 3.647 1.00 95.10 32 A 1 ATOM 254 C CA . LEU A 1 32 ? 15.831 2.258 3.451 1.00 94.58 32 A 1 ATOM 255 C C . LEU A 1 32 ? 16.973 1.231 3.411 1.00 94.80 32 A 1 ATOM 256 O O . LEU A 1 32 ? 16.780 0.045 3.663 1.00 93.07 32 A 1 ATOM 257 C CB . LEU A 1 32 ? 16.020 3.310 4.560 1.00 93.43 32 A 1 ATOM 258 C CG . LEU A 1 32 ? 14.877 4.336 4.701 1.00 92.52 32 A 1 ATOM 259 C CD1 . LEU A 1 32 ? 15.206 5.327 5.817 1.00 88.12 32 A 1 ATOM 260 C CD2 . LEU A 1 32 ? 14.636 5.128 3.413 1.00 87.12 32 A 1 ATOM 261 N N . GLU A 1 33 ? 18.181 1.700 3.125 1.00 93.28 33 A 1 ATOM 262 C CA . GLU A 1 33 ? 19.357 0.836 2.961 1.00 93.35 33 A 1 ATOM 263 C C . GLU A 1 33 ? 19.693 0.016 4.228 1.00 94.74 33 A 1 ATOM 264 O O . GLU A 1 33 ? 20.134 -1.133 4.146 1.00 93.50 33 A 1 ATOM 265 C CB . GLU A 1 33 ? 20.525 1.741 2.542 1.00 91.52 33 A 1 ATOM 266 C CG . GLU A 1 33 ? 21.704 0.950 1.963 1.00 80.60 33 A 1 ATOM 267 C CD . GLU A 1 33 ? 22.822 1.864 1.440 1.00 71.96 33 A 1 ATOM 268 O OE1 . GLU A 1 33 ? 23.703 1.331 0.728 1.00 64.04 33 A 1 ATOM 269 O OE2 . GLU A 1 33 ? 22.798 3.067 1.759 1.00 64.63 33 A 1 ATOM 270 N N . ASP A 1 34 ? 19.410 0.566 5.414 1.00 94.27 34 A 1 ATOM 271 C CA . ASP A 1 34 ? 19.569 -0.118 6.703 1.00 94.79 34 A 1 ATOM 272 C C . ASP A 1 34 ? 18.392 -1.055 7.053 1.00 96.23 34 A 1 ATOM 273 O O . ASP A 1 34 ? 18.402 -1.718 8.093 1.00 95.17 34 A 1 ATOM 274 C CB . ASP A 1 34 ? 19.825 0.921 7.813 1.00 92.69 34 A 1 ATOM 275 C CG . ASP A 1 34 ? 18.559 1.654 8.265 1.00 89.58 34 A 1 ATOM 276 O OD1 . ASP A 1 34 ? 17.661 1.848 7.419 1.00 84.91 34 A 1 ATOM 277 O OD2 . ASP A 1 34 ? 18.451 1.950 9.479 1.00 84.63 34 A 1 ATOM 278 N N . GLY A 1 35 ? 17.371 -1.127 6.205 1.00 95.02 35 A 1 ATOM 279 C CA . GLY A 1 35 ? 16.137 -1.881 6.417 1.00 96.03 35 A 1 ATOM 280 C C . GLY A 1 35 ? 15.070 -1.133 7.216 1.00 96.94 35 A 1 ATOM 281 O O . GLY A 1 35 ? 14.001 -1.697 7.462 1.00 96.05 35 A 1 ATOM 282 N N . ALA A 1 36 ? 15.302 0.118 7.635 1.00 96.52 36 A 1 ATOM 283 C CA . ALA A 1 36 ? 14.251 0.932 8.240 1.00 96.03 36 A 1 ATOM 284 C C . ALA A 1 36 ? 13.088 1.137 7.257 1.00 96.25 36 A 1 ATOM 285 O O . ALA A 1 36 ? 13.276 1.161 6.043 1.00 95.23 36 A 1 ATOM 286 C CB . ALA A 1 36 ? 14.826 2.269 8.720 1.00 94.89 36 A 1 ATOM 287 N N . LEU A 1 37 ? 11.875 1.284 7.783 1.00 96.12 37 A 1 ATOM 288 C CA . LEU A 1 37 ? 10.696 1.486 6.942 1.00 96.44 37 A 1 ATOM 289 C C . LEU A 1 37 ? 10.763 2.843 6.226 1.00 96.43 37 A 1 ATOM 290 O O . LEU A 1 37 ? 10.939 3.884 6.855 1.00 95.03 37 A 1 ATOM 291 C CB . LEU A 1 37 ? 9.441 1.360 7.818 1.00 95.39 37 A 1 ATOM 292 C CG . LEU A 1 37 ? 8.134 1.292 7.000 1.00 92.94 37 A 1 ATOM 293 C CD1 . LEU A 1 37 ? 7.962 -0.075 6.337 1.00 90.53 37 A 1 ATOM 294 C CD2 . LEU A 1 37 ? 6.944 1.524 7.923 1.00 90.02 37 A 1 ATOM 295 N N . ASN A 1 38 ? 10.569 2.844 4.914 1.00 95.91 38 A 1 ATOM 296 C CA . ASN A 1 38 ? 10.498 4.071 4.130 1.00 95.82 38 A 1 ATOM 297 C C . ASN A 1 38 ? 9.086 4.671 4.213 1.00 96.24 38 A 1 ATOM 298 O O . ASN A 1 38 ? 8.210 4.410 3.385 1.00 95.63 38 A 1 ATOM 299 C CB . ASN A 1 38 ? 10.948 3.792 2.689 1.00 94.97 38 A 1 ATOM 300 C CG . ASN A 1 38 ? 10.925 5.044 1.830 1.00 94.71 38 A 1 ATOM 301 O OD1 . ASN A 1 38 ? 10.736 6.161 2.294 1.00 91.73 38 A 1 ATOM 302 N ND2 . ASN A 1 38 ? 11.102 4.885 0.536 1.00 91.38 38 A 1 ATOM 303 N N . HIS A 1 39 ? 8.857 5.514 5.210 1.00 95.86 39 A 1 ATOM 304 C CA . HIS A 1 39 ? 7.557 6.163 5.398 1.00 95.87 39 A 1 ATOM 305 C C . HIS A 1 39 ? 7.105 6.987 4.182 1.00 95.82 39 A 1 ATOM 306 O O . HIS A 1 39 ? 5.905 7.072 3.917 1.00 94.42 39 A 1 ATOM 307 C CB . HIS A 1 39 ? 7.597 7.032 6.654 1.00 95.52 39 A 1 ATOM 308 C CG . HIS A 1 39 ? 7.509 6.222 7.915 1.00 96.01 39 A 1 ATOM 309 N ND1 . HIS A 1 39 ? 6.350 5.662 8.432 1.00 89.82 39 A 1 ATOM 310 C CD2 . HIS A 1 39 ? 8.542 5.884 8.750 1.00 90.20 39 A 1 ATOM 311 C CE1 . HIS A 1 39 ? 6.681 5.009 9.552 1.00 91.40 39 A 1 ATOM 312 N NE2 . HIS A 1 39 ? 8.001 5.122 9.771 1.00 91.90 39 A 1 ATOM 313 N N . SER A 1 40 ? 8.034 7.556 3.409 1.00 95.66 40 A 1 ATOM 314 C CA . SER A 1 40 ? 7.696 8.364 2.231 1.00 94.88 40 A 1 ATOM 315 C C . SER A 1 40 ? 6.991 7.552 1.136 1.00 95.46 40 A 1 ATOM 316 O O . SER A 1 40 ? 6.052 8.050 0.516 1.00 94.29 40 A 1 ATOM 317 C CB . SER A 1 40 ? 8.936 9.083 1.691 1.00 92.96 40 A 1 ATOM 318 O OG . SER A 1 40 ? 9.810 8.223 1.001 1.00 82.12 40 A 1 ATOM 319 N N . TYR A 1 41 ? 7.341 6.277 0.989 1.00 95.59 41 A 1 ATOM 320 C CA . TYR A 1 41 ? 6.652 5.353 0.082 1.00 96.08 41 A 1 ATOM 321 C C . TYR A 1 41 ? 5.168 5.182 0.452 1.00 96.24 41 A 1 ATOM 322 O O . TYR A 1 41 ? 4.286 5.166 -0.411 1.00 95.10 41 A 1 ATOM 323 C CB . TYR A 1 41 ? 7.381 4.005 0.105 1.00 96.04 41 A 1 ATOM 324 C CG . TYR A 1 41 ? 6.702 2.926 -0.709 1.00 96.55 41 A 1 ATOM 325 C CD1 . TYR A 1 41 ? 5.799 2.028 -0.105 1.00 95.75 41 A 1 ATOM 326 C CD2 . TYR A 1 41 ? 6.970 2.813 -2.088 1.00 95.97 41 A 1 ATOM 327 C CE1 . TYR A 1 41 ? 5.176 1.027 -0.863 1.00 95.47 41 A 1 ATOM 328 C CE2 . TYR A 1 41 ? 6.352 1.811 -2.852 1.00 95.37 41 A 1 ATOM 329 C CZ . TYR A 1 41 ? 5.456 0.918 -2.237 1.00 95.65 41 A 1 ATOM 330 O OH . TYR A 1 41 ? 4.856 -0.065 -2.982 1.00 94.48 41 A 1 ATOM 331 N N . PHE A 1 42 ? 4.867 5.116 1.745 1.00 96.35 42 A 1 ATOM 332 C CA . PHE A 1 42 ? 3.500 4.929 2.238 1.00 96.08 42 A 1 ATOM 333 C C . PHE A 1 42 ? 2.691 6.230 2.332 1.00 95.38 42 A 1 ATOM 334 O O . PHE A 1 42 ? 1.461 6.171 2.401 1.00 93.16 42 A 1 ATOM 335 C CB . PHE A 1 42 ? 3.537 4.177 3.566 1.00 96.16 42 A 1 ATOM 336 C CG . PHE A 1 42 ? 4.061 2.764 3.418 1.00 96.61 42 A 1 ATOM 337 C CD1 . PHE A 1 42 ? 3.253 1.758 2.852 1.00 95.67 42 A 1 ATOM 338 C CD2 . PHE A 1 42 ? 5.375 2.454 3.808 1.00 95.79 42 A 1 ATOM 339 C CE1 . PHE A 1 42 ? 3.744 0.458 2.685 1.00 95.14 42 A 1 ATOM 340 C CE2 . PHE A 1 42 ? 5.873 1.153 3.645 1.00 95.22 42 A 1 ATOM 341 C CZ . PHE A 1 42 ? 5.056 0.155 3.082 1.00 95.59 42 A 1 ATOM 342 N N . LEU A 1 43 ? 3.335 7.385 2.275 1.00 95.43 43 A 1 ATOM 343 C CA . LEU A 1 43 ? 2.669 8.686 2.148 1.00 94.42 43 A 1 ATOM 344 C C . LEU A 1 43 ? 2.182 8.958 0.718 1.00 93.60 43 A 1 ATOM 345 O O . LEU A 1 43 ? 1.283 9.773 0.514 1.00 91.14 43 A 1 ATOM 346 C CB . LEU A 1 43 ? 3.626 9.792 2.614 1.00 93.95 43 A 1 ATOM 347 C CG . LEU A 1 43 ? 3.884 9.795 4.134 1.00 93.46 43 A 1 ATOM 348 C CD1 . LEU A 1 43 ? 5.009 10.776 4.455 1.00 91.73 43 A 1 ATOM 349 C CD2 . LEU A 1 43 ? 2.638 10.202 4.925 1.00 91.57 43 A 1 ATOM 350 N N . THR A 1 44 ? 2.740 8.258 -0.269 1.00 93.50 44 A 1 ATOM 351 C CA . THR A 1 44 ? 2.355 8.387 -1.679 1.00 92.44 44 A 1 ATOM 352 C C . THR A 1 44 ? 1.422 7.257 -2.095 1.00 92.65 44 A 1 ATOM 353 O O . THR A 1 44 ? 1.489 6.150 -1.581 1.00 90.45 44 A 1 ATOM 354 C CB . THR A 1 44 ? 3.579 8.456 -2.612 1.00 90.08 44 A 1 ATOM 355 O OG1 . THR A 1 44 ? 4.804 8.443 -1.937 1.00 79.55 44 A 1 ATOM 356 C CG2 . THR A 1 44 ? 3.552 9.749 -3.417 1.00 78.54 44 A 1 ATOM 357 N N . LYS A 1 45 ? 0.530 7.523 -3.057 1.00 90.68 45 A 1 ATOM 358 C CA . LYS A 1 45 ? -0.298 6.452 -3.615 1.00 89.51 45 A 1 ATOM 359 C C . LYS A 1 45 ? 0.585 5.409 -4.300 1.00 90.08 45 A 1 ATOM 360 O O . LYS A 1 45 ? 1.617 5.739 -4.884 1.00 87.88 45 A 1 ATOM 361 C CB . LYS A 1 45 ? -1.337 7.006 -4.593 1.00 86.64 45 A 1 ATOM 362 C CG . LYS A 1 45 ? -2.405 7.847 -3.886 1.00 77.25 45 A 1 ATOM 363 C CD . LYS A 1 45 ? -3.425 8.355 -4.907 1.00 72.38 45 A 1 ATOM 364 C CE . LYS A 1 45 ? -4.478 9.231 -4.225 1.00 63.34 45 A 1 ATOM 365 N NZ . LYS A 1 45 ? -5.408 9.829 -5.211 1.00 55.64 45 A 1 ATOM 366 N N . LYS A 1 46 ? 0.131 4.164 -4.284 1.00 88.66 46 A 1 ATOM 367 C CA . LYS A 1 46 ? 0.820 3.087 -4.987 1.00 87.22 46 A 1 ATOM 368 C C . LYS A 1 46 ? 1.047 3.453 -6.459 1.00 87.54 46 A 1 ATOM 369 O O . LYS A 1 46 ? 0.142 3.957 -7.118 1.00 81.29 46 A 1 ATOM 370 C CB . LYS A 1 46 ? 0.014 1.787 -4.850 1.00 83.27 46 A 1 ATOM 371 C CG . LYS A 1 46 ? 0.847 0.631 -5.391 1.00 77.64 46 A 1 ATOM 372 C CD . LYS A 1 46 ? 0.095 -0.677 -5.389 1.00 71.51 46 A 1 ATOM 373 C CE . LYS A 1 46 ? 1.053 -1.673 -6.047 1.00 65.24 46 A 1 ATOM 374 N NZ . LYS A 1 46 ? 0.366 -2.899 -6.409 1.00 57.49 46 A 1 ATOM 375 N N . GLY A 1 47 ? 2.256 3.198 -6.954 1.00 86.15 47 A 1 ATOM 376 C CA . GLY A 1 47 ? 2.662 3.528 -8.326 1.00 85.15 47 A 1 ATOM 377 C C . GLY A 1 47 ? 2.972 5.008 -8.583 1.00 87.33 47 A 1 ATOM 378 O O . GLY A 1 47 ? 3.377 5.345 -9.687 1.00 83.74 47 A 1 ATOM 379 N N . GLN A 1 48 ? 2.813 5.882 -7.585 1.00 89.08 48 A 1 ATOM 380 C CA . GLN A 1 48 ? 3.118 7.317 -7.688 1.00 89.78 48 A 1 ATOM 381 C C . GLN A 1 48 ? 4.329 7.732 -6.836 1.00 92.03 48 A 1 ATOM 382 O O . GLN A 1 48 ? 4.632 8.919 -6.730 1.00 90.21 48 A 1 ATOM 383 C CB . GLN A 1 48 ? 1.882 8.155 -7.317 1.00 87.16 48 A 1 ATOM 384 C CG . GLN A 1 48 ? 0.692 7.887 -8.244 1.00 82.44 48 A 1 ATOM 385 C CD . GLN A 1 48 ? -0.498 8.811 -7.985 1.00 76.31 48 A 1 ATOM 386 O OE1 . GLN A 1 48 ? -0.676 9.422 -6.941 1.00 70.25 48 A 1 ATOM 387 N NE2 . GLN A 1 48 ? -1.390 8.928 -8.945 1.00 67.13 48 A 1 ATOM 388 N N . TYR A 1 49 ? 5.004 6.775 -6.216 1.00 92.05 49 A 1 ATOM 389 C CA . TYR A 1 49 ? 6.208 7.064 -5.443 1.00 93.78 49 A 1 ATOM 390 C C . TYR A 1 49 ? 7.345 7.502 -6.375 1.00 94.99 49 A 1 ATOM 391 O O . TYR A 1 49 ? 7.689 6.803 -7.330 1.00 94.30 49 A 1 ATOM 392 C CB . TYR A 1 49 ? 6.604 5.847 -4.603 1.00 93.32 49 A 1 ATOM 393 C CG . TYR A 1 49 ? 7.878 6.064 -3.815 1.00 94.14 49 A 1 ATOM 394 C CD1 . TYR A 1 49 ? 9.049 5.347 -4.138 1.00 92.69 49 A 1 ATOM 395 C CD2 . TYR A 1 49 ? 7.918 7.011 -2.775 1.00 92.82 49 A 1 ATOM 396 C CE1 . TYR A 1 49 ? 10.238 5.567 -3.433 1.00 92.48 49 A 1 ATOM 397 C CE2 . TYR A 1 49 ? 9.111 7.244 -2.063 1.00 92.33 49 A 1 ATOM 398 C CZ . TYR A 1 49 ? 10.266 6.516 -2.397 1.00 92.96 49 A 1 ATOM 399 O OH . TYR A 1 49 ? 11.431 6.741 -1.706 1.00 91.45 49 A 1 ATOM 400 N N . TRP A 1 50 ? 7.913 8.669 -6.081 1.00 94.86 50 A 1 ATOM 401 C CA . TRP A 1 50 ? 9.056 9.200 -6.816 1.00 95.75 50 A 1 ATOM 402 C C . TRP A 1 50 ? 10.343 8.649 -6.214 1.00 95.90 50 A 1 ATOM 403 O O . TRP A 1 50 ? 10.775 9.080 -5.141 1.00 94.71 50 A 1 ATOM 404 C CB . TRP A 1 50 ? 9.022 10.719 -6.800 1.00 95.96 50 A 1 ATOM 405 C CG . TRP A 1 50 ? 10.037 11.337 -7.712 1.00 96.50 50 A 1 ATOM 406 C CD1 . TRP A 1 50 ? 11.241 11.832 -7.356 1.00 95.63 50 A 1 ATOM 407 C CD2 . TRP A 1 50 ? 9.934 11.510 -9.159 1.00 96.70 50 A 1 ATOM 408 N NE1 . TRP A 1 50 ? 11.892 12.328 -8.481 1.00 96.01 50 A 1 ATOM 409 C CE2 . TRP A 1 50 ? 11.123 12.150 -9.603 1.00 96.62 50 A 1 ATOM 410 C CE3 . TRP A 1 50 ? 8.946 11.194 -10.117 1.00 96.88 50 A 1 ATOM 411 C CZ2 . TRP A 1 50 ? 11.328 12.477 -10.966 1.00 96.83 50 A 1 ATOM 412 C CZ3 . TRP A 1 50 ? 9.154 11.519 -11.471 1.00 96.46 50 A 1 ATOM 413 C CH2 . TRP A 1 50 ? 10.334 12.152 -11.890 1.00 96.54 50 A 1 ATOM 414 N N . THR A 1 51 ? 10.946 7.688 -6.913 1.00 95.27 51 A 1 ATOM 415 C CA . THR A 1 51 ? 12.145 7.000 -6.431 1.00 95.28 51 A 1 ATOM 416 C C . THR A 1 51 ? 13.398 7.884 -6.558 1.00 95.76 51 A 1 ATOM 417 O O . THR A 1 51 ? 13.436 8.791 -7.399 1.00 95.68 51 A 1 ATOM 418 C CB . THR A 1 51 ? 12.366 5.670 -7.169 1.00 94.63 51 A 1 ATOM 419 O OG1 . THR A 1 51 ? 12.744 5.891 -8.506 1.00 91.47 51 A 1 ATOM 420 C CG2 . THR A 1 51 ? 11.123 4.779 -7.185 1.00 91.23 51 A 1 ATOM 421 N N . PRO A 1 52 ? 14.469 7.596 -5.800 1.00 94.99 52 A 1 ATOM 422 C CA . PRO A 1 52 ? 15.776 8.225 -6.030 1.00 94.90 52 A 1 ATOM 423 C C . PRO A 1 52 ? 16.284 8.042 -7.468 1.00 96.29 52 A 1 ATOM 424 O O . PRO A 1 52 ? 16.905 8.946 -8.025 1.00 96.13 52 A 1 ATOM 425 C CB . PRO A 1 52 ? 16.721 7.572 -5.017 1.00 93.19 52 A 1 ATOM 426 C CG . PRO A 1 52 ? 15.785 7.128 -3.889 1.00 90.33 52 A 1 ATOM 427 C CD . PRO A 1 52 ? 14.521 6.717 -4.637 1.00 92.88 52 A 1 ATOM 428 N N . LEU A 1 53 ? 15.969 6.904 -8.089 1.00 94.68 53 A 1 ATOM 429 C CA . LEU A 1 53 ? 16.308 6.639 -9.487 1.00 95.35 53 A 1 ATOM 430 C C . LEU A 1 53 ? 15.570 7.597 -10.434 1.00 96.90 53 A 1 ATOM 431 O O . LEU A 1 53 ? 16.187 8.162 -11.334 1.00 97.00 53 A 1 ATOM 432 C CB . LEU A 1 53 ? 15.987 5.167 -9.809 1.00 94.09 53 A 1 ATOM 433 C CG . LEU A 1 53 ? 16.596 4.693 -11.143 1.00 87.07 53 A 1 ATOM 434 C CD1 . LEU A 1 53 ? 18.103 4.452 -11.010 1.00 82.04 53 A 1 ATOM 435 C CD2 . LEU A 1 53 ? 15.933 3.379 -11.576 1.00 81.81 53 A 1 ATOM 436 N N . ASN A 1 54 ? 14.282 7.839 -10.194 1.00 96.94 54 A 1 ATOM 437 C CA . ASN A 1 54 ? 13.496 8.806 -10.961 1.00 97.42 54 A 1 ATOM 438 C C . ASN A 1 54 ? 14.044 10.231 -10.795 1.00 98.06 54 A 1 ATOM 439 O O . ASN A 1 54 ? 14.091 10.989 -11.761 1.00 98.13 54 A 1 ATOM 440 C CB . ASN A 1 54 ? 12.030 8.763 -10.502 1.00 97.00 54 A 1 ATOM 441 C CG . ASN A 1 54 ? 11.284 7.487 -10.850 1.00 96.08 54 A 1 ATOM 442 O OD1 . ASN A 1 54 ? 11.731 6.622 -11.573 1.00 89.53 54 A 1 ATOM 443 N ND2 . ASN A 1 54 ? 10.083 7.337 -10.327 1.00 87.97 54 A 1 ATOM 444 N N . GLN A 1 55 ? 14.477 10.586 -9.589 1.00 97.36 55 A 1 ATOM 445 C CA . GLN A 1 55 ? 15.090 11.892 -9.338 1.00 97.74 55 A 1 ATOM 446 C C . GLN A 1 55 ? 16.362 12.069 -10.172 1.00 98.29 55 A 1 ATOM 447 O O . GLN A 1 55 ? 16.487 13.070 -10.875 1.00 98.26 55 A 1 ATOM 448 C CB . GLN A 1 55 ? 15.372 12.041 -7.838 1.00 97.07 55 A 1 ATOM 449 C CG . GLN A 1 55 ? 15.934 13.423 -7.464 1.00 95.39 55 A 1 ATOM 450 C CD . GLN A 1 55 ? 14.928 14.570 -7.601 1.00 96.12 55 A 1 ATOM 451 O OE1 . GLN A 1 55 ? 13.734 14.395 -7.780 1.00 91.46 55 A 1 ATOM 452 N NE2 . GLN A 1 55 ? 15.388 15.792 -7.475 1.00 90.11 55 A 1 ATOM 453 N N . LYS A 1 56 ? 17.257 11.078 -10.151 1.00 97.83 56 A 1 ATOM 454 C CA . LYS A 1 56 ? 18.484 11.099 -10.958 1.00 98.11 56 A 1 ATOM 455 C C . LYS A 1 56 ? 18.200 11.100 -12.460 1.00 98.49 56 A 1 ATOM 456 O O . LYS A 1 56 ? 18.840 11.843 -13.194 1.00 98.34 56 A 1 ATOM 457 C CB . LYS A 1 56 ? 19.388 9.919 -10.562 1.00 97.66 56 A 1 ATOM 458 C CG . LYS A 1 56 ? 20.117 10.121 -9.221 1.00 88.63 56 A 1 ATOM 459 C CD . LYS A 1 56 ? 21.117 11.281 -9.344 1.00 80.37 56 A 1 ATOM 460 C CE . LYS A 1 56 ? 21.993 11.515 -8.122 1.00 72.82 56 A 1 ATOM 461 N NZ . LYS A 1 56 ? 22.874 12.696 -8.365 1.00 61.44 56 A 1 ATOM 462 N N . ALA A 1 57 ? 17.220 10.339 -12.908 1.00 98.48 57 A 1 ATOM 463 C CA . ALA A 1 57 ? 16.795 10.323 -14.303 1.00 98.52 57 A 1 ATOM 464 C C . ALA A 1 57 ? 16.304 11.705 -14.764 1.00 98.67 57 A 1 ATOM 465 O O . ALA A 1 57 ? 16.716 12.185 -15.817 1.00 98.53 57 A 1 ATOM 466 C CB . ALA A 1 57 ? 15.722 9.241 -14.470 1.00 98.22 57 A 1 ATOM 467 N N . LEU A 1 58 ? 15.499 12.393 -13.952 1.00 98.71 58 A 1 ATOM 468 C CA . LEU A 1 58 ? 15.050 13.751 -14.273 1.00 98.77 58 A 1 ATOM 469 C C . LEU A 1 58 ? 16.219 14.744 -14.315 1.00 98.82 58 A 1 ATOM 470 O O . LEU A 1 58 ? 16.276 15.564 -15.226 1.00 98.70 58 A 1 ATOM 471 C CB . LEU A 1 58 ? 13.968 14.177 -13.273 1.00 98.64 58 A 1 ATOM 472 C CG . LEU A 1 58 ? 13.432 15.603 -13.499 1.00 98.32 58 A 1 ATOM 473 C CD1 . LEU A 1 58 ? 12.869 15.825 -14.905 1.00 97.87 58 A 1 ATOM 474 C CD2 . LEU A 1 58 ? 12.310 15.885 -12.497 1.00 97.85 58 A 1 ATOM 475 N N . GLN A 1 59 ? 17.146 14.664 -13.364 1.00 98.76 59 A 1 ATOM 476 C CA . GLN A 1 59 ? 18.319 15.546 -13.332 1.00 98.75 59 A 1 ATOM 477 C C . GLN A 1 59 ? 19.200 15.358 -14.573 1.00 98.76 59 A 1 ATOM 478 O O . GLN A 1 59 ? 19.535 16.354 -15.218 1.00 98.53 59 A 1 ATOM 479 C CB . GLN A 1 59 ? 19.108 15.318 -12.036 1.00 98.61 59 A 1 ATOM 480 C CG . GLN A 1 59 ? 18.369 15.875 -10.814 1.00 98.04 59 A 1 ATOM 481 C CD . GLN A 1 59 ? 19.206 15.728 -9.546 1.00 97.17 59 A 1 ATOM 482 O OE1 . GLN A 1 59 ? 19.197 14.716 -8.873 1.00 91.20 59 A 1 ATOM 483 N NE2 . GLN A 1 59 ? 19.962 16.740 -9.185 1.00 89.19 59 A 1 ATOM 484 N N . ARG A 1 60 ? 19.478 14.119 -14.984 1.00 98.70 60 A 1 ATOM 485 C CA . ARG A 1 60 ? 20.178 13.827 -16.248 1.00 98.59 60 A 1 ATOM 486 C C . ARG A 1 60 ? 19.400 14.319 -17.464 1.00 98.67 60 A 1 ATOM 487 O O . ARG A 1 60 ? 19.978 14.930 -18.351 1.00 98.31 60 A 1 ATOM 488 C CB . ARG A 1 60 ? 20.412 12.325 -16.415 1.00 97.95 60 A 1 ATOM 489 C CG . ARG A 1 60 ? 21.480 11.751 -15.487 1.00 90.31 60 A 1 ATOM 490 C CD . ARG A 1 60 ? 21.863 10.344 -15.945 1.00 90.56 60 A 1 ATOM 491 N NE . ARG A 1 60 ? 20.692 9.470 -16.098 1.00 83.36 60 A 1 ATOM 492 C CZ . ARG A 1 60 ? 20.186 8.622 -15.222 1.00 79.54 60 A 1 ATOM 493 N NH1 . ARG A 1 60 ? 20.756 8.398 -14.069 1.00 69.48 60 A 1 ATOM 494 N NH2 . ARG A 1 60 ? 19.090 7.981 -15.513 1.00 71.21 60 A 1 ATOM 495 N N . GLY A 1 61 ? 18.097 14.093 -17.492 1.00 98.66 61 A 1 ATOM 496 C CA . GLY A 1 61 ? 17.249 14.557 -18.588 1.00 98.63 61 A 1 ATOM 497 C C . GLY A 1 61 ? 17.294 16.077 -18.770 1.00 98.71 61 A 1 ATOM 498 O O . GLY A 1 61 ? 17.351 16.564 -19.898 1.00 98.48 61 A 1 ATOM 499 N N . ILE A 1 62 ? 17.327 16.839 -17.676 1.00 98.77 62 A 1 ATOM 500 C CA . ILE A 1 62 ? 17.491 18.303 -17.715 1.00 98.76 62 A 1 ATOM 501 C C . ILE A 1 62 ? 18.852 18.687 -18.307 1.00 98.75 62 A 1 ATOM 502 O O . ILE A 1 62 ? 18.915 19.605 -19.127 1.00 98.46 62 A 1 ATOM 503 C CB . ILE A 1 62 ? 17.291 18.906 -16.307 1.00 98.58 62 A 1 ATOM 504 C CG1 . ILE A 1 62 ? 15.805 18.807 -15.888 1.00 97.63 62 A 1 ATOM 505 C CG2 . ILE A 1 62 ? 17.743 20.381 -16.241 1.00 97.64 62 A 1 ATOM 506 C CD1 . ILE A 1 62 ? 15.601 18.974 -14.376 1.00 96.16 62 A 1 ATOM 507 N N . GLU A 1 63 ? 19.914 17.982 -17.928 1.00 98.74 63 A 1 ATOM 508 C CA . GLU A 1 63 ? 21.261 18.227 -18.459 1.00 98.64 63 A 1 ATOM 509 C C . GLU A 1 63 ? 21.374 17.887 -19.957 1.00 98.59 63 A 1 ATOM 510 O O . GLU A 1 63 ? 21.952 18.644 -20.742 1.00 97.99 63 A 1 ATOM 511 C CB . GLU A 1 63 ? 22.258 17.421 -17.615 1.00 98.30 63 A 1 ATOM 512 C CG . GLU A 1 63 ? 23.711 17.633 -18.051 1.00 95.69 63 A 1 ATOM 513 C CD . GLU A 1 63 ? 24.725 16.992 -17.092 1.00 94.92 63 A 1 ATOM 514 O OE1 . GLU A 1 63 ? 25.937 17.179 -17.341 1.00 88.76 63 A 1 ATOM 515 O OE2 . GLU A 1 63 ? 24.308 16.354 -16.102 1.00 90.32 63 A 1 ATOM 516 N N . LEU A 1 64 ? 20.770 16.775 -20.387 1.00 98.60 64 A 1 ATOM 517 C CA . LEU A 1 64 ? 20.871 16.271 -21.756 1.00 98.46 64 A 1 ATOM 518 C C . LEU A 1 64 ? 19.983 17.026 -22.748 1.00 98.51 64 A 1 ATOM 519 O O . LEU A 1 64 ? 20.420 17.332 -23.863 1.00 97.83 64 A 1 ATOM 520 C CB . LEU A 1 64 ? 20.533 14.770 -21.761 1.00 98.03 64 A 1 ATOM 521 C CG . LEU A 1 64 ? 21.576 13.874 -21.064 1.00 95.71 64 A 1 ATOM 522 C CD1 . LEU A 1 64 ? 21.041 12.443 -20.999 1.00 91.54 64 A 1 ATOM 523 C CD2 . LEU A 1 64 ? 22.911 13.860 -21.808 1.00 91.03 64 A 1 ATOM 524 N N . PHE A 1 65 ? 18.743 17.336 -22.357 1.00 98.59 65 A 1 ATOM 525 C CA . PHE A 1 65 ? 17.714 17.869 -23.260 1.00 98.53 65 A 1 ATOM 526 C C . PHE A 1 65 ? 17.315 19.311 -22.955 1.00 98.50 65 A 1 ATOM 527 O O . PHE A 1 65 ? 16.844 20.018 -23.847 1.00 97.45 65 A 1 ATOM 528 C CB . PHE A 1 65 ? 16.504 16.933 -23.259 1.00 98.32 65 A 1 ATOM 529 C CG . PHE A 1 65 ? 16.842 15.518 -23.676 1.00 98.28 65 A 1 ATOM 530 C CD1 . PHE A 1 65 ? 17.042 15.208 -25.035 1.00 97.16 65 A 1 ATOM 531 C CD2 . PHE A 1 65 ? 17.003 14.509 -22.707 1.00 97.31 65 A 1 ATOM 532 C CE1 . PHE A 1 65 ? 17.406 13.916 -25.422 1.00 96.53 65 A 1 ATOM 533 C CE2 . PHE A 1 65 ? 17.369 13.210 -23.089 1.00 96.72 65 A 1 ATOM 534 C CZ . PHE A 1 65 ? 17.575 12.916 -24.448 1.00 96.99 65 A 1 ATOM 535 N N . GLY A 1 66 ? 17.539 19.778 -21.747 1.00 98.29 66 A 1 ATOM 536 C CA . GLY A 1 66 ? 17.174 21.113 -21.290 1.00 98.28 66 A 1 ATOM 537 C C . GLY A 1 66 ? 15.811 21.181 -20.604 1.00 98.45 66 A 1 ATOM 538 O O . GLY A 1 66 ? 14.893 20.395 -20.851 1.00 97.67 66 A 1 ATOM 539 N N . VAL A 1 67 ? 15.666 22.173 -19.728 1.00 98.43 67 A 1 ATOM 540 C CA . VAL A 1 67 ? 14.421 22.456 -19.003 1.00 98.41 67 A 1 ATOM 541 C C . VAL A 1 67 ? 13.292 22.750 -19.994 1.00 98.30 67 A 1 ATOM 542 O O . VAL A 1 67 ? 13.466 23.510 -20.946 1.00 97.42 67 A 1 ATOM 543 C CB . VAL A 1 67 ? 14.612 23.636 -18.033 1.00 97.98 67 A 1 ATOM 544 C CG1 . VAL A 1 67 ? 13.326 23.981 -17.282 1.00 96.80 67 A 1 ATOM 545 C CG2 . VAL A 1 67 ? 15.688 23.334 -16.983 1.00 96.92 67 A 1 ATOM 546 N N . GLY A 1 68 ? 12.116 22.156 -19.759 1.00 97.66 68 A 1 ATOM 547 C CA . GLY A 1 68 ? 10.930 22.335 -20.608 1.00 97.27 68 A 1 ATOM 548 C C . GLY A 1 68 ? 10.801 21.322 -21.743 1.00 97.65 68 A 1 ATOM 549 O O . GLY A 1 68 ? 9.688 21.112 -22.230 1.00 96.28 68 A 1 ATOM 550 N N . ASN A 1 69 ? 11.876 20.624 -22.110 1.00 98.08 69 A 1 ATOM 551 C CA . ASN A 1 69 ? 11.861 19.573 -23.134 1.00 98.25 69 A 1 ATOM 552 C C . ASN A 1 69 ? 11.346 18.237 -22.563 1.00 98.38 69 A 1 ATOM 553 O O . ASN A 1 69 ? 11.981 17.184 -22.627 1.00 97.70 69 A 1 ATOM 554 C CB . ASN A 1 69 ? 13.243 19.497 -23.801 1.00 97.99 69 A 1 ATOM 555 C CG . ASN A 1 69 ? 13.562 20.756 -24.591 1.00 96.96 69 A 1 ATOM 556 O OD1 . ASN A 1 69 ? 12.712 21.382 -25.205 1.00 88.43 69 A 1 ATOM 557 N ND2 . ASN A 1 69 ? 14.805 21.168 -24.601 1.00 87.32 69 A 1 ATOM 558 N N . TRP A 1 70 ? 10.154 18.290 -21.961 1.00 98.20 70 A 1 ATOM 559 C CA . TRP A 1 70 ? 9.588 17.182 -21.189 1.00 98.07 70 A 1 ATOM 560 C C . TRP A 1 70 ? 9.299 15.935 -22.014 1.00 98.22 70 A 1 ATOM 561 O O . TRP A 1 70 ? 9.335 14.830 -21.474 1.00 97.77 70 A 1 ATOM 562 C CB . TRP A 1 70 ? 8.300 17.639 -20.506 1.00 97.47 70 A 1 ATOM 563 C CG . TRP A 1 70 ? 8.409 18.895 -19.704 1.00 97.34 70 A 1 ATOM 564 C CD1 . TRP A 1 70 ? 7.599 19.968 -19.807 1.00 96.33 70 A 1 ATOM 565 C CD2 . TRP A 1 70 ? 9.405 19.238 -18.691 1.00 97.20 70 A 1 ATOM 566 N NE1 . TRP A 1 70 ? 8.013 20.959 -18.935 1.00 95.87 70 A 1 ATOM 567 C CE2 . TRP A 1 70 ? 9.129 20.555 -18.238 1.00 96.49 70 A 1 ATOM 568 C CE3 . TRP A 1 70 ? 10.519 18.570 -18.133 1.00 96.37 70 A 1 ATOM 569 C CZ2 . TRP A 1 70 ? 9.938 21.199 -17.278 1.00 95.32 70 A 1 ATOM 570 C CZ3 . TRP A 1 70 ? 11.327 19.212 -17.174 1.00 95.31 70 A 1 ATOM 571 C CH2 . TRP A 1 70 ? 11.037 20.514 -16.761 1.00 95.08 70 A 1 ATOM 572 N N . LYS A 1 71 ? 8.964 16.076 -23.302 1.00 98.05 71 A 1 ATOM 573 C CA . LYS A 1 71 ? 8.679 14.925 -24.169 1.00 97.89 71 A 1 ATOM 574 C C . LYS A 1 71 ? 9.940 14.100 -24.410 1.00 98.15 71 A 1 ATOM 575 O O . LYS A 1 71 ? 9.890 12.883 -24.285 1.00 97.57 71 A 1 ATOM 576 C CB . LYS A 1 71 ? 8.081 15.378 -25.501 1.00 97.10 71 A 1 ATOM 577 C CG . LYS A 1 71 ? 6.638 15.883 -25.351 1.00 86.18 71 A 1 ATOM 578 C CD . LYS A 1 71 ? 6.096 16.243 -26.735 1.00 82.86 71 A 1 ATOM 579 C CE . LYS A 1 71 ? 4.652 16.729 -26.649 1.00 70.05 71 A 1 ATOM 580 N NZ . LYS A 1 71 ? 4.146 17.107 -27.994 1.00 60.54 71 A 1 ATOM 581 N N . GLU A 1 72 ? 11.035 14.771 -24.710 1.00 98.21 72 A 1 ATOM 582 C CA . GLU A 1 72 ? 12.353 14.188 -24.935 1.00 98.23 72 A 1 ATOM 583 C C . GLU A 1 72 ? 12.864 13.526 -23.651 1.00 98.38 72 A 1 ATOM 584 O O . GLU A 1 72 ? 13.180 12.338 -23.660 1.00 97.81 72 A 1 ATOM 585 C CB . GLU A 1 72 ? 13.317 15.282 -25.435 1.00 97.75 72 A 1 ATOM 586 C CG . GLU A 1 72 ? 12.973 15.895 -26.809 1.00 92.67 72 A 1 ATOM 587 C CD . GLU A 1 72 ? 11.832 16.935 -26.843 1.00 86.51 72 A 1 ATOM 588 O OE1 . GLU A 1 72 ? 11.526 17.417 -27.958 1.00 75.91 72 A 1 ATOM 589 O OE2 . GLU A 1 72 ? 11.212 17.242 -25.792 1.00 76.00 72 A 1 ATOM 590 N N . ILE A 1 73 ? 12.812 14.241 -22.525 1.00 98.54 73 A 1 ATOM 591 C CA . ILE A 1 73 ? 13.191 13.708 -21.207 1.00 98.57 73 A 1 ATOM 592 C C . ILE A 1 73 ? 12.346 12.478 -20.853 1.00 98.55 73 A 1 ATOM 593 O O . ILE A 1 73 ? 12.868 11.454 -20.418 1.00 98.23 73 A 1 ATOM 594 C CB . ILE A 1 73 ? 13.056 14.800 -20.119 1.00 98.49 73 A 1 ATOM 595 C CG1 . ILE A 1 73 ? 14.068 15.944 -20.371 1.00 98.13 73 A 1 ATOM 596 C CG2 . ILE A 1 73 ? 13.255 14.214 -18.707 1.00 98.08 73 A 1 ATOM 597 C CD1 . ILE A 1 73 ? 13.863 17.181 -19.488 1.00 97.25 73 A 1 ATOM 598 N N . ASN A 1 74 ? 11.027 12.554 -21.049 1.00 98.54 74 A 1 ATOM 599 C CA . ASN A 1 74 ? 10.136 11.440 -20.728 1.00 98.40 74 A 1 ATOM 600 C C . ASN A 1 74 ? 10.420 10.209 -21.597 1.00 98.30 74 A 1 ATOM 601 O O . ASN A 1 74 ? 10.382 9.082 -21.097 1.00 97.68 74 A 1 ATOM 602 C CB . ASN A 1 74 ? 8.683 11.919 -20.882 1.00 97.91 74 A 1 ATOM 603 C CG . ASN A 1 74 ? 7.656 10.912 -20.385 1.00 97.59 74 A 1 ATOM 604 O OD1 . ASN A 1 74 ? 7.924 9.949 -19.692 1.00 94.76 74 A 1 ATOM 605 N ND2 . ASN A 1 74 ? 6.399 11.124 -20.709 1.00 93.96 74 A 1 ATOM 606 N N . TYR A 1 75 ? 10.690 10.415 -22.890 1.00 98.32 75 A 1 ATOM 607 C CA . TYR A 1 75 ? 10.967 9.317 -23.809 1.00 98.12 75 A 1 ATOM 608 C C . TYR A 1 75 ? 12.300 8.626 -23.492 1.00 98.20 75 A 1 ATOM 609 O O . TYR A 1 75 ? 12.335 7.401 -23.401 1.00 97.10 75 A 1 ATOM 610 C CB . TYR A 1 75 ? 10.923 9.841 -25.247 1.00 97.39 75 A 1 ATOM 611 C CG . TYR A 1 75 ? 11.042 8.739 -26.273 1.00 89.26 75 A 1 ATOM 612 C CD1 . TYR A 1 75 ? 12.290 8.444 -26.858 1.00 82.15 75 A 1 ATOM 613 C CD2 . TYR A 1 75 ? 9.913 7.974 -26.627 1.00 81.12 75 A 1 ATOM 614 C CE1 . TYR A 1 75 ? 12.407 7.403 -27.788 1.00 74.81 75 A 1 ATOM 615 C CE2 . TYR A 1 75 ? 10.020 6.929 -27.556 1.00 73.17 75 A 1 ATOM 616 C CZ . TYR A 1 75 ? 11.271 6.649 -28.134 1.00 71.71 75 A 1 ATOM 617 O OH . TYR A 1 75 ? 11.384 5.627 -29.045 1.00 71.51 75 A 1 ATOM 618 N N . ASP A 1 76 ? 13.348 9.410 -23.271 1.00 97.94 76 A 1 ATOM 619 C CA . ASP A 1 76 ? 14.704 8.903 -23.050 1.00 97.76 76 A 1 ATOM 620 C C . ASP A 1 76 ? 14.886 8.319 -21.641 1.00 97.87 76 A 1 ATOM 621 O O . ASP A 1 76 ? 15.235 7.153 -21.468 1.00 96.63 76 A 1 ATOM 622 C CB . ASP A 1 76 ? 15.684 10.045 -23.334 1.00 97.16 76 A 1 ATOM 623 C CG . ASP A 1 76 ? 17.123 9.550 -23.436 1.00 92.41 76 A 1 ATOM 624 O OD1 . ASP A 1 76 ? 17.421 8.892 -24.460 1.00 83.99 76 A 1 ATOM 625 O OD2 . ASP A 1 76 ? 17.916 9.872 -22.528 1.00 83.53 76 A 1 ATOM 626 N N . GLU A 1 77 ? 14.558 9.094 -20.605 1.00 97.99 77 A 1 ATOM 627 C CA . GLU A 1 77 ? 14.852 8.741 -19.211 1.00 97.89 77 A 1 ATOM 628 C C . GLU A 1 77 ? 13.739 7.944 -18.514 1.00 97.73 77 A 1 ATOM 629 O O . GLU A 1 77 ? 13.987 7.257 -17.522 1.00 95.94 77 A 1 ATOM 630 C CB . GLU A 1 77 ? 15.164 10.023 -18.427 1.00 97.43 77 A 1 ATOM 631 C CG . GLU A 1 77 ? 16.473 10.706 -18.865 1.00 95.17 77 A 1 ATOM 632 C CD . GLU A 1 77 ? 17.734 9.955 -18.391 1.00 94.57 77 A 1 ATOM 633 O OE1 . GLU A 1 77 ? 18.841 10.323 -18.811 1.00 86.28 77 A 1 ATOM 634 O OE2 . GLU A 1 77 ? 17.652 9.068 -17.499 1.00 88.81 77 A 1 ATOM 635 N N . PHE A 1 78 ? 12.489 8.024 -19.004 1.00 97.89 78 A 1 ATOM 636 C CA . PHE A 1 78 ? 11.331 7.395 -18.356 1.00 97.71 78 A 1 ATOM 637 C C . PHE A 1 78 ? 10.560 6.427 -19.262 1.00 97.25 78 A 1 ATOM 638 O O . PHE A 1 78 ? 9.482 5.943 -18.883 1.00 94.57 78 A 1 ATOM 639 C CB . PHE A 1 78 ? 10.414 8.464 -17.749 1.00 97.58 78 A 1 ATOM 640 C CG . PHE A 1 78 ? 11.076 9.332 -16.702 1.00 98.01 78 A 1 ATOM 641 C CD1 . PHE A 1 78 ? 11.050 8.956 -15.343 1.00 97.45 78 A 1 ATOM 642 C CD2 . PHE A 1 78 ? 11.743 10.514 -17.071 1.00 97.55 78 A 1 ATOM 643 C CE1 . PHE A 1 78 ? 11.672 9.748 -14.374 1.00 97.17 78 A 1 ATOM 644 C CE2 . PHE A 1 78 ? 12.373 11.312 -16.103 1.00 97.30 78 A 1 ATOM 645 C CZ . PHE A 1 78 ? 12.335 10.930 -14.754 1.00 97.66 78 A 1 ATOM 646 N N . SER A 1 79 ? 11.063 6.128 -20.451 1.00 97.67 79 A 1 ATOM 647 C CA . SER A 1 79 ? 10.388 5.278 -21.446 1.00 97.22 79 A 1 ATOM 648 C C . SER A 1 79 ? 8.957 5.747 -21.777 1.00 97.38 79 A 1 ATOM 649 O O . SER A 1 79 ? 8.053 4.929 -21.977 1.00 94.65 79 A 1 ATOM 650 C CB . SER A 1 79 ? 10.408 3.805 -21.016 1.00 96.00 79 A 1 ATOM 651 O OG . SER A 1 79 ? 11.701 3.347 -20.699 1.00 89.41 79 A 1 ATOM 652 N N . GLY A 1 80 ? 8.717 7.052 -21.751 1.00 97.07 80 A 1 ATOM 653 C CA . GLY A 1 80 ? 7.414 7.674 -22.007 1.00 96.87 80 A 1 ATOM 654 C C . GLY A 1 80 ? 6.360 7.481 -20.908 1.00 96.86 80 A 1 ATOM 655 O O . GLY A 1 80 ? 5.197 7.840 -21.114 1.00 94.64 80 A 1 ATOM 656 N N . LYS A 1 81 ? 6.722 6.911 -19.753 1.00 96.40 81 A 1 ATOM 657 C CA . LYS A 1 81 ? 5.771 6.544 -18.682 1.00 95.05 81 A 1 ATOM 658 C C . LYS A 1 81 ? 5.545 7.645 -17.648 1.00 95.05 81 A 1 ATOM 659 O O . LYS A 1 81 ? 4.586 7.559 -16.878 1.00 92.54 81 A 1 ATOM 660 C CB . LYS A 1 81 ? 6.242 5.262 -17.986 1.00 93.40 81 A 1 ATOM 661 C CG . LYS A 1 81 ? 6.256 4.054 -18.932 1.00 89.26 81 A 1 ATOM 662 C CD . LYS A 1 81 ? 6.756 2.813 -18.188 1.00 81.10 81 A 1 ATOM 663 C CE . LYS A 1 81 ? 6.843 1.635 -19.158 1.00 73.70 81 A 1 ATOM 664 N NZ . LYS A 1 81 ? 7.468 0.452 -18.524 1.00 64.18 81 A 1 ATOM 665 N N . ALA A 1 82 ? 6.408 8.651 -17.591 1.00 95.70 82 A 1 ATOM 666 C CA . ALA A 1 82 ? 6.279 9.733 -16.626 1.00 95.72 82 A 1 ATOM 667 C C . ALA A 1 82 ? 5.131 10.684 -17.000 1.00 95.59 82 A 1 ATOM 668 O O . ALA A 1 82 ? 4.792 10.891 -18.168 1.00 94.11 82 A 1 ATOM 669 C CB . ALA A 1 82 ? 7.613 10.467 -16.480 1.00 95.40 82 A 1 ATOM 670 N N . ASN A 1 83 ? 4.544 11.306 -15.970 1.00 95.64 83 A 1 ATOM 671 C CA . ASN A 1 83 ? 3.612 12.404 -16.167 1.00 95.14 83 A 1 ATOM 672 C C . ASN A 1 83 ? 4.409 13.699 -16.398 1.00 95.84 83 A 1 ATOM 673 O O . ASN A 1 83 ? 5.112 14.160 -15.503 1.00 95.03 83 A 1 ATOM 674 C CB . ASN A 1 83 ? 2.678 12.469 -14.950 1.00 93.11 83 A 1 ATOM 675 C CG . ASN A 1 83 ? 1.624 13.555 -15.059 1.00 90.15 83 A 1 ATOM 676 O OD1 . ASN A 1 83 ? 1.677 14.466 -15.863 1.00 82.20 83 A 1 ATOM 677 N ND2 . ASN A 1 83 ? 0.610 13.488 -14.224 1.00 80.33 83 A 1 ATOM 678 N N . ILE A 1 84 ? 4.252 14.316 -17.572 1.00 94.24 84 A 1 ATOM 679 C CA . ILE A 1 84 ? 4.949 15.562 -17.939 1.00 94.56 84 A 1 ATOM 680 C C . ILE A 1 84 ? 4.709 16.680 -16.912 1.00 95.36 84 A 1 ATOM 681 O O . ILE A 1 84 ? 5.625 17.428 -16.584 1.00 93.99 84 A 1 ATOM 682 C CB . ILE A 1 84 ? 4.525 15.998 -19.362 1.00 92.00 84 A 1 ATOM 683 C CG1 . ILE A 1 84 ? 5.049 14.980 -20.401 1.00 84.07 84 A 1 ATOM 684 C CG2 . ILE A 1 84 ? 5.015 17.415 -19.685 1.00 80.60 84 A 1 ATOM 685 C CD1 . ILE A 1 84 ? 4.566 15.238 -21.836 1.00 76.90 84 A 1 ATOM 686 N N . VAL A 1 85 ? 3.498 16.775 -16.361 1.00 94.54 85 A 1 ATOM 687 C CA . VAL A 1 85 ? 3.184 17.763 -15.315 1.00 93.92 85 A 1 ATOM 688 C C . VAL A 1 85 ? 3.996 17.487 -14.051 1.00 94.93 85 A 1 ATOM 689 O O . VAL A 1 85 ? 4.473 18.420 -13.410 1.00 94.47 85 A 1 ATOM 690 C CB . VAL A 1 85 ? 1.679 17.776 -14.988 1.00 92.21 85 A 1 ATOM 691 C CG1 . VAL A 1 85 ? 1.329 18.801 -13.906 1.00 87.15 85 A 1 ATOM 692 C CG2 . VAL A 1 85 ? 0.844 18.110 -16.234 1.00 86.88 85 A 1 ATOM 693 N N . GLU A 1 86 ? 4.193 16.218 -13.701 1.00 95.29 86 A 1 ATOM 694 C CA . GLU A 1 86 ? 5.044 15.861 -12.568 1.00 95.65 86 A 1 ATOM 695 C C . GLU A 1 86 ? 6.506 16.223 -12.836 1.00 96.40 86 A 1 ATOM 696 O O . GLU A 1 86 ? 7.145 16.788 -11.953 1.00 96.19 86 A 1 ATOM 697 C CB . GLU A 1 86 ? 4.866 14.384 -12.194 1.00 94.82 86 A 1 ATOM 698 C CG . GLU A 1 86 ? 5.709 14.022 -10.965 1.00 93.57 86 A 1 ATOM 699 C CD . GLU A 1 86 ? 5.375 12.673 -10.327 1.00 93.39 86 A 1 ATOM 700 O OE1 . GLU A 1 86 ? 5.808 12.488 -9.161 1.00 88.92 86 A 1 ATOM 701 O OE2 . GLU A 1 86 ? 4.679 11.848 -10.955 1.00 90.14 86 A 1 ATOM 702 N N . LEU A 1 87 ? 7.020 15.996 -14.051 1.00 96.75 87 A 1 ATOM 703 C CA . LEU A 1 87 ? 8.388 16.389 -14.418 1.00 97.52 87 A 1 ATOM 704 C C . LEU A 1 87 ? 8.607 17.897 -14.241 1.00 97.56 87 A 1 ATOM 705 O O . LEU A 1 87 ? 9.602 18.307 -13.647 1.00 97.40 87 A 1 ATOM 706 C CB . LEU A 1 87 ? 8.720 15.968 -15.864 1.00 97.82 87 A 1 ATOM 707 C CG . LEU A 1 87 ? 8.649 14.460 -16.168 1.00 97.26 87 A 1 ATOM 708 C CD1 . LEU A 1 87 ? 9.069 14.214 -17.614 1.00 96.72 87 A 1 ATOM 709 C CD2 . LEU A 1 87 ? 9.549 13.632 -15.253 1.00 96.30 87 A 1 ATOM 710 N N . GLU A 1 88 ? 7.648 18.716 -14.666 1.00 96.94 88 A 1 ATOM 711 C CA . GLU A 1 88 ? 7.704 20.170 -14.472 1.00 96.44 88 A 1 ATOM 712 C C . GLU A 1 88 ? 7.702 20.547 -12.982 1.00 96.90 88 A 1 ATOM 713 O O . GLU A 1 88 ? 8.542 21.323 -12.526 1.00 96.31 88 A 1 ATOM 714 C CB . GLU A 1 88 ? 6.527 20.831 -15.205 1.00 94.99 88 A 1 ATOM 715 C CG . GLU A 1 88 ? 6.700 22.354 -15.310 1.00 88.89 88 A 1 ATOM 716 C CD . GLU A 1 88 ? 5.447 23.070 -15.834 1.00 83.87 88 A 1 ATOM 717 O OE1 . GLU A 1 88 ? 5.222 24.231 -15.405 1.00 76.22 88 A 1 ATOM 718 O OE2 . GLU A 1 88 ? 4.674 22.459 -16.598 1.00 76.51 88 A 1 ATOM 719 N N . LEU A 1 89 ? 6.800 19.960 -12.190 1.00 96.76 89 A 1 ATOM 720 C CA . LEU A 1 89 ? 6.707 20.223 -10.751 1.00 96.66 89 A 1 ATOM 721 C C . LEU A 1 89 ? 7.974 19.789 -10.001 1.00 97.17 89 A 1 ATOM 722 O O . LEU A 1 89 ? 8.465 20.519 -9.137 1.00 96.95 89 A 1 ATOM 723 C CB . LEU A 1 89 ? 5.481 19.494 -10.179 1.00 95.84 89 A 1 ATOM 724 C CG . LEU A 1 89 ? 4.125 20.076 -10.613 1.00 93.85 89 A 1 ATOM 725 C CD1 . LEU A 1 89 ? 3.000 19.168 -10.119 1.00 90.80 89 A 1 ATOM 726 C CD2 . LEU A 1 89 ? 3.903 21.469 -10.040 1.00 90.20 89 A 1 ATOM 727 N N . ARG A 1 90 ? 8.523 18.628 -10.347 1.00 97.69 90 A 1 ATOM 728 C CA . ARG A 1 90 ? 9.779 18.119 -9.780 1.00 97.78 90 A 1 ATOM 729 C C . ARG A 1 90 ? 10.953 19.016 -10.155 1.00 98.15 90 A 1 ATOM 730 O O . ARG A 1 90 ? 11.785 19.300 -9.301 1.00 97.89 90 A 1 ATOM 731 C CB . ARG A 1 90 ? 10.017 16.683 -10.253 1.00 97.26 90 A 1 ATOM 732 C CG . ARG A 1 90 ? 9.005 15.658 -9.706 1.00 95.27 90 A 1 ATOM 733 C CD . ARG A 1 90 ? 9.199 15.351 -8.231 1.00 93.65 90 A 1 ATOM 734 N NE . ARG A 1 90 ? 8.184 14.379 -7.799 1.00 91.94 90 A 1 ATOM 735 C CZ . ARG A 1 90 ? 8.018 13.893 -6.593 1.00 92.59 90 A 1 ATOM 736 N NH1 . ARG A 1 90 ? 8.805 14.214 -5.599 1.00 85.42 90 A 1 ATOM 737 N NH2 . ARG A 1 90 ? 7.029 13.072 -6.365 1.00 88.62 90 A 1 ATOM 738 N N . THR A 1 91 ? 10.975 19.546 -11.379 1.00 98.06 91 A 1 ATOM 739 C CA . THR A 1 91 ? 12.003 20.506 -11.813 1.00 98.32 91 A 1 ATOM 740 C C . THR A 1 91 ? 11.908 21.825 -11.053 1.00 98.32 91 A 1 ATOM 741 O O . THR A 1 91 ? 12.934 22.356 -10.636 1.00 98.08 91 A 1 ATOM 742 C CB . THR A 1 91 ? 11.937 20.733 -13.324 1.00 98.32 91 A 1 ATOM 743 O OG1 . THR A 1 91 ? 12.103 19.492 -13.965 1.00 96.67 91 A 1 ATOM 744 C CG2 . THR A 1 91 ? 13.055 21.645 -13.817 1.00 96.59 91 A 1 ATOM 745 N N . CYS A 1 92 ? 10.707 22.317 -10.748 1.00 98.11 92 A 1 ATOM 746 C CA . CYS A 1 92 ? 10.544 23.460 -9.844 1.00 97.87 92 A 1 ATOM 747 C C . CYS A 1 92 ? 11.199 23.200 -8.475 1.00 98.07 92 A 1 ATOM 748 O O . CYS A 1 92 ? 11.873 24.071 -7.930 1.00 97.77 92 A 1 ATOM 749 C CB . CYS A 1 92 ? 9.053 23.778 -9.646 1.00 97.21 92 A 1 ATOM 750 S SG . CYS A 1 92 ? 8.260 24.359 -11.175 1.00 95.83 92 A 1 ATOM 751 N N . MET A 1 93 ? 11.051 21.993 -7.924 1.00 97.80 93 A 1 ATOM 752 C CA . MET A 1 93 ? 11.694 21.615 -6.661 1.00 97.61 93 A 1 ATOM 753 C C . MET A 1 93 ? 13.215 21.462 -6.787 1.00 97.84 93 A 1 ATOM 754 O O . MET A 1 93 ? 13.942 21.834 -5.862 1.00 97.37 93 A 1 ATOM 755 C CB . MET A 1 93 ? 11.102 20.307 -6.136 1.00 96.88 93 A 1 ATOM 756 C CG . MET A 1 93 ? 9.625 20.423 -5.741 1.00 94.11 93 A 1 ATOM 757 S SD . MET A 1 93 ? 8.908 18.840 -5.216 1.00 89.82 93 A 1 ATOM 758 C CE . MET A 1 93 ? 9.957 18.461 -3.787 1.00 75.79 93 A 1 ATOM 759 N N . ILE A 1 94 ? 13.700 20.932 -7.915 1.00 98.24 94 A 1 ATOM 760 C CA . ILE A 1 94 ? 15.137 20.789 -8.208 1.00 98.34 94 A 1 ATOM 761 C C . ILE A 1 94 ? 15.809 22.161 -8.253 1.00 98.42 94 A 1 ATOM 762 O O . ILE A 1 94 ? 16.862 22.338 -7.640 1.00 98.18 94 A 1 ATOM 763 C CB . ILE A 1 94 ? 15.348 19.990 -9.516 1.00 98.30 94 A 1 ATOM 764 C CG1 . ILE A 1 94 ? 15.047 18.495 -9.272 1.00 97.85 94 A 1 ATOM 765 C CG2 . ILE A 1 94 ? 16.780 20.147 -10.068 1.00 97.68 94 A 1 ATOM 766 C CD1 . ILE A 1 94 ? 14.888 17.679 -10.560 1.00 96.95 94 A 1 ATOM 767 N N . LEU A 1 95 ? 15.182 23.133 -8.904 1.00 98.27 95 A 1 ATOM 768 C CA . LEU A 1 95 ? 15.708 24.493 -9.080 1.00 98.39 95 A 1 ATOM 769 C C . LEU A 1 95 ? 15.300 25.461 -7.958 1.00 98.36 95 A 1 ATOM 770 O O . LEU A 1 95 ? 15.753 26.605 -7.923 1.00 97.95 95 A 1 ATOM 771 C CB . LEU A 1 95 ? 15.296 25.009 -10.473 1.00 98.42 95 A 1 ATOM 772 C CG . LEU A 1 95 ? 15.784 24.153 -11.660 1.00 98.10 95 A 1 ATOM 773 C CD1 . LEU A 1 95 ? 15.333 24.795 -12.967 1.00 97.61 95 A 1 ATOM 774 C CD2 . LEU A 1 95 ? 17.307 24.009 -11.695 1.00 97.38 95 A 1 ATOM 775 N N . GLY A 1 96 ? 14.436 25.027 -7.024 1.00 97.90 96 A 1 ATOM 776 C CA . GLY A 1 96 ? 14.033 25.824 -5.862 1.00 97.80 96 A 1 ATOM 777 C C . GLY A 1 96 ? 13.179 27.056 -6.196 1.00 97.90 96 A 1 ATOM 778 O O . GLY A 1 96 ? 13.204 28.037 -5.453 1.00 96.81 96 A 1 ATOM 779 N N . ILE A 1 97 ? 12.422 27.026 -7.295 1.00 97.59 97 A 1 ATOM 780 C CA . ILE A 1 97 ? 11.580 28.135 -7.758 1.00 97.36 97 A 1 ATOM 781 C C . ILE A 1 97 ? 10.249 27.620 -8.319 1.00 97.01 97 A 1 ATOM 782 O O . ILE A 1 97 ? 10.187 26.549 -8.916 1.00 96.19 97 A 1 ATOM 783 C CB . ILE A 1 97 ? 12.368 29.009 -8.763 1.00 96.95 97 A 1 ATOM 784 C CG1 . ILE A 1 97 ? 11.658 30.354 -9.007 1.00 95.24 97 A 1 ATOM 785 C CG2 . ILE A 1 97 ? 12.636 28.259 -10.081 1.00 93.94 97 A 1 ATOM 786 C CD1 . ILE A 1 97 ? 12.526 31.375 -9.759 1.00 93.45 97 A 1 ATOM 787 N N . ASN A 1 98 ? 9.154 28.363 -8.118 1.00 95.99 98 A 1 ATOM 788 C CA . ASN A 1 98 ? 7.815 27.952 -8.561 1.00 94.79 98 A 1 ATOM 789 C C . ASN A 1 98 ? 7.529 28.212 -10.050 1.00 94.53 98 A 1 ATOM 790 O O . ASN A 1 98 ? 6.598 27.624 -10.601 1.00 92.65 98 A 1 ATOM 791 C CB . ASN A 1 98 ? 6.758 28.620 -7.669 1.00 93.08 98 A 1 ATOM 792 C CG . ASN A 1 98 ? 6.644 30.127 -7.865 1.00 92.92 98 A 1 ATOM 793 O OD1 . ASN A 1 98 ? 7.551 30.816 -8.280 1.00 87.02 98 A 1 ATOM 794 N ND2 . ASN A 1 98 ? 5.499 30.690 -7.552 1.00 86.99 98 A 1 ATOM 795 N N . ASP A 1 99 ? 8.310 29.086 -10.684 1.00 94.54 99 A 1 ATOM 796 C CA . ASP A 1 99 ? 8.251 29.399 -12.109 1.00 94.37 99 A 1 ATOM 797 C C . ASP A 1 99 ? 9.635 29.195 -12.725 1.00 95.34 99 A 1 ATOM 798 O O . ASP A 1 99 ? 10.582 29.920 -12.423 1.00 94.42 99 A 1 ATOM 799 C CB . ASP A 1 99 ? 7.734 30.831 -12.303 1.00 92.37 99 A 1 ATOM 800 C CG . ASP A 1 99 ? 7.639 31.245 -13.777 1.00 90.59 99 A 1 ATOM 801 O OD1 . ASP A 1 99 ? 7.923 30.408 -14.665 1.00 86.34 99 A 1 ATOM 802 O OD2 . ASP A 1 99 ? 7.298 32.421 -14.015 1.00 83.87 99 A 1 ATOM 803 N N . ILE A 1 100 ? 9.743 28.186 -13.585 1.00 95.45 100 A 1 ATOM 804 C CA . ILE A 1 100 ? 10.990 27.761 -14.228 1.00 96.02 100 A 1 ATOM 805 C C . ILE A 1 100 ? 11.099 28.235 -15.681 1.00 96.38 100 A 1 ATOM 806 O O . ILE A 1 100 ? 12.017 27.826 -16.383 1.00 95.56 100 A 1 ATOM 807 C CB . ILE A 1 100 ? 11.183 26.238 -14.096 1.00 95.69 100 A 1 ATOM 808 C CG1 . ILE A 1 100 ? 9.962 25.464 -14.648 1.00 94.01 100 A 1 ATOM 809 C CG2 . ILE A 1 100 ? 11.478 25.888 -12.628 1.00 92.33 100 A 1 ATOM 810 C CD1 . ILE A 1 100 ? 10.207 23.961 -14.760 1.00 93.38 100 A 1 ATOM 811 N N . THR A 1 101 ? 10.197 29.106 -16.139 1.00 95.40 101 A 1 ATOM 812 C CA . THR A 1 101 ? 10.168 29.595 -17.529 1.00 94.63 101 A 1 ATOM 813 C C . THR A 1 101 ? 11.476 30.269 -17.942 1.00 95.61 101 A 1 ATOM 814 O O . THR A 1 101 ? 11.915 30.108 -19.077 1.00 94.50 101 A 1 ATOM 815 C CB . THR A 1 101 ? 9.011 30.577 -17.764 1.00 92.05 101 A 1 ATOM 816 O OG1 . THR A 1 101 ? 9.035 31.619 -16.823 1.00 83.54 101 A 1 ATOM 817 C CG2 . THR A 1 101 ? 7.647 29.887 -17.700 1.00 81.11 101 A 1 ATOM 818 N N . GLU A 1 102 ? 12.168 30.945 -17.018 1.00 95.51 102 A 1 ATOM 819 C CA . GLU A 1 102 ? 13.472 31.574 -17.290 1.00 95.69 102 A 1 ATOM 820 C C . GLU A 1 102 ? 14.606 30.572 -17.575 1.00 96.85 102 A 1 ATOM 821 O O . GLU A 1 102 ? 15.646 30.962 -18.113 1.00 95.82 102 A 1 ATOM 822 C CB . GLU A 1 102 ? 13.850 32.515 -16.138 1.00 93.07 102 A 1 ATOM 823 C CG . GLU A 1 102 ? 14.235 31.795 -14.827 1.00 82.73 102 A 1 ATOM 824 C CD . GLU A 1 102 ? 14.536 32.792 -13.685 1.00 80.43 102 A 1 ATOM 825 O OE1 . GLU A 1 102 ? 15.189 32.409 -12.696 1.00 73.29 102 A 1 ATOM 826 O OE2 . GLU A 1 102 ? 14.075 33.959 -13.765 1.00 76.51 102 A 1 ATOM 827 N N . TYR A 1 103 ? 14.401 29.292 -17.245 1.00 97.23 103 A 1 ATOM 828 C CA . TYR A 1 103 ? 15.351 28.206 -17.490 1.00 97.87 103 A 1 ATOM 829 C C . TYR A 1 103 ? 15.007 27.381 -18.736 1.00 98.18 103 A 1 ATOM 830 O O . TYR A 1 103 ? 15.792 26.516 -19.117 1.00 97.58 103 A 1 ATOM 831 C CB . TYR A 1 103 ? 15.452 27.312 -16.247 1.00 97.85 103 A 1 ATOM 832 C CG . TYR A 1 103 ? 15.787 28.063 -14.974 1.00 98.02 103 A 1 ATOM 833 C CD1 . TYR A 1 103 ? 17.111 28.464 -14.703 1.00 97.11 103 A 1 ATOM 834 C CD2 . TYR A 1 103 ? 14.764 28.390 -14.064 1.00 97.24 103 A 1 ATOM 835 C CE1 . TYR A 1 103 ? 17.410 29.193 -13.542 1.00 96.70 103 A 1 ATOM 836 C CE2 . TYR A 1 103 ? 15.053 29.122 -12.898 1.00 96.93 103 A 1 ATOM 837 C CZ . TYR A 1 103 ? 16.377 29.527 -12.642 1.00 97.27 103 A 1 ATOM 838 O OH . TYR A 1 103 ? 16.650 30.260 -11.516 1.00 96.38 103 A 1 ATOM 839 N N . TYR A 1 104 ? 13.870 27.626 -19.382 1.00 97.43 104 A 1 ATOM 840 C CA . TYR A 1 104 ? 13.438 26.846 -20.538 1.00 97.39 104 A 1 ATOM 841 C C . TYR A 1 104 ? 14.493 26.845 -21.649 1.00 97.68 104 A 1 ATOM 842 O O . TYR A 1 104 ? 15.099 27.868 -21.972 1.00 95.94 104 A 1 ATOM 843 C CB . TYR A 1 104 ? 12.070 27.322 -21.055 1.00 96.04 104 A 1 ATOM 844 C CG . TYR A 1 104 ? 10.846 26.766 -20.344 1.00 93.68 104 A 1 ATOM 845 C CD1 . TYR A 1 104 ? 10.884 26.316 -19.011 1.00 86.88 104 A 1 ATOM 846 C CD2 . TYR A 1 104 ? 9.628 26.676 -21.052 1.00 86.54 104 A 1 ATOM 847 C CE1 . TYR A 1 104 ? 9.739 25.784 -18.392 1.00 84.63 104 A 1 ATOM 848 C CE2 . TYR A 1 104 ? 8.477 26.150 -20.446 1.00 84.42 104 A 1 ATOM 849 C CZ . TYR A 1 104 ? 8.535 25.705 -19.114 1.00 84.87 104 A 1 ATOM 850 O OH . TYR A 1 104 ? 7.410 25.177 -18.526 1.00 82.24 104 A 1 ATOM 851 N N . GLY A 1 105 ? 14.715 25.659 -22.216 1.00 97.25 105 A 1 ATOM 852 C CA . GLY A 1 105 ? 15.734 25.412 -23.238 1.00 97.32 105 A 1 ATOM 853 C C . GLY A 1 105 ? 17.169 25.319 -22.711 1.00 97.86 105 A 1 ATOM 854 O O . GLY A 1 105 ? 18.050 24.890 -23.458 1.00 96.11 105 A 1 ATOM 855 N N . LYS A 1 106 ? 17.433 25.675 -21.451 1.00 98.06 106 A 1 ATOM 856 C CA . LYS A 1 106 ? 18.772 25.570 -20.868 1.00 98.13 106 A 1 ATOM 857 C C . LYS A 1 106 ? 19.044 24.136 -20.430 1.00 98.35 106 A 1 ATOM 858 O O . LYS A 1 106 ? 18.256 23.552 -19.690 1.00 97.69 106 A 1 ATOM 859 C CB . LYS A 1 106 ? 18.959 26.540 -19.698 1.00 97.58 106 A 1 ATOM 860 C CG . LYS A 1 106 ? 18.785 28.005 -20.118 1.00 94.40 106 A 1 ATOM 861 C CD . LYS A 1 106 ? 19.022 28.927 -18.916 1.00 90.09 106 A 1 ATOM 862 C CE . LYS A 1 106 ? 18.793 30.383 -19.320 1.00 83.04 106 A 1 ATOM 863 N NZ . LYS A 1 106 ? 18.760 31.273 -18.129 1.00 73.05 106 A 1 ATOM 864 N N . LYS A 1 107 ? 20.187 23.616 -20.864 1.00 98.49 107 A 1 ATOM 865 C CA . LYS A 1 107 ? 20.775 22.385 -20.337 1.00 98.56 107 A 1 ATOM 866 C C . LYS A 1 107 ? 21.595 22.758 -19.110 1.00 98.55 107 A 1 ATOM 867 O O . LYS A 1 107 ? 22.419 23.665 -19.203 1.00 97.73 107 A 1 ATOM 868 C CB . LYS A 1 107 ? 21.641 21.709 -21.399 1.00 98.26 107 A 1 ATOM 869 C CG . LYS A 1 107 ? 20.832 21.334 -22.644 1.00 97.61 107 A 1 ATOM 870 C CD . LYS A 1 107 ? 21.720 20.576 -23.627 1.00 96.63 107 A 1 ATOM 871 C CE . LYS A 1 107 ? 20.916 20.192 -24.867 1.00 93.74 107 A 1 ATOM 872 N NZ . LYS A 1 107 ? 21.617 19.130 -25.629 1.00 90.91 107 A 1 ATOM 873 N N . ILE A 1 108 ? 21.313 22.124 -17.981 1.00 98.59 108 A 1 ATOM 874 C CA . ILE A 1 108 ? 21.877 22.502 -16.684 1.00 98.64 108 A 1 ATOM 875 C C . ILE A 1 108 ? 22.422 21.234 -16.036 1.00 98.72 108 A 1 ATOM 876 O O . ILE A 1 108 ? 21.646 20.295 -15.839 1.00 98.45 108 A 1 ATOM 877 C CB . ILE A 1 108 ? 20.814 23.179 -15.789 1.00 98.40 108 A 1 ATOM 878 C CG1 . ILE A 1 108 ? 20.048 24.316 -16.510 1.00 97.14 108 A 1 ATOM 879 C CG2 . ILE A 1 108 ? 21.495 23.731 -14.530 1.00 96.84 108 A 1 ATOM 880 C CD1 . ILE A 1 108 ? 18.920 24.946 -15.679 1.00 96.50 108 A 1 ATOM 881 N N . SER A 1 109 ? 23.713 21.212 -15.708 1.00 98.66 109 A 1 ATOM 882 C CA . SER A 1 109 ? 24.322 20.047 -15.067 1.00 98.64 109 A 1 ATOM 883 C C . SER A 1 109 ? 23.742 19.800 -13.672 1.00 98.73 109 A 1 ATOM 884 O O . SER A 1 109 ? 23.120 20.685 -13.074 1.00 98.48 109 A 1 ATOM 885 C CB . SER A 1 109 ? 25.849 20.192 -15.015 1.00 98.18 109 A 1 ATOM 886 O OG . SER A 1 109 ? 26.268 21.067 -13.983 1.00 95.80 109 A 1 ATOM 887 N N . GLU A 1 110 ? 23.943 18.604 -13.108 1.00 98.40 110 A 1 ATOM 888 C CA . GLU A 1 110 ? 23.470 18.302 -11.750 1.00 98.10 110 A 1 ATOM 889 C C . GLU A 1 110 ? 24.068 19.267 -10.712 1.00 98.30 110 A 1 ATOM 890 O O . GLU A 1 110 ? 23.346 19.752 -9.837 1.00 97.75 110 A 1 ATOM 891 C CB . GLU A 1 110 ? 23.780 16.843 -11.358 1.00 96.82 110 A 1 ATOM 892 C CG . GLU A 1 110 ? 22.942 15.796 -12.110 1.00 87.29 110 A 1 ATOM 893 C CD . GLU A 1 110 ? 23.005 14.381 -11.492 1.00 83.00 110 A 1 ATOM 894 O OE1 . GLU A 1 110 ? 22.541 13.412 -12.132 1.00 75.11 110 A 1 ATOM 895 O OE2 . GLU A 1 110 ? 23.417 14.201 -10.317 1.00 77.40 110 A 1 ATOM 896 N N . GLU A 1 111 ? 25.359 19.614 -10.825 1.00 98.37 111 A 1 ATOM 897 C CA . GLU A 1 111 ? 25.987 20.587 -9.931 1.00 98.30 111 A 1 ATOM 898 C C . GLU A 1 111 ? 25.392 21.992 -10.097 1.00 98.48 111 A 1 ATOM 899 O O . GLU A 1 111 ? 25.081 22.662 -9.108 1.00 97.90 111 A 1 ATOM 900 C CB . GLU A 1 111 ? 27.504 20.659 -10.150 1.00 97.64 111 A 1 ATOM 901 C CG . GLU A 1 111 ? 28.256 19.374 -9.754 1.00 83.31 111 A 1 ATOM 902 C CD . GLU A 1 111 ? 28.847 18.574 -10.917 1.00 75.27 111 A 1 ATOM 903 O OE1 . GLU A 1 111 ? 29.560 17.594 -10.603 1.00 68.28 111 A 1 ATOM 904 O OE2 . GLU A 1 111 ? 28.590 18.936 -12.084 1.00 69.84 111 A 1 ATOM 905 N N . GLU A 1 112 ? 25.179 22.437 -11.322 1.00 98.57 112 A 1 ATOM 906 C CA . GLU A 1 112 ? 24.554 23.732 -11.604 1.00 98.49 112 A 1 ATOM 907 C C . GLU A 1 112 ? 23.108 23.786 -11.102 1.00 98.60 112 A 1 ATOM 908 O O . GLU A 1 112 ? 22.678 24.814 -10.577 1.00 98.26 112 A 1 ATOM 909 C CB . GLU A 1 112 ? 24.572 24.024 -13.105 1.00 97.97 112 A 1 ATOM 910 C CG . GLU A 1 112 ? 25.963 24.386 -13.651 1.00 82.04 112 A 1 ATOM 911 C CD . GLU A 1 112 ? 25.927 24.553 -15.178 1.00 74.02 112 A 1 ATOM 912 O OE1 . GLU A 1 112 ? 26.605 25.475 -15.679 1.00 67.48 112 A 1 ATOM 913 O OE2 . GLU A 1 112 ? 25.198 23.785 -15.850 1.00 70.43 112 A 1 ATOM 914 N N . GLN A 1 113 ? 22.359 22.682 -11.201 1.00 98.74 113 A 1 ATOM 915 C CA . GLN A 1 113 ? 21.005 22.579 -10.651 1.00 98.72 113 A 1 ATOM 916 C C . GLN A 1 113 ? 21.008 22.818 -9.132 1.00 98.70 113 A 1 ATOM 917 O O . GLN A 1 113 ? 20.163 23.563 -8.619 1.00 98.46 113 A 1 ATOM 918 C CB . GLN A 1 113 ? 20.403 21.200 -10.960 1.00 98.52 113 A 1 ATOM 919 C CG . GLN A 1 113 ? 20.068 20.967 -12.446 1.00 98.29 113 A 1 ATOM 920 C CD . GLN A 1 113 ? 19.732 19.500 -12.723 1.00 98.44 113 A 1 ATOM 921 O OE1 . GLN A 1 113 ? 19.116 18.820 -11.915 1.00 94.00 113 A 1 ATOM 922 N NE2 . GLN A 1 113 ? 20.108 18.962 -13.860 1.00 95.01 113 A 1 ATOM 923 N N . GLU A 1 114 ? 21.961 22.235 -8.402 1.00 98.37 114 A 1 ATOM 924 C CA . GLU A 1 114 ? 22.104 22.456 -6.961 1.00 98.10 114 A 1 ATOM 925 C C . GLU A 1 114 ? 22.473 23.909 -6.623 1.00 98.29 114 A 1 ATOM 926 O O . GLU A 1 114 ? 21.904 24.487 -5.690 1.00 97.79 114 A 1 ATOM 927 C CB . GLU A 1 114 ? 23.154 21.521 -6.357 1.00 97.13 114 A 1 ATOM 928 C CG . GLU A 1 114 ? 22.681 20.067 -6.267 1.00 81.96 114 A 1 ATOM 929 C CD . GLU A 1 114 ? 23.564 19.212 -5.353 1.00 69.76 114 A 1 ATOM 930 O OE1 . GLU A 1 114 ? 23.157 18.053 -5.109 1.00 63.57 114 A 1 ATOM 931 O OE2 . GLU A 1 114 ? 24.562 19.731 -4.803 1.00 63.67 114 A 1 ATOM 932 N N . GLU A 1 115 ? 23.384 24.522 -7.377 1.00 98.52 115 A 1 ATOM 933 C CA . GLU A 1 115 ? 23.771 25.924 -7.188 1.00 98.51 115 A 1 ATOM 934 C C . GLU A 1 115 ? 22.604 26.884 -7.457 1.00 98.57 115 A 1 ATOM 935 O O . GLU A 1 115 ? 22.326 27.783 -6.653 1.00 98.13 115 A 1 ATOM 936 C CB . GLU A 1 115 ? 24.985 26.254 -8.071 1.00 98.21 115 A 1 ATOM 937 C CG . GLU A 1 115 ? 26.306 25.686 -7.513 1.00 88.51 115 A 1 ATOM 938 C CD . GLU A 1 115 ? 26.594 26.220 -6.099 1.00 75.07 115 A 1 ATOM 939 O OE1 . GLU A 1 115 ? 26.819 25.400 -5.167 1.00 67.66 115 A 1 ATOM 940 O OE2 . GLU A 1 115 ? 26.499 27.446 -5.899 1.00 69.21 115 A 1 ATOM 941 N N . ILE A 1 116 ? 21.842 26.651 -8.524 1.00 98.60 116 A 1 ATOM 942 C CA . ILE A 1 116 ? 20.623 27.415 -8.823 1.00 98.55 116 A 1 ATOM 943 C C . ILE A 1 116 ? 19.617 27.281 -7.681 1.00 98.49 116 A 1 ATOM 944 O O . ILE A 1 116 ? 19.055 28.285 -7.233 1.00 98.16 116 A 1 ATOM 945 C CB . ILE A 1 116 ? 20.025 26.971 -10.174 1.00 98.41 116 A 1 ATOM 946 C CG1 . ILE A 1 116 ? 20.922 27.473 -11.332 1.00 97.74 116 A 1 ATOM 947 C CG2 . ILE A 1 116 ? 18.590 27.507 -10.355 1.00 97.67 116 A 1 ATOM 948 C CD1 . ILE A 1 116 ? 20.607 26.817 -12.679 1.00 96.22 116 A 1 ATOM 949 N N . LYS A 1 117 ? 19.407 26.070 -7.159 1.00 98.56 117 A 1 ATOM 950 C CA . LYS A 1 117 ? 18.513 25.838 -6.020 1.00 98.42 117 A 1 ATOM 951 C C . LYS A 1 117 ? 18.950 26.630 -4.794 1.00 98.43 117 A 1 ATOM 952 O O . LYS A 1 117 ? 18.127 27.325 -4.189 1.00 98.11 117 A 1 ATOM 953 C CB . LYS A 1 117 ? 18.440 24.337 -5.720 1.00 98.04 117 A 1 ATOM 954 C CG . LYS A 1 117 ? 17.445 24.024 -4.598 1.00 97.11 117 A 1 ATOM 955 C CD . LYS A 1 117 ? 17.359 22.510 -4.408 1.00 94.98 117 A 1 ATOM 956 C CE . LYS A 1 117 ? 16.289 22.139 -3.383 1.00 90.13 117 A 1 ATOM 957 N NZ . LYS A 1 117 ? 16.031 20.679 -3.422 1.00 84.64 117 A 1 ATOM 958 N N . LYS A 1 118 ? 20.230 26.568 -4.423 1.00 98.27 118 A 1 ATOM 959 C CA . LYS A 1 118 ? 20.783 27.333 -3.294 1.00 98.19 118 A 1 ATOM 960 C C . LYS A 1 118 ? 20.584 28.838 -3.495 1.00 98.22 118 A 1 ATOM 961 O O . LYS A 1 118 ? 20.119 29.517 -2.575 1.00 97.80 118 A 1 ATOM 962 C CB . LYS A 1 118 ? 22.279 27.024 -3.123 1.00 97.81 118 A 1 ATOM 963 C CG . LYS A 1 118 ? 22.585 25.615 -2.581 1.00 90.76 118 A 1 ATOM 964 C CD . LYS A 1 118 ? 24.104 25.399 -2.639 1.00 88.76 118 A 1 ATOM 965 C CE . LYS A 1 118 ? 24.524 23.936 -2.508 1.00 79.19 118 A 1 ATOM 966 N NZ . LYS A 1 118 ? 25.914 23.751 -3.011 1.00 71.16 118 A 1 ATOM 967 N N . SER A 1 119 ? 20.877 29.340 -4.693 1.00 98.35 119 A 1 ATOM 968 C CA . SER A 1 119 ? 20.702 30.749 -5.057 1.00 98.24 119 A 1 ATOM 969 C C . SER A 1 119 ? 19.240 31.194 -4.937 1.00 98.26 119 A 1 ATOM 970 O O . SER A 1 119 ? 18.945 32.180 -4.256 1.00 97.66 119 A 1 ATOM 971 C CB . SER A 1 119 ? 21.231 30.976 -6.475 1.00 97.74 119 A 1 ATOM 972 O OG . SER A 1 119 ? 21.152 32.350 -6.805 1.00 83.99 119 A 1 ATOM 973 N N . ASN A 1 120 ? 18.310 30.429 -5.496 1.00 98.37 120 A 1 ATOM 974 C CA . ASN A 1 120 ? 16.878 30.724 -5.427 1.00 98.28 120 A 1 ATOM 975 C C . ASN A 1 120 ? 16.343 30.688 -3.987 1.00 98.16 120 A 1 ATOM 976 O O . ASN A 1 120 ? 15.609 31.593 -3.582 1.00 97.61 120 A 1 ATOM 977 C CB . ASN A 1 120 ? 16.118 29.752 -6.346 1.00 98.10 120 A 1 ATOM 978 C CG . ASN A 1 120 ? 16.197 30.158 -7.813 1.00 98.07 120 A 1 ATOM 979 O OD1 . ASN A 1 120 ? 16.272 31.328 -8.151 1.00 95.20 120 A 1 ATOM 980 N ND2 . ASN A 1 120 ? 16.127 29.206 -8.718 1.00 95.02 120 A 1 ATOM 981 N N . ILE A 1 121 ? 16.755 29.715 -3.174 1.00 97.92 121 A 1 ATOM 982 C CA . ILE A 1 121 ? 16.384 29.652 -1.750 1.00 97.66 121 A 1 ATOM 983 C C . ILE A 1 121 ? 16.933 30.868 -0.988 1.00 97.75 121 A 1 ATOM 984 O O . ILE A 1 121 ? 16.213 31.477 -0.192 1.00 97.15 121 A 1 ATOM 985 C CB . ILE A 1 121 ? 16.850 28.318 -1.127 1.00 96.99 121 A 1 ATOM 986 C CG1 . ILE A 1 121 ? 15.989 27.155 -1.679 1.00 95.21 121 A 1 ATOM 987 C CG2 . ILE A 1 121 ? 16.769 28.348 0.412 1.00 95.06 121 A 1 ATOM 988 C CD1 . ILE A 1 121 ? 16.495 25.758 -1.288 1.00 90.16 121 A 1 ATOM 989 N N . ALA A 1 122 ? 18.192 31.252 -1.224 1.00 97.96 122 A 1 ATOM 990 C CA . ALA A 1 122 ? 18.800 32.426 -0.596 1.00 98.04 122 A 1 ATOM 991 C C . ALA A 1 122 ? 18.063 33.719 -0.983 1.00 98.03 122 A 1 ATOM 992 O O . ALA A 1 122 ? 17.737 34.533 -0.115 1.00 97.34 122 A 1 ATOM 993 C CB . ALA A 1 122 ? 20.283 32.480 -0.974 1.00 97.82 122 A 1 ATOM 994 N N . LYS A 1 123 ? 17.725 33.869 -2.263 1.00 97.68 123 A 1 ATOM 995 C CA . LYS A 1 123 ? 16.945 34.997 -2.774 1.00 97.17 123 A 1 ATOM 996 C C . LYS A 1 123 ? 15.548 35.037 -2.155 1.00 97.27 123 A 1 ATOM 997 O O . LYS A 1 123 ? 15.131 36.080 -1.661 1.00 96.20 123 A 1 ATOM 998 C CB . LYS A 1 123 ? 16.909 34.911 -4.303 1.00 95.71 123 A 1 ATOM 999 C CG . LYS A 1 123 ? 16.376 36.202 -4.937 1.00 85.96 123 A 1 ATOM 1000 C CD . LYS A 1 123 ? 16.459 36.099 -6.462 1.00 85.13 123 A 1 ATOM 1001 C CE . LYS A 1 123 ? 16.000 37.405 -7.108 1.00 75.59 123 A 1 ATOM 1002 N NZ . LYS A 1 123 ? 16.077 37.327 -8.588 1.00 69.08 123 A 1 ATOM 1003 N N . GLY A 1 124 ? 14.870 33.898 -2.089 1.00 97.38 124 A 1 ATOM 1004 C CA . GLY A 1 124 ? 13.557 33.770 -1.457 1.00 97.09 124 A 1 ATOM 1005 C C . GLY A 1 124 ? 13.560 34.138 0.024 1.00 97.25 124 A 1 ATOM 1006 O O . GLY A 1 124 ? 12.662 34.847 0.479 1.00 96.41 124 A 1 ATOM 1007 N N . LYS A 1 125 ? 14.591 33.744 0.775 1.00 97.29 125 A 1 ATOM 1008 C CA . LYS A 1 125 ? 14.787 34.170 2.174 1.00 97.17 125 A 1 ATOM 1009 C C . LYS A 1 125 ? 14.986 35.682 2.279 1.00 97.22 125 A 1 ATOM 1010 O O . LYS A 1 125 ? 14.326 36.322 3.088 1.00 96.13 125 A 1 ATOM 1011 C CB . LYS A 1 125 ? 15.981 33.439 2.809 1.00 96.56 125 A 1 ATOM 1012 C CG . LYS A 1 125 ? 15.652 31.989 3.181 1.00 88.23 125 A 1 ATOM 1013 C CD . LYS A 1 125 ? 16.881 31.294 3.779 1.00 87.15 125 A 1 ATOM 1014 C CE . LYS A 1 125 ? 16.543 29.850 4.158 1.00 78.98 125 A 1 ATOM 1015 N NZ . LYS A 1 125 ? 17.708 29.130 4.741 1.00 70.96 125 A 1 ATOM 1016 N N . LYS A 1 126 ? 15.869 36.246 1.445 1.00 97.22 126 A 1 ATOM 1017 C CA . LYS A 1 126 ? 16.191 37.681 1.453 1.00 97.26 126 A 1 ATOM 1018 C C . LYS A 1 126 ? 14.984 38.558 1.110 1.00 97.16 126 A 1 ATOM 1019 O O . LYS A 1 126 ? 14.807 39.620 1.698 1.00 95.69 126 A 1 ATOM 1020 C CB . LYS A 1 126 ? 17.359 37.932 0.490 1.00 96.67 126 A 1 ATOM 1021 C CG . LYS A 1 126 ? 17.888 39.375 0.575 1.00 87.44 126 A 1 ATOM 1022 C CD . LYS A 1 126 ? 19.063 39.579 -0.392 1.00 83.95 126 A 1 ATOM 1023 C CE . LYS A 1 126 ? 19.567 41.022 -0.299 1.00 72.48 126 A 1 ATOM 1024 N NZ . LYS A 1 126 ? 20.688 41.284 -1.240 1.00 63.47 126 A 1 ATOM 1025 N N . GLU A 1 127 ? 14.152 38.111 0.175 1.00 96.94 127 A 1 ATOM 1026 C CA . GLU A 1 127 ? 12.951 38.828 -0.278 1.00 96.28 127 A 1 ATOM 1027 C C . GLU A 1 127 ? 11.682 38.481 0.520 1.00 96.15 127 A 1 ATOM 1028 O O . GLU A 1 127 ? 10.606 38.994 0.208 1.00 93.86 127 A 1 ATOM 1029 C CB . GLU A 1 127 ? 12.726 38.566 -1.772 1.00 94.75 127 A 1 ATOM 1030 C CG . GLU A 1 127 ? 13.819 39.178 -2.665 1.00 91.61 127 A 1 ATOM 1031 C CD . GLU A 1 127 ? 13.516 38.985 -4.158 1.00 91.78 127 A 1 ATOM 1032 O OE1 . GLU A 1 127 ? 14.480 38.941 -4.953 1.00 85.57 127 A 1 ATOM 1033 O OE2 . GLU A 1 127 ? 12.318 38.888 -4.529 1.00 88.05 127 A 1 ATOM 1034 N N . ASN A 1 128 ? 11.784 37.614 1.523 1.00 96.36 128 A 1 ATOM 1035 C CA . ASN A 1 128 ? 10.653 37.082 2.290 1.00 96.29 128 A 1 ATOM 1036 C C . ASN A 1 128 ? 9.575 36.414 1.404 1.00 96.30 128 A 1 ATOM 1037 O O . ASN A 1 128 ? 8.377 36.511 1.659 1.00 93.88 128 A 1 ATOM 1038 C CB . ASN A 1 128 ? 10.143 38.169 3.247 1.00 95.41 128 A 1 ATOM 1039 C CG . ASN A 1 128 ? 9.511 37.598 4.501 1.00 86.96 128 A 1 ATOM 1040 O OD1 . ASN A 1 128 ? 9.776 36.489 4.925 1.00 78.10 128 A 1 ATOM 1041 N ND2 . ASN A 1 128 ? 8.679 38.375 5.164 1.00 75.88 128 A 1 ATOM 1042 N N . LYS A 1 129 ? 10.018 35.735 0.343 1.00 96.29 129 A 1 ATOM 1043 C CA . LYS A 1 129 ? 9.193 35.034 -0.659 1.00 96.32 129 A 1 ATOM 1044 C C . LYS A 1 129 ? 9.541 33.544 -0.743 1.00 96.61 129 A 1 ATOM 1045 O O . LYS A 1 129 ? 9.457 32.940 -1.808 1.00 94.96 129 A 1 ATOM 1046 C CB . LYS A 1 129 ? 9.336 35.715 -2.022 1.00 95.04 129 A 1 ATOM 1047 C CG . LYS A 1 129 ? 8.731 37.120 -2.091 1.00 92.38 129 A 1 ATOM 1048 C CD . LYS A 1 129 ? 9.025 37.671 -3.490 1.00 87.71 129 A 1 ATOM 1049 C CE . LYS A 1 129 ? 8.694 39.153 -3.614 1.00 81.63 129 A 1 ATOM 1050 N NZ . LYS A 1 129 ? 9.417 39.712 -4.790 1.00 72.61 129 A 1 ATOM 1051 N N . LEU A 1 130 ? 9.972 32.949 0.368 1.00 95.94 130 A 1 ATOM 1052 C CA . LEU A 1 130 ? 10.260 31.520 0.437 1.00 95.99 130 A 1 ATOM 1053 C C . LEU A 1 130 ? 9.083 30.788 1.077 1.00 95.67 130 A 1 ATOM 1054 O O . LEU A 1 130 ? 8.664 31.124 2.183 1.00 93.81 130 A 1 ATOM 1055 C CB . LEU A 1 130 ? 11.568 31.294 1.204 1.00 95.04 130 A 1 ATOM 1056 C CG . LEU A 1 130 ? 12.118 29.862 1.024 1.00 93.53 130 A 1 ATOM 1057 C CD1 . LEU A 1 130 ? 12.782 29.696 -0.345 1.00 90.81 130 A 1 ATOM 1058 C CD2 . LEU A 1 130 ? 13.159 29.554 2.093 1.00 90.81 130 A 1 ATOM 1059 N N . LYS A 1 131 ? 8.573 29.757 0.397 1.00 96.02 131 A 1 ATOM 1060 C CA . LYS A 1 131 ? 7.537 28.876 0.930 1.00 95.63 131 A 1 ATOM 1061 C C . LYS A 1 131 ? 7.864 27.439 0.551 1.00 96.07 131 A 1 ATOM 1062 O O . LYS A 1 131 ? 8.179 27.179 -0.605 1.00 94.89 131 A 1 ATOM 1063 C CB . LYS A 1 131 ? 6.172 29.319 0.391 1.00 93.79 131 A 1 ATOM 1064 C CG . LYS A 1 131 ? 5.022 28.548 1.042 1.00 86.35 131 A 1 ATOM 1065 C CD . LYS A 1 131 ? 3.690 29.000 0.449 1.00 82.28 131 A 1 ATOM 1066 C CE . LYS A 1 131 ? 2.559 28.182 1.064 1.00 73.70 131 A 1 ATOM 1067 N NZ . LYS A 1 131 ? 1.271 28.490 0.405 1.00 65.41 131 A 1 ATOM 1068 N N . ASP A 1 132 ? 7.829 26.528 1.515 1.00 95.84 132 A 1 ATOM 1069 C CA . ASP A 1 132 ? 8.127 25.103 1.310 1.00 95.92 132 A 1 ATOM 1070 C C . ASP A 1 132 ? 9.494 24.849 0.618 1.00 96.09 132 A 1 ATOM 1071 O O . ASP A 1 132 ? 9.620 23.975 -0.231 1.00 94.08 132 A 1 ATOM 1072 C CB . ASP A 1 132 ? 6.926 24.415 0.623 1.00 95.31 132 A 1 ATOM 1073 C CG . ASP A 1 132 ? 5.624 24.606 1.414 1.00 94.47 132 A 1 ATOM 1074 O OD1 . ASP A 1 132 ? 5.642 24.373 2.642 1.00 90.15 132 A 1 ATOM 1075 O OD2 . ASP A 1 132 ? 4.606 25.030 0.814 1.00 90.90 132 A 1 ATOM 1076 N N . ASN A 1 133 ? 10.516 25.636 0.973 1.00 95.38 133 A 1 ATOM 1077 C CA . ASN A 1 133 ? 11.847 25.671 0.332 1.00 95.29 133 A 1 ATOM 1078 C C . ASN A 1 133 ? 11.846 26.050 -1.164 1.00 96.37 133 A 1 ATOM 1079 O O . ASN A 1 133 ? 12.797 25.744 -1.879 1.00 94.21 133 A 1 ATOM 1080 C CB . ASN A 1 133 ? 12.640 24.380 0.622 1.00 92.99 133 A 1 ATOM 1081 C CG . ASN A 1 133 ? 13.259 24.342 2.004 1.00 89.10 133 A 1 ATOM 1082 O OD1 . ASN A 1 133 ? 13.548 25.353 2.622 1.00 79.27 133 A 1 ATOM 1083 N ND2 . ASN A 1 133 ? 13.545 23.156 2.499 1.00 78.09 133 A 1 ATOM 1084 N N . ILE A 1 134 ? 10.822 26.761 -1.620 1.00 96.26 134 A 1 ATOM 1085 C CA . ILE A 1 134 ? 10.679 27.216 -3.005 1.00 96.59 134 A 1 ATOM 1086 C C . ILE A 1 134 ? 10.517 28.734 -3.031 1.00 96.90 134 A 1 ATOM 1087 O O . ILE A 1 134 ? 9.658 29.299 -2.351 1.00 95.94 134 A 1 ATOM 1088 C CB . ILE A 1 134 ? 9.520 26.468 -3.693 1.00 95.45 134 A 1 ATOM 1089 C CG1 . ILE A 1 134 ? 9.857 24.958 -3.746 1.00 92.10 134 A 1 ATOM 1090 C CG2 . ILE A 1 134 ? 9.243 27.021 -5.102 1.00 92.64 134 A 1 ATOM 1091 C CD1 . ILE A 1 134 ? 8.781 24.094 -4.381 1.00 86.51 134 A 1 ATOM 1092 N N . TYR A 1 135 ? 11.340 29.399 -3.849 1.00 97.06 135 A 1 ATOM 1093 C CA . TYR A 1 135 ? 11.213 30.826 -4.121 1.00 97.10 135 A 1 ATOM 1094 C C . TYR A 1 135 ? 9.921 31.101 -4.897 1.00 96.81 135 A 1 ATOM 1095 O O . TYR A 1 135 ? 9.689 30.549 -5.969 1.00 95.89 135 A 1 ATOM 1096 C CB . TYR A 1 135 ? 12.453 31.318 -4.871 1.00 96.80 135 A 1 ATOM 1097 C CG . TYR A 1 135 ? 12.382 32.767 -5.310 1.00 96.81 135 A 1 ATOM 1098 C CD1 . TYR A 1 135 ? 12.457 33.097 -6.676 1.00 94.55 135 A 1 ATOM 1099 C CD2 . TYR A 1 135 ? 12.244 33.796 -4.358 1.00 94.78 135 A 1 ATOM 1100 C CE1 . TYR A 1 135 ? 12.408 34.438 -7.087 1.00 94.39 135 A 1 ATOM 1101 C CE2 . TYR A 1 135 ? 12.188 35.139 -4.765 1.00 94.01 135 A 1 ATOM 1102 C CZ . TYR A 1 135 ? 12.278 35.458 -6.131 1.00 94.41 135 A 1 ATOM 1103 O OH . TYR A 1 135 ? 12.246 36.768 -6.531 1.00 92.49 135 A 1 ATOM 1104 N N . GLN A 1 136 ? 9.077 31.957 -4.346 1.00 95.82 136 A 1 ATOM 1105 C CA . GLN A 1 136 ? 7.795 32.330 -4.927 1.00 94.77 136 A 1 ATOM 1106 C C . GLN A 1 136 ? 7.989 33.520 -5.870 1.00 94.37 136 A 1 ATOM 1107 O O . GLN A 1 136 ? 7.812 34.677 -5.482 1.00 91.62 136 A 1 ATOM 1108 C CB . GLN A 1 136 ? 6.776 32.631 -3.818 1.00 93.13 136 A 1 ATOM 1109 C CG . GLN A 1 136 ? 6.582 31.489 -2.813 1.00 89.39 136 A 1 ATOM 1110 C CD . GLN A 1 136 ? 6.049 30.210 -3.460 1.00 88.81 136 A 1 ATOM 1111 O OE1 . GLN A 1 136 ? 4.964 30.173 -4.010 1.00 79.89 136 A 1 ATOM 1112 N NE2 . GLN A 1 136 ? 6.794 29.133 -3.397 1.00 78.82 136 A 1 ATOM 1113 N N . LYS A 1 137 ? 8.353 33.227 -7.118 1.00 90.92 137 A 1 ATOM 1114 C CA . LYS A 1 137 ? 8.367 34.241 -8.173 1.00 87.76 137 A 1 ATOM 1115 C C . LYS A 1 137 ? 6.924 34.533 -8.574 1.00 84.34 137 A 1 ATOM 1116 O O . LYS A 1 137 ? 6.170 33.623 -8.911 1.00 75.72 137 A 1 ATOM 1117 C CB . LYS A 1 137 ? 9.245 33.766 -9.338 1.00 83.42 137 A 1 ATOM 1118 C CG . LYS A 1 137 ? 9.555 34.878 -10.352 1.00 76.80 137 A 1 ATOM 1119 C CD . LYS A 1 137 ? 10.502 34.341 -11.437 1.00 72.58 137 A 1 ATOM 1120 C CE . LYS A 1 137 ? 10.814 35.385 -12.512 1.00 65.16 137 A 1 ATOM 1121 N NZ . LYS A 1 137 ? 11.619 34.794 -13.605 1.00 59.00 137 A 1 ATOM 1122 N N . LEU A 1 138 ? 6.522 35.810 -8.496 1.00 80.70 138 A 1 ATOM 1123 C CA . LEU A 1 138 ? 5.241 36.252 -9.039 1.00 75.99 138 A 1 ATOM 1124 C C . LEU A 1 138 ? 5.326 36.119 -10.557 1.00 74.18 138 A 1 ATOM 1125 O O . LEU A 1 138 ? 6.162 36.778 -11.174 1.00 65.31 138 A 1 ATOM 1126 C CB . LEU A 1 138 ? 4.950 37.701 -8.614 1.00 68.95 138 A 1 ATOM 1127 C CG . LEU A 1 138 ? 4.548 37.842 -7.136 1.00 60.99 138 A 1 ATOM 1128 C CD1 . LEU A 1 138 ? 4.681 39.299 -6.687 1.00 55.99 138 A 1 ATOM 1129 C CD2 . LEU A 1 138 ? 3.102 37.406 -6.890 1.00 55.24 138 A 1 ATOM 1130 N N . GLN A 1 139 ? 4.469 35.278 -11.147 1.00 70.24 139 A 1 ATOM 1131 C CA . GLN A 1 139 ? 4.259 35.334 -12.589 1.00 65.20 139 A 1 ATOM 1132 C C . GLN A 1 139 ? 3.720 36.730 -12.902 1.00 63.26 139 A 1 ATOM 1133 O O . GLN A 1 139 ? 2.675 37.127 -12.386 1.00 56.12 139 A 1 ATOM 1134 C CB . GLN A 1 139 ? 3.297 34.232 -13.056 1.00 57.90 139 A 1 ATOM 1135 C CG . GLN A 1 139 ? 4.002 32.867 -13.139 1.00 51.89 139 A 1 ATOM 1136 C CD . GLN A 1 139 ? 3.095 31.748 -13.644 1.00 48.00 139 A 1 ATOM 1137 O OE1 . GLN A 1 139 ? 1.891 31.755 -13.468 1.00 44.64 139 A 1 ATOM 1138 N NE2 . GLN A 1 139 ? 3.649 30.732 -14.264 1.00 43.04 139 A 1 ATOM 1139 N N . GLN A 1 140 ? 4.462 37.491 -13.712 1.00 51.44 140 A 1 ATOM 1140 C CA . GLN A 1 140 ? 3.850 38.615 -14.399 1.00 48.81 140 A 1 ATOM 1141 C C . GLN A 1 140 ? 2.819 37.996 -15.337 1.00 47.41 140 A 1 ATOM 1142 O O . GLN A 1 140 ? 3.186 37.373 -16.327 1.00 42.97 140 A 1 ATOM 1143 C CB . GLN A 1 140 ? 4.898 39.443 -15.155 1.00 44.50 140 A 1 ATOM 1144 C CG . GLN A 1 140 ? 5.744 40.308 -14.203 1.00 39.56 140 A 1 ATOM 1145 C CD . GLN A 1 140 ? 6.756 41.198 -14.939 1.00 36.11 140 A 1 ATOM 1146 O OE1 . GLN A 1 140 ? 7.058 41.032 -16.102 1.00 34.04 140 A 1 ATOM 1147 N NE2 . GLN A 1 140 ? 7.331 42.171 -14.269 1.00 32.89 140 A 1 ATOM 1148 N N . MET A 1 141 ? 1.530 38.131 -14.991 1.00 47.33 141 A 1 ATOM 1149 C CA . MET A 1 141 ? 0.479 37.986 -15.989 1.00 45.04 141 A 1 ATOM 1150 C C . MET A 1 141 ? 0.734 39.083 -17.021 1.00 43.78 141 A 1 ATOM 1151 O O . MET A 1 141 ? 0.488 40.256 -16.742 1.00 40.85 141 A 1 ATOM 1152 C CB . MET A 1 141 ? -0.916 38.126 -15.361 1.00 42.51 141 A 1 ATOM 1153 C CG . MET A 1 141 ? -1.304 36.919 -14.510 1.00 39.58 141 A 1 ATOM 1154 S SD . MET A 1 141 ? -3.033 36.936 -13.921 1.00 37.72 141 A 1 ATOM 1155 C CE . MET A 1 141 ? -2.973 38.252 -12.678 1.00 35.45 141 A 1 ATOM 1156 N N . GLN A 1 142 ? 1.339 38.701 -18.143 1.00 34.45 142 A 1 ATOM 1157 C CA . GLN A 1 142 ? 1.249 39.497 -19.365 1.00 32.87 142 A 1 ATOM 1158 C C . GLN A 1 142 ? -0.152 39.334 -19.971 1.00 30.06 142 A 1 ATOM 1159 O O . GLN A 1 142 ? -0.718 38.228 -19.866 1.00 26.92 142 A 1 ATOM 1160 C CB . GLN A 1 142 ? 2.333 39.105 -20.371 1.00 30.78 142 A 1 ATOM 1161 C CG . GLN A 1 142 ? 3.716 39.640 -19.950 1.00 28.94 142 A 1 ATOM 1162 C CD . GLN A 1 142 ? 4.772 39.482 -21.052 1.00 26.48 142 A 1 ATOM 1163 O OE1 . GLN A 1 142 ? 4.599 38.819 -22.065 1.00 26.13 142 A 1 ATOM 1164 N NE2 . GLN A 1 142 ? 5.916 40.104 -20.907 1.00 25.97 142 A 1 ATOM 1165 O OXT . GLN A 1 142 ? -0.614 40.340 -20.545 1.00 25.79 142 A 1 ATOM 1166 N N . ASP B 2 1 ? -16.648 14.714 -27.572 1.00 53.70 1 B 1 ATOM 1167 C CA . ASP B 2 1 ? -17.744 15.603 -28.030 1.00 59.25 1 B 1 ATOM 1168 C C . ASP B 2 1 ? -18.395 16.364 -26.885 1.00 62.44 1 B 1 ATOM 1169 O O . ASP B 2 1 ? -18.145 17.561 -26.780 1.00 59.11 1 B 1 ATOM 1170 C CB . ASP B 2 1 ? -18.719 14.851 -28.936 1.00 55.36 1 B 1 ATOM 1171 C CG . ASP B 2 1 ? -17.954 14.253 -30.111 1.00 50.58 1 B 1 ATOM 1172 O OD1 . ASP B 2 1 ? -16.758 14.613 -30.224 1.00 47.63 1 B 1 ATOM 1173 O OD2 . ASP B 2 1 ? -18.497 13.363 -30.781 1.00 45.65 1 B 1 ATOM 1174 N N . ASP B 2 2 ? -19.082 15.727 -25.960 1.00 65.52 2 B 1 ATOM 1175 C CA . ASP B 2 2 ? -19.906 16.356 -24.900 1.00 68.70 2 B 1 ATOM 1176 C C . ASP B 2 2 ? -19.166 17.368 -23.988 1.00 70.20 2 B 1 ATOM 1177 O O . ASP B 2 2 ? -19.775 18.226 -23.346 1.00 65.95 2 B 1 ATOM 1178 C CB . ASP B 2 2 ? -20.508 15.210 -24.060 1.00 63.31 2 B 1 ATOM 1179 C CG . ASP B 2 2 ? -21.831 15.574 -23.388 1.00 57.03 2 B 1 ATOM 1180 O OD1 . ASP B 2 2 ? -22.672 16.193 -24.062 1.00 53.20 2 B 1 ATOM 1181 O OD2 . ASP B 2 2 ? -21.985 15.257 -22.180 1.00 52.12 2 B 1 ATOM 1182 N N . TYR B 2 3 ? -17.835 17.311 -23.924 1.00 77.37 3 B 1 ATOM 1183 C CA . TYR B 2 3 ? -17.043 18.280 -23.151 1.00 77.65 3 B 1 ATOM 1184 C C . TYR B 2 3 ? -16.931 19.646 -23.839 1.00 78.58 3 B 1 ATOM 1185 O O . TYR B 2 3 ? -16.895 20.670 -23.156 1.00 75.86 3 B 1 ATOM 1186 C CB . TYR B 2 3 ? -15.646 17.705 -22.863 1.00 73.31 3 B 1 ATOM 1187 C CG . TYR B 2 3 ? -15.367 17.555 -21.387 1.00 66.60 3 B 1 ATOM 1188 C CD1 . TYR B 2 3 ? -14.835 18.627 -20.644 1.00 61.70 3 B 1 ATOM 1189 C CD2 . TYR B 2 3 ? -15.654 16.337 -20.738 1.00 60.36 3 B 1 ATOM 1190 C CE1 . TYR B 2 3 ? -14.583 18.484 -19.271 1.00 55.61 3 B 1 ATOM 1191 C CE2 . TYR B 2 3 ? -15.408 16.183 -19.365 1.00 55.83 3 B 1 ATOM 1192 C CZ . TYR B 2 3 ? -14.867 17.259 -18.633 1.00 53.77 3 B 1 ATOM 1193 O OH . TYR B 2 3 ? -14.621 17.111 -17.289 1.00 51.33 3 B 1 ATOM 1194 N N . LEU B 2 4 ? -16.877 19.675 -25.180 1.00 81.88 4 B 1 ATOM 1195 C CA . LEU B 2 4 ? -16.790 20.911 -25.969 1.00 82.35 4 B 1 ATOM 1196 C C . LEU B 2 4 ? -18.098 21.708 -25.912 1.00 82.43 4 B 1 ATOM 1197 O O . LEU B 2 4 ? -18.060 22.930 -25.807 1.00 78.59 4 B 1 ATOM 1198 C CB . LEU B 2 4 ? -16.415 20.573 -27.426 1.00 80.06 4 B 1 ATOM 1199 C CG . LEU B 2 4 ? -14.933 20.197 -27.611 1.00 74.75 4 B 1 ATOM 1200 C CD1 . LEU B 2 4 ? -14.732 19.539 -28.976 1.00 71.16 4 B 1 ATOM 1201 C CD2 . LEU B 2 4 ? -14.029 21.433 -27.555 1.00 70.66 4 B 1 ATOM 1202 N N . ASP B 2 5 ? -19.239 21.024 -25.888 1.00 80.78 5 B 1 ATOM 1203 C CA . ASP B 2 5 ? -20.557 21.674 -25.810 1.00 81.18 5 B 1 ATOM 1204 C C . ASP B 2 5 ? -20.807 22.392 -24.476 1.00 81.48 5 B 1 ATOM 1205 O O . ASP B 2 5 ? -21.628 23.315 -24.398 1.00 78.46 5 B 1 ATOM 1206 C CB . ASP B 2 5 ? -21.653 20.630 -26.057 1.00 78.42 5 B 1 ATOM 1207 C CG . ASP B 2 5 ? -21.802 20.258 -27.531 1.00 71.38 5 B 1 ATOM 1208 O OD1 . ASP B 2 5 ? -21.441 21.098 -28.387 1.00 66.17 5 B 1 ATOM 1209 O OD2 . ASP B 2 5 ? -22.321 19.152 -27.784 1.00 64.13 5 B 1 ATOM 1210 N N . ARG B 2 6 ? -20.075 22.020 -23.427 1.00 81.08 6 B 1 ATOM 1211 C CA . ARG B 2 6 ? -20.137 22.671 -22.106 1.00 81.00 6 B 1 ATOM 1212 C C . ARG B 2 6 ? -19.206 23.878 -21.982 1.00 82.45 6 B 1 ATOM 1213 O O . ARG B 2 6 ? -19.229 24.550 -20.948 1.00 79.30 6 B 1 ATOM 1214 C CB . ARG B 2 6 ? -19.862 21.646 -21.001 1.00 77.53 6 B 1 ATOM 1215 C CG . ARG B 2 6 ? -20.917 20.541 -20.976 1.00 70.88 6 B 1 ATOM 1216 C CD . ARG B 2 6 ? -20.609 19.560 -19.851 1.00 66.31 6 B 1 ATOM 1217 N NE . ARG B 2 6 ? -21.367 18.320 -20.006 1.00 59.95 6 B 1 ATOM 1218 C CZ . ARG B 2 6 ? -21.608 17.401 -19.091 1.00 54.27 6 B 1 ATOM 1219 N NH1 . ARG B 2 6 ? -21.236 17.552 -17.847 1.00 50.32 6 B 1 ATOM 1220 N NH2 . ARG B 2 6 ? -22.220 16.304 -19.445 1.00 47.94 6 B 1 ATOM 1221 N N . LEU B 2 7 ? -18.374 24.152 -22.984 1.00 86.40 7 B 1 ATOM 1222 C CA . LEU B 2 7 ? -17.496 25.314 -22.950 1.00 86.30 7 B 1 ATOM 1223 C C . LEU B 2 7 ? -18.313 26.602 -23.143 1.00 86.48 7 B 1 ATOM 1224 O O . LEU B 2 7 ? -19.219 26.657 -23.977 1.00 84.39 7 B 1 ATOM 1225 C CB . LEU B 2 7 ? -16.377 25.194 -23.996 1.00 84.18 7 B 1 ATOM 1226 C CG . LEU B 2 7 ? -15.325 24.117 -23.668 1.00 78.92 7 B 1 ATOM 1227 C CD1 . LEU B 2 7 ? -14.385 23.946 -24.862 1.00 75.42 7 B 1 ATOM 1228 C CD2 . LEU B 2 7 ? -14.470 24.493 -22.453 1.00 74.47 7 B 1 ATOM 1229 N N . PRO B 2 8 ? -17.959 27.668 -22.409 1.00 83.06 8 B 1 ATOM 1230 C CA . PRO B 2 8 ? -18.576 28.971 -22.621 1.00 82.75 8 B 1 ATOM 1231 C C . PRO B 2 8 ? -18.407 29.411 -24.081 1.00 84.65 8 B 1 ATOM 1232 O O . PRO B 2 8 ? -17.293 29.484 -24.601 1.00 82.57 8 B 1 ATOM 1233 C CB . PRO B 2 8 ? -17.874 29.929 -21.655 1.00 78.53 8 B 1 ATOM 1234 C CG . PRO B 2 8 ? -17.284 29.019 -20.582 1.00 77.48 8 B 1 ATOM 1235 C CD . PRO B 2 8 ? -16.977 27.729 -21.337 1.00 80.20 8 B 1 ATOM 1236 N N . LYS B 2 9 ? -19.513 29.769 -24.737 1.00 82.72 9 B 1 ATOM 1237 C CA . LYS B 2 9 ? -19.493 30.204 -26.148 1.00 82.64 9 B 1 ATOM 1238 C C . LYS B 2 9 ? -19.014 31.649 -26.328 1.00 84.57 9 B 1 ATOM 1239 O O . LYS B 2 9 ? -18.680 32.059 -27.436 1.00 80.20 9 B 1 ATOM 1240 C CB . LYS B 2 9 ? -20.875 29.988 -26.790 1.00 78.20 9 B 1 ATOM 1241 C CG . LYS B 2 9 ? -21.260 28.498 -26.856 1.00 73.77 9 B 1 ATOM 1242 C CD . LYS B 2 9 ? -22.536 28.264 -27.679 1.00 66.50 9 B 1 ATOM 1243 C CE . LYS B 2 9 ? -22.821 26.755 -27.726 1.00 62.68 9 B 1 ATOM 1244 N NZ . LYS B 2 9 ? -23.974 26.396 -28.588 1.00 55.28 9 B 1 ATOM 1245 N N . SER B 2 10 ? -18.986 32.438 -25.252 1.00 85.78 10 B 1 ATOM 1246 C CA . SER B 2 10 ? -18.515 33.824 -25.303 1.00 86.45 10 B 1 ATOM 1247 C C . SER B 2 10 ? -17.023 33.915 -24.966 1.00 88.17 10 B 1 ATOM 1248 O O . SER B 2 10 ? -16.537 33.219 -24.072 1.00 86.58 10 B 1 ATOM 1249 C CB . SER B 2 10 ? -19.356 34.732 -24.402 1.00 83.38 10 B 1 ATOM 1250 O OG . SER B 2 10 ? -19.042 34.568 -23.034 1.00 76.92 10 B 1 ATOM 1251 N N . LYS B 2 11 ? -16.305 34.843 -25.630 1.00 88.28 11 B 1 ATOM 1252 C CA . LYS B 2 11 ? -14.881 35.110 -25.360 1.00 88.88 11 B 1 ATOM 1253 C C . LYS B 2 11 ? -14.632 35.428 -23.880 1.00 89.76 11 B 1 ATOM 1254 O O . LYS B 2 11 ? -13.678 34.921 -23.295 1.00 89.02 11 B 1 ATOM 1255 C CB . LYS B 2 11 ? -14.392 36.247 -26.281 1.00 87.74 11 B 1 ATOM 1256 C CG . LYS B 2 11 ? -12.866 36.450 -26.213 1.00 81.02 11 B 1 ATOM 1257 C CD . LYS B 2 11 ? -12.406 37.544 -27.191 1.00 76.21 11 B 1 ATOM 1258 C CE . LYS B 2 11 ? -10.881 37.705 -27.119 1.00 68.19 11 B 1 ATOM 1259 N NZ . LYS B 2 11 ? -10.370 38.752 -28.045 1.00 60.54 11 B 1 ATOM 1260 N N . LYS B 2 12 ? -15.527 36.215 -23.271 1.00 89.44 12 B 1 ATOM 1261 C CA . LYS B 2 12 ? -15.455 36.581 -21.847 1.00 89.98 12 B 1 ATOM 1262 C C . LYS B 2 12 ? -15.662 35.365 -20.927 1.00 91.08 12 B 1 ATOM 1263 O O . LYS B 2 12 ? -14.951 35.223 -19.939 1.00 88.60 12 B 1 ATOM 1264 C CB . LYS B 2 12 ? -16.475 37.698 -21.564 1.00 88.63 12 B 1 ATOM 1265 C CG . LYS B 2 12 ? -16.233 38.367 -20.203 1.00 78.97 12 B 1 ATOM 1266 C CD . LYS B 2 12 ? -17.214 39.529 -19.972 1.00 73.25 12 B 1 ATOM 1267 C CE . LYS B 2 12 ? -16.894 40.233 -18.650 1.00 64.62 12 B 1 ATOM 1268 N NZ . LYS B 2 12 ? -17.807 41.375 -18.375 1.00 56.63 12 B 1 ATOM 1269 N N . GLY B 2 13 ? -16.596 34.489 -21.275 1.00 90.78 13 B 1 ATOM 1270 C CA . GLY B 2 13 ? -16.822 33.241 -20.542 1.00 90.46 13 B 1 ATOM 1271 C C . GLY B 2 13 ? -15.640 32.275 -20.658 1.00 92.08 13 B 1 ATOM 1272 O O . GLY B 2 13 ? -15.239 31.681 -19.661 1.00 90.88 13 B 1 ATOM 1273 N N . LEU B 2 14 ? -15.033 32.193 -21.851 1.00 92.92 14 B 1 ATOM 1274 C CA . LEU B 2 14 ? -13.825 31.390 -22.071 1.00 92.89 14 B 1 ATOM 1275 C C . LEU B 2 14 ? -12.638 31.910 -21.246 1.00 93.39 14 B 1 ATOM 1276 O O . LEU B 2 14 ? -11.937 31.121 -20.627 1.00 93.52 14 B 1 ATOM 1277 C CB . LEU B 2 14 ? -13.472 31.366 -23.572 1.00 91.94 14 B 1 ATOM 1278 C CG . LEU B 2 14 ? -13.211 29.933 -24.080 1.00 84.82 14 B 1 ATOM 1279 C CD1 . LEU B 2 14 ? -14.488 29.351 -24.694 1.00 79.61 14 B 1 ATOM 1280 C CD2 . LEU B 2 14 ? -12.122 29.917 -25.148 1.00 80.75 14 B 1 ATOM 1281 N N . GLN B 2 15 ? -12.438 33.229 -21.204 1.00 92.39 15 B 1 ATOM 1282 C CA . GLN B 2 15 ? -11.398 33.862 -20.381 1.00 91.57 15 B 1 ATOM 1283 C C . GLN B 2 15 ? -11.618 33.612 -18.884 1.00 92.07 15 B 1 ATOM 1284 O O . GLN B 2 15 ? -10.659 33.295 -18.180 1.00 91.48 15 B 1 ATOM 1285 C CB . GLN B 2 15 ? -11.353 35.370 -20.662 1.00 90.58 15 B 1 ATOM 1286 C CG . GLN B 2 15 ? -10.618 35.688 -21.973 1.00 83.69 15 B 1 ATOM 1287 C CD . GLN B 2 15 ? -10.629 37.187 -22.304 1.00 78.66 15 B 1 ATOM 1288 O OE1 . GLN B 2 15 ? -11.562 37.925 -22.025 1.00 73.25 15 B 1 ATOM 1289 N NE2 . GLN B 2 15 ? -9.592 37.686 -22.934 1.00 69.21 15 B 1 ATOM 1290 N N . GLY B 2 16 ? -12.862 33.699 -18.414 1.00 91.54 16 B 1 ATOM 1291 C CA . GLY B 2 16 ? -13.200 33.376 -17.022 1.00 91.22 16 B 1 ATOM 1292 C C . GLY B 2 16 ? -12.888 31.920 -16.673 1.00 92.49 16 B 1 ATOM 1293 O O . GLY B 2 16 ? -12.238 31.652 -15.663 1.00 91.01 16 B 1 ATOM 1294 N N . LEU B 2 17 ? -13.257 30.996 -17.562 1.00 94.07 17 B 1 ATOM 1295 C CA . LEU B 2 17 ? -12.931 29.578 -17.392 1.00 93.55 17 B 1 ATOM 1296 C C . LEU B 2 17 ? -11.413 29.343 -17.376 1.00 94.01 17 B 1 ATOM 1297 O O . LEU B 2 17 ? -10.928 28.559 -16.564 1.00 93.63 17 B 1 ATOM 1298 C CB . LEU B 2 17 ? -13.609 28.769 -18.512 1.00 92.79 17 B 1 ATOM 1299 C CG . LEU B 2 17 ? -13.395 27.245 -18.385 1.00 87.46 17 B 1 ATOM 1300 C CD1 . LEU B 2 17 ? -14.113 26.669 -17.161 1.00 80.90 17 B 1 ATOM 1301 C CD2 . LEU B 2 17 ? -13.933 26.542 -19.628 1.00 82.51 17 B 1 ATOM 1302 N N . LEU B 2 18 ? -10.662 30.031 -18.251 1.00 93.27 18 B 1 ATOM 1303 C CA . LEU B 2 18 ? -9.201 29.931 -18.294 1.00 92.46 18 B 1 ATOM 1304 C C . LEU B 2 18 ? -8.576 30.387 -16.971 1.00 92.55 18 B 1 ATOM 1305 O O . LEU B 2 18 ? -7.757 29.663 -16.407 1.00 93.00 18 B 1 ATOM 1306 C CB . LEU B 2 18 ? -8.642 30.748 -19.478 1.00 91.99 18 B 1 ATOM 1307 C CG . LEU B 2 18 ? -7.486 30.008 -20.186 1.00 81.15 18 B 1 ATOM 1308 C CD1 . LEU B 2 18 ? -8.007 29.300 -21.440 1.00 76.25 18 B 1 ATOM 1309 C CD2 . LEU B 2 18 ? -6.382 30.979 -20.607 1.00 78.45 18 B 1 ATOM 1310 N N . GLN B 2 19 ? -9.024 31.527 -16.440 1.00 93.28 19 B 1 ATOM 1311 C CA . GLN B 2 19 ? -8.562 32.046 -15.146 1.00 92.28 19 B 1 ATOM 1312 C C . GLN B 2 19 ? -8.879 31.090 -13.990 1.00 92.43 19 B 1 ATOM 1313 O O . GLN B 2 19 ? -8.036 30.869 -13.115 1.00 91.58 19 B 1 ATOM 1314 C CB . GLN B 2 19 ? -9.213 33.408 -14.876 1.00 91.21 19 B 1 ATOM 1315 C CG . GLN B 2 19 ? -8.583 34.523 -15.723 1.00 83.88 19 B 1 ATOM 1316 C CD . GLN B 2 19 ? -9.242 35.885 -15.487 1.00 79.83 19 B 1 ATOM 1317 O OE1 . GLN B 2 19 ? -10.296 36.031 -14.884 1.00 74.16 19 B 1 ATOM 1318 N NE2 . GLN B 2 19 ? -8.634 36.948 -15.961 1.00 70.99 19 B 1 ATOM 1319 N N . ASP B 2 20 ? -10.061 30.482 -13.991 1.00 93.35 20 B 1 ATOM 1320 C CA . ASP B 2 20 ? -10.424 29.487 -12.977 1.00 92.54 20 B 1 ATOM 1321 C C . ASP B 2 20 ? -9.541 28.232 -13.068 1.00 92.40 20 B 1 ATOM 1322 O O . ASP B 2 20 ? -9.105 27.698 -12.040 1.00 91.81 20 B 1 ATOM 1323 C CB . ASP B 2 20 ? -11.905 29.097 -13.116 1.00 92.20 20 B 1 ATOM 1324 C CG . ASP B 2 20 ? -12.878 30.072 -12.439 1.00 83.29 20 B 1 ATOM 1325 O OD1 . ASP B 2 20 ? -12.440 30.858 -11.567 1.00 77.60 20 B 1 ATOM 1326 O OD2 . ASP B 2 20 ? -14.090 29.944 -12.729 1.00 77.15 20 B 1 ATOM 1327 N N . ILE B 2 21 ? -9.239 27.781 -14.289 1.00 93.64 21 B 1 ATOM 1328 C CA . ILE B 2 21 ? -8.327 26.656 -14.527 1.00 92.60 21 B 1 ATOM 1329 C C . ILE B 2 21 ? -6.915 27.005 -14.042 1.00 92.05 21 B 1 ATOM 1330 O O . ILE B 2 21 ? -6.334 26.219 -13.292 1.00 91.83 21 B 1 ATOM 1331 C CB . ILE B 2 21 ? -8.350 26.224 -16.010 1.00 92.31 21 B 1 ATOM 1332 C CG1 . ILE B 2 21 ? -9.702 25.547 -16.340 1.00 87.84 21 B 1 ATOM 1333 C CG2 . ILE B 2 21 ? -7.189 25.267 -16.336 1.00 86.18 21 B 1 ATOM 1334 C CD1 . ILE B 2 21 ? -9.952 25.363 -17.843 1.00 79.43 21 B 1 ATOM 1335 N N . GLU B 2 22 ? -6.382 28.171 -14.397 1.00 92.44 22 B 1 ATOM 1336 C CA . GLU B 2 22 ? -5.059 28.637 -13.959 1.00 90.97 22 B 1 ATOM 1337 C C . GLU B 2 22 ? -4.966 28.714 -12.433 1.00 91.11 22 B 1 ATOM 1338 O O . GLU B 2 22 ? -4.028 28.190 -11.831 1.00 90.20 22 B 1 ATOM 1339 C CB . GLU B 2 22 ? -4.770 30.017 -14.554 1.00 89.96 22 B 1 ATOM 1340 C CG . GLU B 2 22 ? -4.394 29.942 -16.037 1.00 84.37 22 B 1 ATOM 1341 C CD . GLU B 2 22 ? -4.263 31.327 -16.688 1.00 79.36 22 B 1 ATOM 1342 O OE1 . GLU B 2 22 ? -3.935 31.352 -17.896 1.00 73.82 22 B 1 ATOM 1343 O OE2 . GLU B 2 22 ? -4.524 32.340 -15.997 1.00 77.19 22 B 1 ATOM 1344 N N . LYS B 2 23 ? -5.989 29.291 -11.789 1.00 92.51 23 B 1 ATOM 1345 C CA . LYS B 2 23 ? -6.064 29.366 -10.326 1.00 91.78 23 B 1 ATOM 1346 C C . LYS B 2 23 ? -6.078 27.977 -9.685 1.00 91.35 23 B 1 ATOM 1347 O O . LYS B 2 23 ? -5.429 27.749 -8.660 1.00 90.22 23 B 1 ATOM 1348 C CB . LYS B 2 23 ? -7.306 30.181 -9.954 1.00 91.26 23 B 1 ATOM 1349 C CG . LYS B 2 23 ? -7.307 30.594 -8.477 1.00 82.97 23 B 1 ATOM 1350 C CD . LYS B 2 23 ? -8.537 31.464 -8.212 1.00 80.49 23 B 1 ATOM 1351 C CE . LYS B 2 23 ? -8.544 31.992 -6.777 1.00 71.31 23 B 1 ATOM 1352 N NZ . LYS B 2 23 ? -9.729 32.859 -6.547 1.00 64.57 23 B 1 ATOM 1353 N N . ARG B 2 24 ? -6.789 27.043 -10.308 1.00 92.57 24 B 1 ATOM 1354 C CA . ARG B 2 24 ? -6.850 25.651 -9.850 1.00 91.50 24 B 1 ATOM 1355 C C . ARG B 2 24 ? -5.509 24.935 -10.032 1.00 91.35 24 B 1 ATOM 1356 O O . ARG B 2 24 ? -5.072 24.243 -9.114 1.00 90.36 24 B 1 ATOM 1357 C CB . ARG B 2 24 ? -8.009 24.953 -10.572 1.00 91.47 24 B 1 ATOM 1358 C CG . ARG B 2 24 ? -8.454 23.688 -9.837 1.00 81.76 24 B 1 ATOM 1359 C CD . ARG B 2 24 ? -9.695 23.126 -10.536 1.00 78.09 24 B 1 ATOM 1360 N NE . ARG B 2 24 ? -10.244 21.972 -9.803 1.00 69.67 24 B 1 ATOM 1361 C CZ . ARG B 2 24 ? -11.328 21.287 -10.138 1.00 63.06 24 B 1 ATOM 1362 N NH1 . ARG B 2 24 ? -12.025 21.589 -11.202 1.00 56.40 24 B 1 ATOM 1363 N NH2 . ARG B 2 24 ? -11.726 20.292 -9.402 1.00 54.70 24 B 1 ATOM 1364 N N . ILE B 2 25 ? -4.827 25.143 -11.164 1.00 91.56 25 B 1 ATOM 1365 C CA . ILE B 2 25 ? -3.469 24.633 -11.416 1.00 89.87 25 B 1 ATOM 1366 C C . ILE B 2 25 ? -2.493 25.184 -10.371 1.00 90.72 25 B 1 ATOM 1367 O O . ILE B 2 25 ? -1.745 24.410 -9.773 1.00 90.36 25 B 1 ATOM 1368 C CB . ILE B 2 25 ? -3.013 24.966 -12.853 1.00 88.27 25 B 1 ATOM 1369 C CG1 . ILE B 2 25 ? -3.819 24.125 -13.872 1.00 83.92 25 B 1 ATOM 1370 C CG2 . ILE B 2 25 ? -1.504 24.712 -13.034 1.00 83.19 25 B 1 ATOM 1371 C CD1 . ILE B 2 25 ? -3.665 24.605 -15.320 1.00 77.07 25 B 1 ATOM 1372 N N . LEU B 2 26 ? -2.542 26.491 -10.096 1.00 90.19 26 B 1 ATOM 1373 C CA . LEU B 2 26 ? -1.691 27.126 -9.088 1.00 90.09 26 B 1 ATOM 1374 C C . LEU B 2 26 ? -1.920 26.525 -7.695 1.00 92.23 26 B 1 ATOM 1375 O O . LEU B 2 26 ? -0.965 26.249 -6.968 1.00 92.07 26 B 1 ATOM 1376 C CB . LEU B 2 26 ? -1.967 28.641 -9.084 1.00 87.63 26 B 1 ATOM 1377 C CG . LEU B 2 26 ? -0.772 29.434 -8.518 1.00 78.22 26 B 1 ATOM 1378 C CD1 . LEU B 2 26 ? 0.245 29.725 -9.615 1.00 73.53 26 B 1 ATOM 1379 C CD2 . LEU B 2 26 ? -1.242 30.758 -7.917 1.00 74.41 26 B 1 ATOM 1380 N N . HIS B 2 27 ? -3.186 26.271 -7.338 1.00 92.53 27 B 1 ATOM 1381 C CA . HIS B 2 27 ? -3.540 25.609 -6.083 1.00 93.12 27 B 1 ATOM 1382 C C . HIS B 2 27 ? -2.971 24.187 -6.003 1.00 93.45 27 B 1 ATOM 1383 O O . HIS B 2 27 ? -2.384 23.818 -4.982 1.00 93.15 27 B 1 ATOM 1384 C CB . HIS B 2 27 ? -5.058 25.617 -5.922 1.00 92.75 27 B 1 ATOM 1385 C CG . HIS B 2 27 ? -5.501 25.019 -4.614 1.00 88.68 27 B 1 ATOM 1386 N ND1 . HIS B 2 27 ? -5.235 25.535 -3.363 1.00 76.34 27 B 1 ATOM 1387 C CD2 . HIS B 2 27 ? -6.224 23.868 -4.424 1.00 78.01 27 B 1 ATOM 1388 C CE1 . HIS B 2 27 ? -5.788 24.718 -2.453 1.00 77.47 27 B 1 ATOM 1389 N NE2 . HIS B 2 27 ? -6.399 23.701 -3.060 1.00 78.03 27 B 1 ATOM 1390 N N . TYR B 2 28 ? -3.069 23.414 -7.086 1.00 93.74 28 B 1 ATOM 1391 C CA . TYR B 2 28 ? -2.477 22.076 -7.143 1.00 93.54 28 B 1 ATOM 1392 C C . TYR B 2 28 ? -0.945 22.107 -7.057 1.00 94.53 28 B 1 ATOM 1393 O O . TYR B 2 28 ? -0.380 21.291 -6.329 1.00 94.30 28 B 1 ATOM 1394 C CB . TYR B 2 28 ? -2.924 21.343 -8.412 1.00 92.23 28 B 1 ATOM 1395 C CG . TYR B 2 28 ? -4.349 20.830 -8.380 1.00 83.45 28 B 1 ATOM 1396 C CD1 . TYR B 2 28 ? -4.773 19.965 -7.353 1.00 76.95 28 B 1 ATOM 1397 C CD2 . TYR B 2 28 ? -5.256 21.189 -9.398 1.00 75.33 28 B 1 ATOM 1398 C CE1 . TYR B 2 28 ? -6.088 19.473 -7.332 1.00 70.50 28 B 1 ATOM 1399 C CE2 . TYR B 2 28 ? -6.574 20.698 -9.387 1.00 69.34 28 B 1 ATOM 1400 C CZ . TYR B 2 28 ? -6.986 19.843 -8.351 1.00 68.37 28 B 1 ATOM 1401 O OH . TYR B 2 28 ? -8.272 19.367 -8.334 1.00 62.85 28 B 1 ATOM 1402 N N . LYS B 2 29 ? -0.270 23.063 -7.717 1.00 93.57 29 B 1 ATOM 1403 C CA . LYS B 2 29 ? 1.183 23.269 -7.571 1.00 94.04 29 B 1 ATOM 1404 C C . LYS B 2 29 ? 1.550 23.514 -6.105 1.00 94.97 29 B 1 ATOM 1405 O O . LYS B 2 29 ? 2.442 22.858 -5.574 1.00 94.93 29 B 1 ATOM 1406 C CB . LYS B 2 29 ? 1.695 24.426 -8.467 1.00 92.49 29 B 1 ATOM 1407 C CG . LYS B 2 29 ? 1.883 24.046 -9.950 1.00 86.72 29 B 1 ATOM 1408 C CD . LYS B 2 29 ? 2.656 25.108 -10.760 1.00 87.03 29 B 1 ATOM 1409 C CE . LYS B 2 29 ? 2.978 24.599 -12.184 1.00 80.53 29 B 1 ATOM 1410 N NZ . LYS B 2 29 ? 3.922 25.455 -12.976 1.00 76.30 29 B 1 ATOM 1411 N N . GLN B 2 30 ? 0.835 24.411 -5.420 1.00 94.62 30 B 1 ATOM 1412 C CA . GLN B 2 30 ? 1.091 24.720 -4.010 1.00 94.69 30 B 1 ATOM 1413 C C . GLN B 2 30 ? 0.869 23.513 -3.089 1.00 95.58 30 B 1 ATOM 1414 O O . GLN B 2 30 ? 1.687 23.276 -2.202 1.00 94.97 30 B 1 ATOM 1415 C CB . GLN B 2 30 ? 0.195 25.874 -3.556 1.00 93.33 30 B 1 ATOM 1416 C CG . GLN B 2 30 ? 0.648 27.216 -4.140 1.00 85.05 30 B 1 ATOM 1417 C CD . GLN B 2 30 ? -0.262 28.371 -3.718 1.00 76.73 30 B 1 ATOM 1418 O OE1 . GLN B 2 30 ? -1.218 28.227 -2.965 1.00 70.19 30 B 1 ATOM 1419 N NE2 . GLN B 2 30 ? 0.028 29.570 -4.167 1.00 65.82 30 B 1 ATOM 1420 N N . LEU B 2 31 ? -0.207 22.758 -3.296 1.00 95.21 31 B 1 ATOM 1421 C CA . LEU B 2 31 ? -0.468 21.519 -2.557 1.00 95.13 31 B 1 ATOM 1422 C C . LEU B 2 31 ? 0.645 20.500 -2.768 1.00 95.75 31 B 1 ATOM 1423 O O . LEU B 2 31 ? 1.164 19.968 -1.792 1.00 95.42 31 B 1 ATOM 1424 C CB . LEU B 2 31 ? -1.821 20.930 -2.992 1.00 94.22 31 B 1 ATOM 1425 C CG . LEU B 2 31 ? -2.997 21.453 -2.150 1.00 85.60 31 B 1 ATOM 1426 C CD1 . LEU B 2 31 ? -4.306 21.174 -2.884 1.00 82.30 31 B 1 ATOM 1427 C CD2 . LEU B 2 31 ? -3.067 20.763 -0.792 1.00 83.13 31 B 1 ATOM 1428 N N . PHE B 2 32 ? 1.057 20.295 -4.017 1.00 95.17 32 B 1 ATOM 1429 C CA . PHE B 2 32 ? 2.140 19.376 -4.352 1.00 95.52 32 B 1 ATOM 1430 C C . PHE B 2 32 ? 3.437 19.762 -3.637 1.00 95.95 32 B 1 ATOM 1431 O O . PHE B 2 32 ? 4.038 18.927 -2.966 1.00 95.90 32 B 1 ATOM 1432 C CB . PHE B 2 32 ? 2.321 19.347 -5.869 1.00 95.14 32 B 1 ATOM 1433 C CG . PHE B 2 32 ? 3.438 18.427 -6.310 1.00 95.18 32 B 1 ATOM 1434 C CD1 . PHE B 2 32 ? 4.745 18.919 -6.477 1.00 93.86 32 B 1 ATOM 1435 C CD2 . PHE B 2 32 ? 3.171 17.065 -6.540 1.00 93.88 32 B 1 ATOM 1436 C CE1 . PHE B 2 32 ? 5.776 18.057 -6.880 1.00 93.28 32 B 1 ATOM 1437 C CE2 . PHE B 2 32 ? 4.201 16.203 -6.950 1.00 92.91 32 B 1 ATOM 1438 C CZ . PHE B 2 32 ? 5.500 16.700 -7.118 1.00 93.14 32 B 1 ATOM 1439 N N . PHE B 2 33 ? 3.851 21.029 -3.706 1.00 96.34 33 B 1 ATOM 1440 C CA . PHE B 2 33 ? 5.075 21.486 -3.045 1.00 96.53 33 B 1 ATOM 1441 C C . PHE B 2 33 ? 5.008 21.323 -1.528 1.00 96.63 33 B 1 ATOM 1442 O O . PHE B 2 33 ? 5.978 20.876 -0.919 1.00 96.08 33 B 1 ATOM 1443 C CB . PHE B 2 33 ? 5.353 22.947 -3.407 1.00 96.30 33 B 1 ATOM 1444 C CG . PHE B 2 33 ? 5.608 23.227 -4.874 1.00 96.37 33 B 1 ATOM 1445 C CD1 . PHE B 2 33 ? 6.264 22.297 -5.698 1.00 94.50 33 B 1 ATOM 1446 C CD2 . PHE B 2 33 ? 5.211 24.466 -5.417 1.00 94.61 33 B 1 ATOM 1447 C CE1 . PHE B 2 33 ? 6.513 22.590 -7.047 1.00 93.98 33 B 1 ATOM 1448 C CE2 . PHE B 2 33 ? 5.462 24.768 -6.761 1.00 93.81 33 B 1 ATOM 1449 C CZ . PHE B 2 33 ? 6.110 23.829 -7.578 1.00 94.51 33 B 1 ATOM 1450 N N . LYS B 2 34 ? 3.859 21.633 -0.919 1.00 96.58 34 B 1 ATOM 1451 C CA . LYS B 2 34 ? 3.643 21.435 0.512 1.00 96.51 34 B 1 ATOM 1452 C C . LYS B 2 34 ? 3.779 19.963 0.900 1.00 96.32 34 B 1 ATOM 1453 O O . LYS B 2 34 ? 4.523 19.648 1.824 1.00 95.77 34 B 1 ATOM 1454 C CB . LYS B 2 34 ? 2.273 22.002 0.902 1.00 96.36 34 B 1 ATOM 1455 C CG . LYS B 2 34 ? 2.074 21.906 2.415 1.00 92.05 34 B 1 ATOM 1456 C CD . LYS B 2 34 ? 0.684 22.386 2.827 1.00 88.93 34 B 1 ATOM 1457 C CE . LYS B 2 34 ? 0.560 22.106 4.323 1.00 79.76 34 B 1 ATOM 1458 N NZ . LYS B 2 34 ? -0.814 22.323 4.823 1.00 72.12 34 B 1 ATOM 1459 N N . GLU B 2 35 ? 3.100 19.064 0.189 1.00 95.58 35 B 1 ATOM 1460 C CA . GLU B 2 35 ? 3.162 17.626 0.454 1.00 94.58 35 B 1 ATOM 1461 C C . GLU B 2 35 ? 4.589 17.085 0.304 1.00 94.68 35 B 1 ATOM 1462 O O . GLU B 2 35 ? 5.072 16.367 1.178 1.00 93.79 35 B 1 ATOM 1463 C CB . GLU B 2 35 ? 2.219 16.866 -0.491 1.00 93.38 35 B 1 ATOM 1464 C CG . GLU B 2 35 ? 0.744 17.010 -0.102 1.00 84.42 35 B 1 ATOM 1465 C CD . GLU B 2 35 ? -0.212 16.271 -1.056 1.00 78.62 35 B 1 ATOM 1466 O OE1 . GLU B 2 35 ? -1.423 16.230 -0.732 1.00 71.89 35 B 1 ATOM 1467 O OE2 . GLU B 2 35 ? 0.239 15.746 -2.101 1.00 74.61 35 B 1 ATOM 1468 N N . GLN B 2 36 ? 5.295 17.472 -0.756 1.00 95.16 36 B 1 ATOM 1469 C CA . GLN B 2 36 ? 6.673 17.033 -0.967 1.00 95.10 36 B 1 ATOM 1470 C C . GLN B 2 36 ? 7.627 17.581 0.098 1.00 95.22 36 B 1 ATOM 1471 O O . GLN B 2 36 ? 8.520 16.862 0.538 1.00 94.08 36 B 1 ATOM 1472 C CB . GLN B 2 36 ? 7.158 17.426 -2.369 1.00 94.58 36 B 1 ATOM 1473 C CG . GLN B 2 36 ? 6.396 16.741 -3.513 1.00 93.05 36 B 1 ATOM 1474 C CD . GLN B 2 36 ? 6.312 15.226 -3.373 1.00 92.78 36 B 1 ATOM 1475 O OE1 . GLN B 2 36 ? 7.306 14.526 -3.260 1.00 85.66 36 B 1 ATOM 1476 N NE2 . GLN B 2 36 ? 5.120 14.674 -3.372 1.00 84.84 36 B 1 ATOM 1477 N N . ASN B 2 37 ? 7.430 18.808 0.557 1.00 95.23 37 B 1 ATOM 1478 C CA . ASN B 2 37 ? 8.232 19.383 1.636 1.00 95.17 37 B 1 ATOM 1479 C C . ASN B 2 37 ? 7.966 18.687 2.981 1.00 94.90 37 B 1 ATOM 1480 O O . ASN B 2 37 ? 8.897 18.414 3.736 1.00 93.75 37 B 1 ATOM 1481 C CB . ASN B 2 37 ? 7.952 20.886 1.702 1.00 94.96 37 B 1 ATOM 1482 C CG . ASN B 2 37 ? 8.883 21.591 2.670 1.00 93.19 37 B 1 ATOM 1483 O OD1 . ASN B 2 37 ? 10.092 21.502 2.597 1.00 84.90 37 B 1 ATOM 1484 N ND2 . ASN B 2 37 ? 8.333 22.341 3.600 1.00 84.91 37 B 1 ATOM 1485 N N . GLU B 2 38 ? 6.714 18.335 3.283 1.00 95.39 38 B 1 ATOM 1486 C CA . GLU B 2 38 ? 6.374 17.541 4.468 1.00 94.91 38 B 1 ATOM 1487 C C . GLU B 2 38 ? 7.032 16.150 4.436 1.00 94.45 38 B 1 ATOM 1488 O O . GLU B 2 38 ? 7.558 15.699 5.453 1.00 92.79 38 B 1 ATOM 1489 C CB . GLU B 2 38 ? 4.851 17.388 4.587 1.00 94.61 38 B 1 ATOM 1490 C CG . GLU B 2 38 ? 4.124 18.658 5.047 1.00 92.77 38 B 1 ATOM 1491 C CD . GLU B 2 38 ? 2.593 18.485 5.141 1.00 92.22 38 B 1 ATOM 1492 O OE1 . GLU B 2 38 ? 1.897 19.496 5.398 1.00 85.68 38 B 1 ATOM 1493 O OE2 . GLU B 2 38 ? 2.076 17.343 5.016 1.00 88.55 38 B 1 ATOM 1494 N N . ILE B 2 39 ? 7.032 15.491 3.274 1.00 94.47 39 B 1 ATOM 1495 C CA . ILE B 2 39 ? 7.710 14.202 3.071 1.00 93.39 39 B 1 ATOM 1496 C C . ILE B 2 39 ? 9.224 14.351 3.264 1.00 92.80 39 B 1 ATOM 1497 O O . ILE B 2 39 ? 9.822 13.567 4.002 1.00 90.99 39 B 1 ATOM 1498 C CB . ILE B 2 39 ? 7.354 13.620 1.682 1.00 92.43 39 B 1 ATOM 1499 C CG1 . ILE B 2 39 ? 5.869 13.179 1.643 1.00 90.25 39 B 1 ATOM 1500 C CG2 . ILE B 2 39 ? 8.258 12.429 1.319 1.00 90.12 39 B 1 ATOM 1501 C CD1 . ILE B 2 39 ? 5.330 12.906 0.231 1.00 86.54 39 B 1 ATOM 1502 N N . ALA B 2 40 ? 9.837 15.362 2.653 1.00 92.95 40 B 1 ATOM 1503 C CA . ALA B 2 40 ? 11.272 15.629 2.772 1.00 92.19 40 B 1 ATOM 1504 C C . ALA B 2 40 ? 11.701 15.951 4.217 1.00 92.88 40 B 1 ATOM 1505 O O . ALA B 2 40 ? 12.808 15.608 4.623 1.00 90.94 40 B 1 ATOM 1506 C CB . ALA B 2 40 ? 11.633 16.775 1.820 1.00 90.66 40 B 1 ATOM 1507 N N . ASN B 2 41 ? 10.808 16.536 5.014 1.00 93.21 41 B 1 ATOM 1508 C CA . ASN B 2 41 ? 11.030 16.823 6.433 1.00 93.74 41 B 1 ATOM 1509 C C . ASN B 2 41 ? 10.759 15.621 7.361 1.00 93.51 41 B 1 ATOM 1510 O O . ASN B 2 41 ? 10.653 15.792 8.578 1.00 89.72 41 B 1 ATOM 1511 C CB . ASN B 2 41 ? 10.213 18.068 6.815 1.00 92.67 41 B 1 ATOM 1512 C CG . ASN B 2 41 ? 10.760 19.343 6.194 1.00 89.12 41 B 1 ATOM 1513 O OD1 . ASN B 2 41 ? 11.942 19.527 5.975 1.00 79.91 41 B 1 ATOM 1514 N ND2 . ASN B 2 41 ? 9.898 20.298 5.919 1.00 78.88 41 B 1 ATOM 1515 N N . GLY B 2 42 ? 10.636 14.407 6.810 1.00 92.53 42 B 1 ATOM 1516 C CA . GLY B 2 42 ? 10.517 13.182 7.605 1.00 92.36 42 B 1 ATOM 1517 C C . GLY B 2 42 ? 9.122 12.924 8.176 1.00 93.59 42 B 1 ATOM 1518 O O . GLY B 2 42 ? 8.994 12.259 9.206 1.00 91.16 42 B 1 ATOM 1519 N N . LYS B 2 43 ? 8.071 13.412 7.534 1.00 94.58 43 B 1 ATOM 1520 C CA . LYS B 2 43 ? 6.693 13.074 7.910 1.00 95.53 43 B 1 ATOM 1521 C C . LYS B 2 43 ? 6.516 11.557 7.926 1.00 95.90 43 B 1 ATOM 1522 O O . LYS B 2 43 ? 6.779 10.878 6.931 1.00 94.97 43 B 1 ATOM 1523 C CB . LYS B 2 43 ? 5.709 13.742 6.942 1.00 94.21 43 B 1 ATOM 1524 C CG . LYS B 2 43 ? 4.240 13.514 7.339 1.00 91.53 43 B 1 ATOM 1525 C CD . LYS B 2 43 ? 3.347 14.203 6.310 1.00 89.02 43 B 1 ATOM 1526 C CE . LYS B 2 43 ? 1.866 14.120 6.675 1.00 83.91 43 B 1 ATOM 1527 N NZ . LYS B 2 43 ? 1.073 14.914 5.706 1.00 77.03 43 B 1 ATOM 1528 N N . ARG B 2 44 ? 6.024 11.037 9.050 1.00 95.47 44 B 1 ATOM 1529 C CA . ARG B 2 44 ? 5.718 9.612 9.194 1.00 95.44 44 B 1 ATOM 1530 C C . ARG B 2 44 ? 4.369 9.280 8.553 1.00 95.68 44 B 1 ATOM 1531 O O . ARG B 2 44 ? 3.423 10.066 8.605 1.00 93.54 44 B 1 ATOM 1532 C CB . ARG B 2 44 ? 5.777 9.184 10.664 1.00 93.12 44 B 1 ATOM 1533 C CG . ARG B 2 44 ? 7.211 9.243 11.216 1.00 84.47 44 B 1 ATOM 1534 C CD . ARG B 2 44 ? 7.263 8.655 12.627 1.00 82.49 44 B 1 ATOM 1535 N NE . ARG B 2 44 ? 8.652 8.551 13.133 1.00 76.01 44 B 1 ATOM 1536 C CZ . ARG B 2 44 ? 9.155 7.524 13.801 1.00 70.59 44 B 1 ATOM 1537 N NH1 . ARG B 2 44 ? 8.428 6.504 14.176 1.00 63.06 44 B 1 ATOM 1538 N NH2 . ARG B 2 44 ? 10.414 7.502 14.100 1.00 63.20 44 B 1 ATOM 1539 N N . SER B 2 45 ? 4.298 8.092 7.954 1.00 96.41 45 B 1 ATOM 1540 C CA . SER B 2 45 ? 3.040 7.487 7.528 1.00 96.12 45 B 1 ATOM 1541 C C . SER B 2 45 ? 2.310 6.864 8.723 1.00 96.53 45 B 1 ATOM 1542 O O . SER B 2 45 ? 2.827 6.829 9.838 1.00 95.53 45 B 1 ATOM 1543 C CB . SER B 2 45 ? 3.308 6.453 6.431 1.00 94.75 45 B 1 ATOM 1544 O OG . SER B 2 45 ? 3.906 5.299 6.973 1.00 93.75 45 B 1 ATOM 1545 N N . MET B 2 46 ? 1.112 6.322 8.476 1.00 95.64 46 B 1 ATOM 1546 C CA . MET B 2 46 ? 0.366 5.531 9.461 1.00 95.53 46 B 1 ATOM 1547 C C . MET B 2 46 ? 0.832 4.072 9.541 1.00 96.69 46 B 1 ATOM 1548 O O . MET B 2 46 ? 0.255 3.293 10.293 1.00 95.21 46 B 1 ATOM 1549 C CB . MET B 2 46 ? -1.136 5.588 9.125 1.00 93.46 46 B 1 ATOM 1550 C CG . MET B 2 46 ? -1.724 7.000 9.225 1.00 86.29 46 B 1 ATOM 1551 S SD . MET B 2 46 ? -1.608 7.805 10.853 1.00 76.13 46 B 1 ATOM 1552 C CE . MET B 2 46 ? -2.602 6.684 11.869 1.00 65.67 46 B 1 ATOM 1553 N N . VAL B 2 47 ? 1.823 3.669 8.746 1.00 96.99 47 B 1 ATOM 1554 C CA . VAL B 2 47 ? 2.328 2.293 8.725 1.00 97.30 47 B 1 ATOM 1555 C C . VAL B 2 47 ? 3.250 2.081 9.926 1.00 97.53 47 B 1 ATOM 1556 O O . VAL B 2 47 ? 4.169 2.880 10.113 1.00 96.67 47 B 1 ATOM 1557 C CB . VAL B 2 47 ? 3.034 1.984 7.396 1.00 96.38 47 B 1 ATOM 1558 C CG1 . VAL B 2 47 ? 3.622 0.580 7.384 1.00 93.62 47 B 1 ATOM 1559 C CG2 . VAL B 2 47 ? 2.034 2.075 6.234 1.00 93.86 47 B 1 ATOM 1560 N N . PRO B 2 48 ? 3.033 1.022 10.738 1.00 97.86 48 B 1 ATOM 1561 C CA . PRO B 2 48 ? 3.856 0.766 11.915 1.00 97.71 48 B 1 ATOM 1562 C C . PRO B 2 48 ? 5.316 0.446 11.572 1.00 97.74 48 B 1 ATOM 1563 O O . PRO B 2 48 ? 5.598 -0.267 10.608 1.00 96.91 48 B 1 ATOM 1564 C CB . PRO B 2 48 ? 3.172 -0.389 12.649 1.00 97.00 48 B 1 ATOM 1565 C CG . PRO B 2 48 ? 1.729 -0.338 12.165 1.00 95.56 48 B 1 ATOM 1566 C CD . PRO B 2 48 ? 1.880 0.129 10.727 1.00 97.19 48 B 1 ATOM 1567 N N . ASP B 2 49 ? 6.251 0.927 12.398 1.00 96.84 49 B 1 ATOM 1568 C CA . ASP B 2 49 ? 7.695 0.821 12.136 1.00 96.56 49 B 1 ATOM 1569 C C . ASP B 2 49 ? 8.209 -0.632 12.090 1.00 97.17 49 B 1 ATOM 1570 O O . ASP B 2 49 ? 9.175 -0.921 11.382 1.00 95.79 49 B 1 ATOM 1571 C CB . ASP B 2 49 ? 8.479 1.625 13.195 1.00 94.64 49 B 1 ATOM 1572 C CG . ASP B 2 49 ? 8.480 3.146 12.981 1.00 91.67 49 B 1 ATOM 1573 O OD1 . ASP B 2 49 ? 8.362 3.605 11.824 1.00 86.59 49 B 1 ATOM 1574 O OD2 . ASP B 2 49 ? 8.668 3.904 13.963 1.00 85.68 49 B 1 ATOM 1575 N N . ASN B 2 50 ? 7.561 -1.552 12.811 1.00 97.05 50 B 1 ATOM 1576 C CA . ASN B 2 50 ? 7.909 -2.978 12.832 1.00 97.31 50 B 1 ATOM 1577 C C . ASN B 2 50 ? 7.030 -3.841 11.906 1.00 97.74 50 B 1 ATOM 1578 O O . ASN B 2 50 ? 7.054 -5.071 12.001 1.00 96.76 50 B 1 ATOM 1579 C CB . ASN B 2 50 ? 7.922 -3.489 14.283 1.00 96.53 50 B 1 ATOM 1580 C CG . ASN B 2 50 ? 9.059 -2.930 15.120 1.00 95.39 50 B 1 ATOM 1581 O OD1 . ASN B 2 50 ? 10.002 -2.311 14.651 1.00 88.39 50 B 1 ATOM 1582 N ND2 . ASN B 2 50 ? 9.020 -3.173 16.412 1.00 87.37 50 B 1 ATOM 1583 N N . SER B 2 51 ? 6.263 -3.236 11.005 1.00 98.00 51 B 1 ATOM 1584 C CA . SER B 2 51 ? 5.583 -3.962 9.931 1.00 98.03 51 B 1 ATOM 1585 C C . SER B 2 51 ? 6.580 -4.403 8.853 1.00 98.20 51 B 1 ATOM 1586 O O . SER B 2 51 ? 7.611 -3.759 8.638 1.00 97.62 51 B 1 ATOM 1587 C CB . SER B 2 51 ? 4.446 -3.127 9.330 1.00 97.22 51 B 1 ATOM 1588 O OG . SER B 2 51 ? 4.944 -1.993 8.655 1.00 93.65 51 B 1 ATOM 1589 N N . ILE B 2 52 ? 6.274 -5.490 8.155 1.00 98.27 52 B 1 ATOM 1590 C CA . ILE B 2 52 ? 7.137 -6.073 7.122 1.00 98.32 52 B 1 ATOM 1591 C C . ILE B 2 52 ? 6.333 -6.227 5.820 1.00 98.34 52 B 1 ATOM 1592 O O . ILE B 2 52 ? 5.817 -7.307 5.527 1.00 97.95 52 B 1 ATOM 1593 C CB . ILE B 2 52 ? 7.769 -7.395 7.613 1.00 98.22 52 B 1 ATOM 1594 C CG1 . ILE B 2 52 ? 8.520 -7.216 8.960 1.00 97.46 52 B 1 ATOM 1595 C CG2 . ILE B 2 52 ? 8.743 -7.940 6.547 1.00 97.51 52 B 1 ATOM 1596 C CD1 . ILE B 2 52 ? 8.756 -8.539 9.697 1.00 94.88 52 B 1 ATOM 1597 N N . PRO B 2 53 ? 6.175 -5.156 5.036 1.00 98.43 53 B 1 ATOM 1598 C CA . PRO B 2 53 ? 5.410 -5.188 3.794 1.00 98.23 53 B 1 ATOM 1599 C C . PRO B 2 53 ? 6.199 -5.851 2.663 1.00 98.13 53 B 1 ATOM 1600 O O . PRO B 2 53 ? 7.328 -5.458 2.371 1.00 97.16 53 B 1 ATOM 1601 C CB . PRO B 2 53 ? 5.076 -3.728 3.464 1.00 97.66 53 B 1 ATOM 1602 C CG . PRO B 2 53 ? 5.463 -2.940 4.716 1.00 96.27 53 B 1 ATOM 1603 C CD . PRO B 2 53 ? 6.553 -3.786 5.347 1.00 97.79 53 B 1 ATOM 1604 N N . ILE B 2 54 ? 5.577 -6.802 1.977 1.00 98.06 54 B 1 ATOM 1605 C CA . ILE B 2 54 ? 6.110 -7.451 0.776 1.00 97.98 54 B 1 ATOM 1606 C C . ILE B 2 54 ? 5.136 -7.195 -0.377 1.00 97.76 54 B 1 ATOM 1607 O O . ILE B 2 54 ? 4.071 -7.811 -0.463 1.00 96.93 54 B 1 ATOM 1608 C CB . ILE B 2 54 ? 6.361 -8.958 1.018 1.00 97.89 54 B 1 ATOM 1609 C CG1 . ILE B 2 54 ? 7.296 -9.188 2.234 1.00 97.09 54 B 1 ATOM 1610 C CG2 . ILE B 2 54 ? 6.945 -9.602 -0.255 1.00 97.10 54 B 1 ATOM 1611 C CD1 . ILE B 2 54 ? 7.475 -10.666 2.612 1.00 95.31 54 B 1 ATOM 1612 N N . CYS B 2 55 ? 5.490 -6.285 -1.267 1.00 97.18 55 B 1 ATOM 1613 C CA . CYS B 2 55 ? 4.695 -6.005 -2.457 1.00 96.52 55 B 1 ATOM 1614 C C . CYS B 2 55 ? 4.975 -7.061 -3.529 1.00 96.33 55 B 1 ATOM 1615 O O . CYS B 2 55 ? 5.955 -6.957 -4.272 1.00 94.94 55 B 1 ATOM 1616 C CB . CYS B 2 55 ? 4.966 -4.575 -2.938 1.00 95.54 55 B 1 ATOM 1617 S SG . CYS B 2 55 ? 3.819 -4.153 -4.289 1.00 93.26 55 B 1 ATOM 1618 N N . SER B 2 56 ? 4.118 -8.066 -3.621 1.00 95.92 56 B 1 ATOM 1619 C CA . SER B 2 56 ? 4.271 -9.138 -4.600 1.00 96.13 56 B 1 ATOM 1620 C C . SER B 2 56 ? 2.931 -9.741 -5.016 1.00 96.58 56 B 1 ATOM 1621 O O . SER B 2 56 ? 1.963 -9.770 -4.256 1.00 95.39 56 B 1 ATOM 1622 C CB . SER B 2 56 ? 5.194 -10.227 -4.043 1.00 95.23 56 B 1 ATOM 1623 O OG . SER B 2 56 ? 5.573 -11.119 -5.077 1.00 89.43 56 B 1 ATOM 1624 N N . ASP B 2 57 ? 2.896 -10.246 -6.235 1.00 95.68 57 B 1 ATOM 1625 C CA . ASP B 2 57 ? 1.901 -11.220 -6.676 1.00 96.38 57 B 1 ATOM 1626 C C . ASP B 2 57 ? 2.300 -12.589 -6.115 1.00 96.97 57 B 1 ATOM 1627 O O . ASP B 2 57 ? 3.394 -13.083 -6.400 1.00 96.03 57 B 1 ATOM 1628 C CB . ASP B 2 57 ? 1.864 -11.188 -8.210 1.00 95.60 57 B 1 ATOM 1629 C CG . ASP B 2 57 ? 0.965 -12.228 -8.883 1.00 95.24 57 B 1 ATOM 1630 O OD1 . ASP B 2 57 ? 0.424 -13.121 -8.195 1.00 91.91 57 B 1 ATOM 1631 O OD2 . ASP B 2 57 ? 0.880 -12.166 -10.133 1.00 91.03 57 B 1 ATOM 1632 N N . VAL B 2 58 ? 1.422 -13.209 -5.318 1.00 96.98 58 B 1 ATOM 1633 C CA . VAL B 2 58 ? 1.703 -14.505 -4.685 1.00 97.24 58 B 1 ATOM 1634 C C . VAL B 2 58 ? 1.947 -15.622 -5.700 1.00 97.44 58 B 1 ATOM 1635 O O . VAL B 2 58 ? 2.614 -16.593 -5.378 1.00 96.44 58 B 1 ATOM 1636 C CB . VAL B 2 58 ? 0.600 -14.940 -3.703 1.00 96.37 58 B 1 ATOM 1637 C CG1 . VAL B 2 58 ? 0.429 -13.923 -2.570 1.00 92.41 58 B 1 ATOM 1638 C CG2 . VAL B 2 58 ? -0.752 -15.163 -4.399 1.00 93.03 58 B 1 ATOM 1639 N N . THR B 2 59 ? 1.459 -15.479 -6.928 1.00 97.01 59 B 1 ATOM 1640 C CA . THR B 2 59 ? 1.699 -16.465 -7.996 1.00 96.55 59 B 1 ATOM 1641 C C . THR B 2 59 ? 3.120 -16.397 -8.561 1.00 96.61 59 B 1 ATOM 1642 O O . THR B 2 59 ? 3.537 -17.296 -9.288 1.00 94.76 59 B 1 ATOM 1643 C CB . THR B 2 59 ? 0.681 -16.342 -9.140 1.00 95.57 59 B 1 ATOM 1644 O OG1 . THR B 2 59 ? 0.857 -15.177 -9.909 1.00 88.46 59 B 1 ATOM 1645 C CG2 . THR B 2 59 ? -0.768 -16.366 -8.646 1.00 86.84 59 B 1 ATOM 1646 N N . LYS B 2 60 ? 3.866 -15.335 -8.230 1.00 96.27 60 B 1 ATOM 1647 C CA . LYS B 2 60 ? 5.248 -15.092 -8.672 1.00 95.73 60 B 1 ATOM 1648 C C . LYS B 2 60 ? 6.235 -14.989 -7.508 1.00 96.19 60 B 1 ATOM 1649 O O . LYS B 2 60 ? 7.436 -14.898 -7.740 1.00 94.01 60 B 1 ATOM 1650 C CB . LYS B 2 60 ? 5.296 -13.816 -9.516 1.00 94.30 60 B 1 ATOM 1651 C CG . LYS B 2 60 ? 4.407 -13.909 -10.769 1.00 91.39 60 B 1 ATOM 1652 C CD . LYS B 2 60 ? 4.410 -12.575 -11.512 1.00 85.07 60 B 1 ATOM 1653 C CE . LYS B 2 60 ? 3.365 -12.632 -12.621 1.00 78.47 60 B 1 ATOM 1654 N NZ . LYS B 2 60 ? 3.005 -11.276 -13.087 1.00 67.74 60 B 1 ATOM 1655 N N . LEU B 2 61 ? 5.737 -14.976 -6.272 1.00 96.10 61 B 1 ATOM 1656 C CA . LEU B 2 61 ? 6.565 -14.851 -5.080 1.00 96.70 61 B 1 ATOM 1657 C C . LEU B 2 61 ? 7.459 -16.086 -4.908 1.00 97.15 61 B 1 ATOM 1658 O O . LEU B 2 61 ? 6.989 -17.222 -4.935 1.00 96.41 61 B 1 ATOM 1659 C CB . LEU B 2 61 ? 5.661 -14.619 -3.858 1.00 96.28 61 B 1 ATOM 1660 C CG . LEU B 2 61 ? 6.422 -14.479 -2.527 1.00 95.86 61 B 1 ATOM 1661 C CD1 . LEU B 2 61 ? 7.309 -13.236 -2.496 1.00 92.96 61 B 1 ATOM 1662 C CD2 . LEU B 2 61 ? 5.425 -14.373 -1.378 1.00 92.78 61 B 1 ATOM 1663 N N . ASN B 2 62 ? 8.738 -15.844 -4.646 1.00 96.60 62 B 1 ATOM 1664 C CA . ASN B 2 62 ? 9.643 -16.897 -4.214 1.00 96.82 62 B 1 ATOM 1665 C C . ASN B 2 62 ? 9.395 -17.225 -2.730 1.00 97.47 62 B 1 ATOM 1666 O O . ASN B 2 62 ? 9.996 -16.633 -1.832 1.00 96.92 62 B 1 ATOM 1667 C CB . ASN B 2 62 ? 11.095 -16.486 -4.515 1.00 95.63 62 B 1 ATOM 1668 C CG . ASN B 2 62 ? 12.071 -17.609 -4.191 1.00 93.85 62 B 1 ATOM 1669 O OD1 . ASN B 2 62 ? 11.727 -18.639 -3.643 1.00 88.20 62 B 1 ATOM 1670 N ND2 . ASN B 2 62 ? 13.328 -17.437 -4.534 1.00 86.18 62 B 1 ATOM 1671 N N . PHE B 2 63 ? 8.513 -18.187 -2.471 1.00 97.63 63 B 1 ATOM 1672 C CA . PHE B 2 63 ? 8.205 -18.641 -1.114 1.00 97.91 63 B 1 ATOM 1673 C C . PHE B 2 63 ? 9.411 -19.278 -0.406 1.00 98.08 63 B 1 ATOM 1674 O O . PHE B 2 63 ? 9.501 -19.180 0.813 1.00 97.44 63 B 1 ATOM 1675 C CB . PHE B 2 63 ? 7.030 -19.620 -1.153 1.00 97.63 63 B 1 ATOM 1676 C CG . PHE B 2 63 ? 5.683 -18.939 -1.289 1.00 97.85 63 B 1 ATOM 1677 C CD1 . PHE B 2 63 ? 5.049 -18.414 -0.149 1.00 96.72 63 B 1 ATOM 1678 C CD2 . PHE B 2 63 ? 5.054 -18.832 -2.541 1.00 96.70 63 B 1 ATOM 1679 C CE1 . PHE B 2 63 ? 3.791 -17.794 -0.252 1.00 95.80 63 B 1 ATOM 1680 C CE2 . PHE B 2 63 ? 3.798 -18.212 -2.651 1.00 95.83 63 B 1 ATOM 1681 C CZ . PHE B 2 63 ? 3.165 -17.696 -1.503 1.00 96.43 63 B 1 ATOM 1682 N N . GLN B 2 64 ? 10.352 -19.864 -1.137 1.00 97.69 64 B 1 ATOM 1683 C CA . GLN B 2 64 ? 11.563 -20.409 -0.525 1.00 97.64 64 B 1 ATOM 1684 C C . GLN B 2 64 ? 12.421 -19.294 0.078 1.00 97.82 64 B 1 ATOM 1685 O O . GLN B 2 64 ? 12.879 -19.424 1.206 1.00 97.36 64 B 1 ATOM 1686 C CB . GLN B 2 64 ? 12.348 -21.257 -1.537 1.00 97.14 64 B 1 ATOM 1687 C CG . GLN B 2 64 ? 13.499 -22.029 -0.862 1.00 92.44 64 B 1 ATOM 1688 C CD . GLN B 2 64 ? 12.981 -22.981 0.220 1.00 93.42 64 B 1 ATOM 1689 O OE1 . GLN B 2 64 ? 12.071 -23.763 -0.003 1.00 84.93 64 B 1 ATOM 1690 N NE2 . GLN B 2 64 ? 13.516 -22.927 1.418 1.00 84.22 64 B 1 ATOM 1691 N N . ALA B 2 65 ? 12.551 -18.158 -0.606 1.00 97.77 65 B 1 ATOM 1692 C CA . ALA B 2 65 ? 13.248 -16.997 -0.052 1.00 97.58 65 B 1 ATOM 1693 C C . ALA B 2 65 ? 12.572 -16.460 1.223 1.00 97.93 65 B 1 ATOM 1694 O O . ALA B 2 65 ? 13.265 -16.064 2.164 1.00 97.25 65 B 1 ATOM 1695 C CB . ALA B 2 65 ? 13.349 -15.913 -1.131 1.00 96.92 65 B 1 ATOM 1696 N N . LEU B 2 66 ? 11.235 -16.485 1.294 1.00 98.08 66 B 1 ATOM 1697 C CA . LEU B 2 66 ? 10.487 -16.142 2.511 1.00 98.18 66 B 1 ATOM 1698 C C . LEU B 2 66 ? 10.800 -17.122 3.654 1.00 98.30 66 B 1 ATOM 1699 O O . LEU B 2 66 ? 11.071 -16.686 4.773 1.00 97.94 66 B 1 ATOM 1700 C CB . LEU B 2 66 ? 8.980 -16.086 2.190 1.00 97.92 66 B 1 ATOM 1701 C CG . LEU B 2 66 ? 8.058 -15.919 3.413 1.00 97.16 66 B 1 ATOM 1702 C CD1 . LEU B 2 66 ? 8.286 -14.600 4.146 1.00 95.82 66 B 1 ATOM 1703 C CD2 . LEU B 2 66 ? 6.595 -15.967 2.969 1.00 95.52 66 B 1 ATOM 1704 N N . ILE B 2 67 ? 10.786 -18.425 3.375 1.00 98.23 67 B 1 ATOM 1705 C CA . ILE B 2 67 ? 11.107 -19.479 4.348 1.00 98.05 67 B 1 ATOM 1706 C C . ILE B 2 67 ? 12.536 -19.301 4.871 1.00 98.09 67 B 1 ATOM 1707 O O . ILE B 2 67 ? 12.753 -19.281 6.083 1.00 97.71 67 B 1 ATOM 1708 C CB . ILE B 2 67 ? 10.899 -20.876 3.708 1.00 97.65 67 B 1 ATOM 1709 C CG1 . ILE B 2 67 ? 9.394 -21.143 3.472 1.00 95.79 67 B 1 ATOM 1710 C CG2 . ILE B 2 67 ? 11.496 -22.002 4.575 1.00 96.06 67 B 1 ATOM 1711 C CD1 . ILE B 2 67 ? 9.122 -22.267 2.464 1.00 92.44 67 B 1 ATOM 1712 N N . ASP B 2 68 ? 13.494 -19.117 3.980 1.00 98.05 68 B 1 ATOM 1713 C CA . ASP B 2 68 ? 14.908 -18.981 4.322 1.00 97.94 68 B 1 ATOM 1714 C C . ASP B 2 68 ? 15.163 -17.729 5.174 1.00 97.95 68 B 1 ATOM 1715 O O . ASP B 2 68 ? 15.866 -17.797 6.186 1.00 97.32 68 B 1 ATOM 1716 C CB . ASP B 2 68 ? 15.751 -18.934 3.039 1.00 97.64 68 B 1 ATOM 1717 C CG . ASP B 2 68 ? 15.721 -20.219 2.205 1.00 95.75 68 B 1 ATOM 1718 O OD1 . ASP B 2 68 ? 15.289 -21.277 2.718 1.00 92.70 68 B 1 ATOM 1719 O OD2 . ASP B 2 68 ? 16.147 -20.147 1.027 1.00 92.75 68 B 1 ATOM 1720 N N . ALA B 2 69 ? 14.550 -16.600 4.822 1.00 98.06 69 B 1 ATOM 1721 C CA . ALA B 2 69 ? 14.639 -15.368 5.601 1.00 97.99 69 B 1 ATOM 1722 C C . ALA B 2 69 ? 14.001 -15.525 6.988 1.00 98.14 69 B 1 ATOM 1723 O O . ALA B 2 69 ? 14.609 -15.150 7.996 1.00 97.66 69 B 1 ATOM 1724 C CB . ALA B 2 69 ? 13.988 -14.231 4.806 1.00 97.64 69 B 1 ATOM 1725 N N . GLN B 2 70 ? 12.822 -16.130 7.071 1.00 98.12 70 B 1 ATOM 1726 C CA . GLN B 2 70 ? 12.128 -16.365 8.336 1.00 98.06 70 B 1 ATOM 1727 C C . GLN B 2 70 ? 12.949 -17.265 9.269 1.00 98.01 70 B 1 ATOM 1728 O O . GLN B 2 70 ? 13.137 -16.936 10.444 1.00 97.53 70 B 1 ATOM 1729 C CB . GLN B 2 70 ? 10.735 -16.943 8.043 1.00 97.69 70 B 1 ATOM 1730 C CG . GLN B 2 70 ? 9.920 -17.270 9.305 1.00 96.37 70 B 1 ATOM 1731 C CD . GLN B 2 70 ? 9.660 -16.075 10.218 1.00 97.62 70 B 1 ATOM 1732 O OE1 . GLN B 2 70 ? 9.747 -14.921 9.853 1.00 92.49 70 B 1 ATOM 1733 N NE2 . GLN B 2 70 ? 9.339 -16.334 11.466 1.00 92.31 70 B 1 ATOM 1734 N N . MET B 2 71 ? 13.496 -18.357 8.756 1.00 97.79 71 B 1 ATOM 1735 C CA . MET B 2 71 ? 14.355 -19.246 9.538 1.00 97.47 71 B 1 ATOM 1736 C C . MET B 2 71 ? 15.649 -18.553 9.977 1.00 97.43 71 B 1 ATOM 1737 O O . MET B 2 71 ? 16.065 -18.696 11.127 1.00 96.50 71 B 1 ATOM 1738 C CB . MET B 2 71 ? 14.661 -20.515 8.733 1.00 96.92 71 B 1 ATOM 1739 C CG . MET B 2 71 ? 13.453 -21.454 8.651 1.00 92.52 71 B 1 ATOM 1740 S SD . MET B 2 71 ? 12.834 -22.051 10.261 1.00 91.12 71 B 1 ATOM 1741 C CE . MET B 2 71 ? 14.250 -23.021 10.838 1.00 79.13 71 B 1 ATOM 1742 N N . ARG B 2 72 ? 16.264 -17.763 9.107 1.00 97.49 72 B 1 ATOM 1743 C CA . ARG B 2 72 ? 17.507 -17.036 9.402 1.00 97.31 72 B 1 ATOM 1744 C C . ARG B 2 72 ? 17.330 -15.952 10.461 1.00 97.13 72 B 1 ATOM 1745 O O . ARG B 2 72 ? 18.214 -15.780 11.299 1.00 96.03 72 B 1 ATOM 1746 C CB . ARG B 2 72 ? 18.048 -16.479 8.080 1.00 96.62 72 B 1 ATOM 1747 C CG . ARG B 2 72 ? 19.375 -15.729 8.199 1.00 88.67 72 B 1 ATOM 1748 C CD . ARG B 2 72 ? 20.058 -15.508 6.839 1.00 88.55 72 B 1 ATOM 1749 N NE . ARG B 2 72 ? 19.174 -15.550 5.682 1.00 80.82 72 B 1 ATOM 1750 C CZ . ARG B 2 72 ? 18.816 -14.538 4.894 1.00 76.91 72 B 1 ATOM 1751 N NH1 . ARG B 2 72 ? 19.394 -13.382 4.954 1.00 67.21 72 B 1 ATOM 1752 N NH2 . ARG B 2 72 ? 17.845 -14.673 4.041 1.00 68.34 72 B 1 ATOM 1753 N N . HIS B 2 73 ? 16.208 -15.234 10.449 1.00 97.32 73 B 1 ATOM 1754 C CA . HIS B 2 73 ? 16.008 -14.057 11.302 1.00 96.86 73 B 1 ATOM 1755 C C . HIS B 2 73 ? 15.173 -14.316 12.562 1.00 96.40 73 B 1 ATOM 1756 O O . HIS B 2 73 ? 15.318 -13.572 13.531 1.00 94.80 73 B 1 ATOM 1757 C CB . HIS B 2 73 ? 15.420 -12.915 10.465 1.00 96.71 73 B 1 ATOM 1758 C CG . HIS B 2 73 ? 16.317 -12.482 9.338 1.00 97.14 73 B 1 ATOM 1759 N ND1 . HIS B 2 73 ? 17.671 -12.176 9.441 1.00 88.41 73 B 1 ATOM 1760 C CD2 . HIS B 2 73 ? 15.954 -12.335 8.025 1.00 89.87 73 B 1 ATOM 1761 C CE1 . HIS B 2 73 ? 18.095 -11.854 8.212 1.00 92.04 73 B 1 ATOM 1762 N NE2 . HIS B 2 73 ? 17.083 -11.939 7.335 1.00 93.33 73 B 1 ATOM 1763 N N . ALA B 2 74 ? 14.332 -15.350 12.575 1.00 97.41 74 B 1 ATOM 1764 C CA . ALA B 2 74 ? 13.522 -15.728 13.738 1.00 96.79 74 B 1 ATOM 1765 C C . ALA B 2 74 ? 13.853 -17.123 14.303 1.00 96.18 74 B 1 ATOM 1766 O O . ALA B 2 74 ? 13.443 -17.446 15.419 1.00 93.32 74 B 1 ATOM 1767 C CB . ALA B 2 74 ? 12.038 -15.603 13.374 1.00 96.04 74 B 1 ATOM 1768 N N . GLY B 2 75 ? 14.551 -17.970 13.554 1.00 96.43 75 B 1 ATOM 1769 C CA . GLY B 2 75 ? 14.894 -19.336 13.968 1.00 95.59 75 B 1 ATOM 1770 C C . GLY B 2 75 ? 13.715 -20.311 14.018 1.00 95.62 75 B 1 ATOM 1771 O O . GLY B 2 75 ? 13.854 -21.422 14.530 1.00 93.31 75 B 1 ATOM 1772 N N . LYS B 2 76 ? 12.551 -19.911 13.532 1.00 95.72 76 B 1 ATOM 1773 C CA . LYS B 2 76 ? 11.325 -20.719 13.471 1.00 95.63 76 B 1 ATOM 1774 C C . LYS B 2 76 ? 10.401 -20.215 12.365 1.00 96.63 76 B 1 ATOM 1775 O O . LYS B 2 76 ? 10.486 -19.058 11.962 1.00 95.95 76 B 1 ATOM 1776 C CB . LYS B 2 76 ? 10.602 -20.725 14.834 1.00 92.63 76 B 1 ATOM 1777 C CG . LYS B 2 76 ? 10.128 -19.332 15.271 1.00 88.91 76 B 1 ATOM 1778 C CD . LYS B 2 76 ? 9.207 -19.396 16.491 1.00 87.73 76 B 1 ATOM 1779 C CE . LYS B 2 76 ? 8.731 -17.983 16.816 1.00 82.95 76 B 1 ATOM 1780 N NZ . LYS B 2 76 ? 7.542 -17.977 17.694 1.00 79.42 76 B 1 ATOM 1781 N N . MET B 2 77 ? 9.478 -21.069 11.939 1.00 96.66 77 B 1 ATOM 1782 C CA . MET B 2 77 ? 8.406 -20.690 11.016 1.00 96.95 77 B 1 ATOM 1783 C C . MET B 2 77 ? 7.301 -19.885 11.715 1.00 97.13 77 B 1 ATOM 1784 O O . MET B 2 77 ? 7.367 -19.618 12.917 1.00 96.08 77 B 1 ATOM 1785 C CB . MET B 2 77 ? 7.866 -21.945 10.319 1.00 96.27 77 B 1 ATOM 1786 C CG . MET B 2 77 ? 8.936 -22.639 9.456 1.00 93.11 77 B 1 ATOM 1787 S SD . MET B 2 77 ? 9.874 -21.541 8.350 1.00 90.16 77 B 1 ATOM 1788 C CE . MET B 2 77 ? 8.558 -20.871 7.324 1.00 77.57 77 B 1 ATOM 1789 N N . PHE B 2 78 ? 6.287 -19.469 10.958 1.00 97.79 78 B 1 ATOM 1790 C CA . PHE B 2 78 ? 5.192 -18.645 11.462 1.00 98.05 78 B 1 ATOM 1791 C C . PHE B 2 78 ? 4.313 -19.403 12.461 1.00 97.92 78 B 1 ATOM 1792 O O . PHE B 2 78 ? 3.993 -20.573 12.268 1.00 97.19 78 B 1 ATOM 1793 C CB . PHE B 2 78 ? 4.384 -18.097 10.284 1.00 98.18 78 B 1 ATOM 1794 C CG . PHE B 2 78 ? 5.196 -17.193 9.383 1.00 98.40 78 B 1 ATOM 1795 C CD1 . PHE B 2 78 ? 5.503 -15.886 9.798 1.00 97.91 78 B 1 ATOM 1796 C CD2 . PHE B 2 78 ? 5.695 -17.663 8.156 1.00 97.78 78 B 1 ATOM 1797 C CE1 . PHE B 2 78 ? 6.293 -15.052 8.997 1.00 97.53 78 B 1 ATOM 1798 C CE2 . PHE B 2 78 ? 6.488 -16.834 7.349 1.00 97.51 78 B 1 ATOM 1799 C CZ . PHE B 2 78 ? 6.788 -15.528 7.770 1.00 97.89 78 B 1 ATOM 1800 N N . ASP B 2 79 ? 3.904 -18.708 13.525 1.00 97.82 79 B 1 ATOM 1801 C CA . ASP B 2 79 ? 2.998 -19.244 14.548 1.00 97.66 79 B 1 ATOM 1802 C C . ASP B 2 79 ? 1.531 -19.095 14.125 1.00 97.99 79 B 1 ATOM 1803 O O . ASP B 2 79 ? 0.718 -19.987 14.371 1.00 97.38 79 B 1 ATOM 1804 C CB . ASP B 2 79 ? 3.234 -18.509 15.875 1.00 96.96 79 B 1 ATOM 1805 C CG . ASP B 2 79 ? 4.654 -18.654 16.424 1.00 96.41 79 B 1 ATOM 1806 O OD1 . ASP B 2 79 ? 5.091 -19.775 16.767 1.00 93.78 79 B 1 ATOM 1807 O OD2 . ASP B 2 79 ? 5.354 -17.630 16.574 1.00 93.62 79 B 1 ATOM 1808 N N . VAL B 2 80 ? 1.195 -17.994 13.474 1.00 98.13 80 B 1 ATOM 1809 C CA . VAL B 2 80 ? -0.143 -17.764 12.915 1.00 98.34 80 B 1 ATOM 1810 C C . VAL B 2 80 ? -0.017 -17.254 11.486 1.00 98.54 80 B 1 ATOM 1811 O O . VAL B 2 80 ? 0.732 -16.318 11.210 1.00 98.28 80 B 1 ATOM 1812 C CB . VAL B 2 80 ? -0.989 -16.804 13.776 1.00 97.97 80 B 1 ATOM 1813 C CG1 . VAL B 2 80 ? -2.409 -16.671 13.217 1.00 96.79 80 B 1 ATOM 1814 C CG2 . VAL B 2 80 ? -1.099 -17.286 15.231 1.00 96.88 80 B 1 ATOM 1815 N N . ILE B 2 81 ? -0.772 -17.858 10.581 1.00 98.56 81 B 1 ATOM 1816 C CA . ILE B 2 81 ? -0.957 -17.383 9.211 1.00 98.65 81 B 1 ATOM 1817 C C . ILE B 2 81 ? -2.396 -16.907 9.073 1.00 98.69 81 B 1 ATOM 1818 O O . ILE B 2 81 ? -3.319 -17.643 9.401 1.00 98.40 81 B 1 ATOM 1819 C CB . ILE B 2 81 ? -0.608 -18.476 8.178 1.00 98.53 81 B 1 ATOM 1820 C CG1 . ILE B 2 81 ? 0.851 -18.957 8.367 1.00 97.80 81 B 1 ATOM 1821 C CG2 . ILE B 2 81 ? -0.840 -17.946 6.748 1.00 98.01 81 B 1 ATOM 1822 C CD1 . ILE B 2 81 ? 1.280 -20.076 7.414 1.00 96.94 81 B 1 ATOM 1823 N N . MET B 2 82 ? -2.608 -15.709 8.549 1.00 98.73 82 B 1 ATOM 1824 C CA . MET B 2 82 ? -3.933 -15.219 8.185 1.00 98.69 82 B 1 ATOM 1825 C C . MET B 2 82 ? -3.978 -14.916 6.697 1.00 98.76 82 B 1 ATOM 1826 O O . MET B 2 82 ? -3.013 -14.425 6.116 1.00 98.46 82 B 1 ATOM 1827 C CB . MET B 2 82 ? -4.310 -14.007 9.048 1.00 98.06 82 B 1 ATOM 1828 C CG . MET B 2 82 ? -5.737 -13.510 8.752 1.00 96.12 82 B 1 ATOM 1829 S SD . MET B 2 82 ? -6.392 -12.302 9.932 1.00 95.28 82 B 1 ATOM 1830 C CE . MET B 2 82 ? -5.224 -10.935 9.702 1.00 88.45 82 B 1 ATOM 1831 N N . MET B 2 83 ? -5.119 -15.183 6.058 1.00 98.41 83 B 1 ATOM 1832 C CA . MET B 2 83 ? -5.345 -14.729 4.692 1.00 98.15 83 B 1 ATOM 1833 C C . MET B 2 83 ? -6.783 -14.299 4.450 1.00 98.49 83 B 1 ATOM 1834 O O . MET B 2 83 ? -7.733 -14.863 4.992 1.00 97.87 83 B 1 ATOM 1835 C CB . MET B 2 83 ? -4.857 -15.772 3.676 1.00 94.80 83 B 1 ATOM 1836 C CG . MET B 2 83 ? -5.627 -17.094 3.727 1.00 87.37 83 B 1 ATOM 1837 S SD . MET B 2 83 ? -5.069 -18.321 2.504 1.00 90.20 83 B 1 ATOM 1838 C CE . MET B 2 83 ? -3.448 -18.727 3.187 1.00 82.52 83 B 1 ATOM 1839 N N . ASP B 2 84 ? -6.935 -13.296 3.592 1.00 98.16 84 B 1 ATOM 1840 C CA . ASP B 2 84 ? -8.220 -12.809 3.093 1.00 98.00 84 B 1 ATOM 1841 C C . ASP B 2 84 ? -8.212 -12.890 1.564 1.00 97.99 84 B 1 ATOM 1842 O O . ASP B 2 84 ? -7.908 -11.903 0.886 1.00 97.31 84 B 1 ATOM 1843 C CB . ASP B 2 84 ? -8.466 -11.382 3.614 1.00 97.33 84 B 1 ATOM 1844 C CG . ASP B 2 84 ? -9.833 -10.831 3.204 1.00 96.44 84 B 1 ATOM 1845 O OD1 . ASP B 2 84 ? -10.761 -11.610 2.882 1.00 94.51 84 B 1 ATOM 1846 O OD2 . ASP B 2 84 ? -10.057 -9.604 3.323 1.00 93.55 84 B 1 ATOM 1847 N N . PRO B 2 85 ? -8.475 -14.081 0.991 1.00 97.87 85 B 1 ATOM 1848 C CA . PRO B 2 85 ? -8.221 -14.321 -0.421 1.00 97.62 85 B 1 ATOM 1849 C C . PRO B 2 85 ? -9.089 -13.465 -1.349 1.00 97.19 85 B 1 ATOM 1850 O O . PRO B 2 85 ? -10.278 -13.252 -1.084 1.00 95.97 85 B 1 ATOM 1851 C CB . PRO B 2 85 ? -8.453 -15.819 -0.645 1.00 97.35 85 B 1 ATOM 1852 C CG . PRO B 2 85 ? -8.268 -16.432 0.740 1.00 96.57 85 B 1 ATOM 1853 C CD . PRO B 2 85 ? -8.808 -15.344 1.657 1.00 97.68 85 B 1 ATOM 1854 N N . PRO B 2 86 ? -8.545 -13.048 -2.499 1.00 97.38 86 B 1 ATOM 1855 C CA . PRO B 2 86 ? -9.295 -12.338 -3.528 1.00 96.71 86 B 1 ATOM 1856 C C . PRO B 2 86 ? -10.125 -13.331 -4.355 1.00 96.12 86 B 1 ATOM 1857 O O . PRO B 2 86 ? -9.837 -13.611 -5.522 1.00 94.38 86 B 1 ATOM 1858 C CB . PRO B 2 86 ? -8.227 -11.587 -4.332 1.00 96.16 86 B 1 ATOM 1859 C CG . PRO B 2 86 ? -7.050 -12.552 -4.310 1.00 95.67 86 B 1 ATOM 1860 C CD . PRO B 2 86 ? -7.143 -13.175 -2.915 1.00 96.52 86 B 1 ATOM 1861 N N . TRP B 2 87 ? -11.156 -13.894 -3.730 1.00 96.30 87 B 1 ATOM 1862 C CA . TRP B 2 87 ? -11.967 -14.973 -4.287 1.00 95.84 87 B 1 ATOM 1863 C C . TRP B 2 87 ? -12.560 -14.614 -5.651 1.00 95.09 87 B 1 ATOM 1864 O O . TRP B 2 87 ? -13.327 -13.653 -5.783 1.00 93.05 87 B 1 ATOM 1865 C CB . TRP B 2 87 ? -13.087 -15.319 -3.311 1.00 95.63 87 B 1 ATOM 1866 C CG . TRP B 2 87 ? -12.631 -15.855 -1.987 1.00 95.94 87 B 1 ATOM 1867 C CD1 . TRP B 2 87 ? -12.715 -15.212 -0.805 1.00 94.54 87 B 1 ATOM 1868 C CD2 . TRP B 2 87 ? -12.011 -17.147 -1.709 1.00 96.17 87 B 1 ATOM 1869 N NE1 . TRP B 2 87 ? -12.202 -16.024 0.205 1.00 94.81 87 B 1 ATOM 1870 C CE2 . TRP B 2 87 ? -11.761 -17.217 -0.311 1.00 95.71 87 B 1 ATOM 1871 C CE3 . TRP B 2 87 ? -11.649 -18.258 -2.505 1.00 95.72 87 B 1 ATOM 1872 C CZ2 . TRP B 2 87 ? -11.167 -18.360 0.283 1.00 95.35 87 B 1 ATOM 1873 C CZ3 . TRP B 2 87 ? -11.054 -19.389 -1.910 1.00 94.97 87 B 1 ATOM 1874 C CH2 . TRP B 2 87 ? -10.818 -19.433 -0.537 1.00 94.99 87 B 1 ATOM 1875 N N . GLN B 2 88 ? -12.289 -15.449 -6.642 1.00 93.89 88 B 1 ATOM 1876 C CA . GLN B 2 88 ? -12.909 -15.331 -7.953 1.00 92.38 88 B 1 ATOM 1877 C C . GLN B 2 88 ? -14.335 -15.884 -7.902 1.00 90.89 88 B 1 ATOM 1878 O O . GLN B 2 88 ? -14.563 -17.074 -7.668 1.00 87.37 88 B 1 ATOM 1879 C CB . GLN B 2 88 ? -12.032 -16.026 -8.998 1.00 90.18 88 B 1 ATOM 1880 C CG . GLN B 2 88 ? -12.486 -15.672 -10.420 1.00 84.70 88 B 1 ATOM 1881 C CD . GLN B 2 88 ? -11.509 -16.197 -11.471 1.00 83.82 88 B 1 ATOM 1882 O OE1 . GLN B 2 88 ? -10.856 -17.218 -11.304 1.00 76.19 88 B 1 ATOM 1883 N NE2 . GLN B 2 88 ? -11.372 -15.515 -12.581 1.00 74.07 88 B 1 ATOM 1884 N N . LEU B 2 89 ? -15.312 -15.009 -8.138 1.00 90.32 89 B 1 ATOM 1885 C CA . LEU B 2 89 ? -16.712 -15.406 -8.257 1.00 86.86 89 B 1 ATOM 1886 C C . LEU B 2 89 ? -16.977 -15.908 -9.679 1.00 84.74 89 B 1 ATOM 1887 O O . LEU B 2 89 ? -16.606 -15.258 -10.652 1.00 75.78 89 B 1 ATOM 1888 C CB . LEU B 2 89 ? -17.629 -14.238 -7.862 1.00 81.88 89 B 1 ATOM 1889 C CG . LEU B 2 89 ? -17.538 -13.846 -6.373 1.00 76.18 89 B 1 ATOM 1890 C CD1 . LEU B 2 89 ? -18.365 -12.584 -6.107 1.00 71.09 89 B 1 ATOM 1891 C CD2 . LEU B 2 89 ? -18.065 -14.957 -5.457 1.00 70.42 89 B 1 ATOM 1892 N N . SER B 2 90 ? -17.639 -17.055 -9.789 1.00 77.39 90 B 1 ATOM 1893 C CA . SER B 2 90 ? -17.973 -17.681 -11.077 1.00 74.61 90 B 1 ATOM 1894 C C . SER B 2 90 ? -19.065 -16.952 -11.855 1.00 73.95 90 B 1 ATOM 1895 O O . SER B 2 90 ? -19.207 -17.165 -13.053 1.00 65.31 90 B 1 ATOM 1896 C CB . SER B 2 90 ? -18.418 -19.127 -10.839 1.00 67.81 90 B 1 ATOM 1897 O OG . SER B 2 90 ? -19.483 -19.162 -9.906 1.00 58.91 90 B 1 ATOM 1898 N N . SER B 2 91 ? -19.870 -16.133 -11.193 1.00 66.82 91 B 1 ATOM 1899 C CA . SER B 2 91 ? -20.960 -15.415 -11.844 1.00 64.07 91 B 1 ATOM 1900 C C . SER B 2 91 ? -20.389 -14.371 -12.803 1.00 63.94 91 B 1 ATOM 1901 O O . SER B 2 91 ? -20.003 -13.278 -12.387 1.00 57.69 91 B 1 ATOM 1902 C CB . SER B 2 91 ? -21.899 -14.786 -10.809 1.00 57.71 91 B 1 ATOM 1903 O OG . SER B 2 91 ? -21.192 -13.933 -9.939 1.00 52.09 91 B 1 ATOM 1904 N N . SER B 2 92 ? -20.381 -14.713 -14.087 1.00 58.23 92 B 1 ATOM 1905 C CA . SER B 2 92 ? -19.983 -13.848 -15.200 1.00 55.88 92 B 1 ATOM 1906 C C . SER B 2 92 ? -20.880 -12.627 -15.370 1.00 56.72 92 B 1 ATOM 1907 O O . SER B 2 92 ? -20.468 -11.652 -15.988 1.00 52.13 92 B 1 ATOM 1908 C CB . SER B 2 92 ? -20.046 -14.659 -16.494 1.00 49.61 92 B 1 ATOM 1909 O OG . SER B 2 92 ? -21.327 -15.250 -16.626 1.00 46.30 92 B 1 ATOM 1910 N N . GLN B 2 93 ? -22.119 -12.691 -14.879 1.00 53.65 93 B 1 ATOM 1911 C CA . GLN B 2 93 ? -22.973 -11.518 -14.950 1.00 52.70 93 B 1 ATOM 1912 C C . GLN B 2 93 ? -22.382 -10.448 -14.038 1.00 54.10 93 B 1 ATOM 1913 O O . GLN B 2 93 ? -22.307 -10.663 -12.825 1.00 48.90 93 B 1 ATOM 1914 C CB . GLN B 2 93 ? -24.432 -11.821 -14.598 1.00 45.72 93 B 1 ATOM 1915 C CG . GLN B 2 93 ? -25.130 -12.579 -15.742 1.00 40.68 93 B 1 ATOM 1916 C CD . GLN B 2 93 ? -26.654 -12.468 -15.700 1.00 37.00 93 B 1 ATOM 1917 O OE1 . GLN B 2 93 ? -27.255 -11.927 -14.784 1.00 34.23 93 B 1 ATOM 1918 N NE2 . GLN B 2 93 ? -27.335 -12.967 -16.706 1.00 33.95 93 B 1 ATOM 1919 N N . PRO B 2 94 ? -22.001 -9.281 -14.608 1.00 52.87 94 B 1 ATOM 1920 C CA . PRO B 2 94 ? -21.673 -8.120 -13.815 1.00 51.78 94 B 1 ATOM 1921 C C . PRO B 2 94 ? -22.963 -7.689 -13.115 1.00 53.27 94 B 1 ATOM 1922 O O . PRO B 2 94 ? -23.714 -6.850 -13.608 1.00 50.43 94 B 1 ATOM 1923 C CB . PRO B 2 94 ? -21.120 -7.094 -14.813 1.00 46.87 94 B 1 ATOM 1924 C CG . PRO B 2 94 ? -21.837 -7.440 -16.117 1.00 45.29 94 B 1 ATOM 1925 C CD . PRO B 2 94 ? -22.045 -8.948 -16.025 1.00 48.51 94 B 1 ATOM 1926 N N . SER B 2 95 ? -23.278 -8.325 -11.982 1.00 52.81 95 B 1 ATOM 1927 C CA . SER B 2 95 ? -24.245 -7.718 -11.093 1.00 51.97 95 B 1 ATOM 1928 C C . SER B 2 95 ? -23.717 -6.316 -10.822 1.00 52.83 95 B 1 ATOM 1929 O O . SER B 2 95 ? -22.516 -6.134 -10.610 1.00 48.93 95 B 1 ATOM 1930 C CB . SER B 2 95 ? -24.443 -8.552 -9.822 1.00 47.17 95 B 1 ATOM 1931 O OG . SER B 2 95 ? -23.271 -8.639 -9.057 1.00 44.10 95 B 1 ATOM 1932 N N . ARG B 2 96 ? -24.588 -5.308 -10.850 1.00 48.90 96 B 1 ATOM 1933 C CA . ARG B 2 96 ? -24.251 -3.899 -10.564 1.00 47.91 96 B 1 ATOM 1934 C C . ARG B 2 96 ? -23.663 -3.675 -9.158 1.00 49.91 96 B 1 ATOM 1935 O O . ARG B 2 96 ? -23.549 -2.533 -8.720 1.00 46.29 96 B 1 ATOM 1936 C CB . ARG B 2 96 ? -25.510 -3.018 -10.709 1.00 42.04 96 B 1 ATOM 1937 C CG . ARG B 2 96 ? -26.059 -2.867 -12.127 1.00 38.42 96 B 1 ATOM 1938 C CD . ARG B 2 96 ? -27.252 -1.908 -12.046 1.00 36.27 96 B 1 ATOM 1939 N NE . ARG B 2 96 ? -27.854 -1.649 -13.365 1.00 32.39 96 B 1 ATOM 1940 C CZ . ARG B 2 96 ? -28.901 -0.866 -13.597 1.00 29.64 96 B 1 ATOM 1941 N NH1 . ARG B 2 96 ? -29.522 -0.237 -12.638 1.00 27.18 96 B 1 ATOM 1942 N NH2 . ARG B 2 96 ? -29.345 -0.710 -14.811 1.00 26.27 96 B 1 ATOM 1943 N N . GLY B 2 97 ? -23.367 -4.741 -8.432 1.00 55.87 97 B 1 ATOM 1944 C CA . GLY B 2 97 ? -22.637 -4.671 -7.186 1.00 54.63 97 B 1 ATOM 1945 C C . GLY B 2 97 ? -21.307 -3.960 -7.400 1.00 56.72 97 B 1 ATOM 1946 O O . GLY B 2 97 ? -20.810 -3.866 -8.518 1.00 53.42 97 B 1 ATOM 1947 N N . VAL B 2 98 ? -20.758 -3.456 -6.312 1.00 59.15 98 B 1 ATOM 1948 C CA . VAL B 2 98 ? -19.454 -2.788 -6.323 1.00 59.65 98 B 1 ATOM 1949 C C . VAL B 2 98 ? -18.443 -3.781 -6.887 1.00 61.80 98 B 1 ATOM 1950 O O . VAL B 2 98 ? -18.081 -4.733 -6.205 1.00 57.61 98 B 1 ATOM 1951 C CB . VAL B 2 98 ? -19.063 -2.325 -4.907 1.00 54.56 98 B 1 ATOM 1952 C CG1 . VAL B 2 98 ? -17.743 -1.561 -4.908 1.00 48.57 98 B 1 ATOM 1953 C CG2 . VAL B 2 98 ? -20.146 -1.405 -4.312 1.00 49.29 98 B 1 ATOM 1954 N N . ALA B 2 99 ? -18.052 -3.600 -8.153 1.00 61.96 99 B 1 ATOM 1955 C CA . ALA B 2 99 ? -16.956 -4.342 -8.748 1.00 61.98 99 B 1 ATOM 1956 C C . ALA B 2 99 ? -15.748 -4.065 -7.857 1.00 64.23 99 B 1 ATOM 1957 O O . ALA B 2 99 ? -15.303 -2.923 -7.749 1.00 61.46 99 B 1 ATOM 1958 C CB . ALA B 2 99 ? -16.756 -3.893 -10.198 1.00 56.72 99 B 1 ATOM 1959 N N . ILE B 2 100 ? -15.307 -5.085 -7.117 1.00 67.92 100 B 1 ATOM 1960 C CA . ILE B 2 100 ? -14.162 -4.924 -6.242 1.00 67.60 100 B 1 ATOM 1961 C C . ILE B 2 100 ? -12.967 -4.782 -7.172 1.00 68.54 100 B 1 ATOM 1962 O O . ILE B 2 100 ? -12.668 -5.690 -7.941 1.00 64.59 100 B 1 ATOM 1963 C CB . ILE B 2 100 ? -14.027 -6.065 -5.222 1.00 63.31 100 B 1 ATOM 1964 C CG1 . ILE B 2 100 ? -15.362 -6.387 -4.510 1.00 58.04 100 B 1 ATOM 1965 C CG2 . ILE B 2 100 ? -12.995 -5.594 -4.188 1.00 57.48 100 B 1 ATOM 1966 C CD1 . ILE B 2 100 ? -15.285 -7.552 -3.520 1.00 53.49 100 B 1 ATOM 1967 N N . ALA B 2 101 ? -12.357 -3.599 -7.146 1.00 68.92 101 B 1 ATOM 1968 C CA . ALA B 2 101 ? -11.321 -3.196 -8.085 1.00 69.27 101 B 1 ATOM 1969 C C . ALA B 2 101 ? -9.947 -3.776 -7.702 1.00 73.78 101 B 1 ATOM 1970 O O . ALA B 2 101 ? -8.971 -3.037 -7.597 1.00 68.75 101 B 1 ATOM 1971 C CB . ALA B 2 101 ? -11.340 -1.665 -8.198 1.00 61.43 101 B 1 ATOM 1972 N N . TYR B 2 102 ? -9.883 -5.079 -7.441 1.00 77.84 102 B 1 ATOM 1973 C CA . TYR B 2 102 ? -8.631 -5.803 -7.269 1.00 79.70 102 B 1 ATOM 1974 C C . TYR B 2 102 ? -8.630 -7.085 -8.106 1.00 82.37 102 B 1 ATOM 1975 O O . TYR B 2 102 ? -9.685 -7.637 -8.430 1.00 79.97 102 B 1 ATOM 1976 C CB . TYR B 2 102 ? -8.349 -6.079 -5.781 1.00 76.98 102 B 1 ATOM 1977 C CG . TYR B 2 102 ? -9.381 -6.894 -5.014 1.00 77.92 102 B 1 ATOM 1978 C CD1 . TYR B 2 102 ? -10.073 -6.307 -3.938 1.00 70.17 102 B 1 ATOM 1979 C CD2 . TYR B 2 102 ? -9.617 -8.247 -5.314 1.00 73.97 102 B 1 ATOM 1980 C CE1 . TYR B 2 102 ? -10.990 -7.053 -3.187 1.00 67.64 102 B 1 ATOM 1981 C CE2 . TYR B 2 102 ? -10.544 -9.006 -4.574 1.00 70.03 102 B 1 ATOM 1982 C CZ . TYR B 2 102 ? -11.229 -8.403 -3.509 1.00 73.19 102 B 1 ATOM 1983 O OH . TYR B 2 102 ? -12.137 -9.136 -2.792 1.00 69.42 102 B 1 ATOM 1984 N N . ASP B 2 103 ? -7.437 -7.560 -8.434 1.00 85.00 103 B 1 ATOM 1985 C CA . ASP B 2 103 ? -7.264 -8.821 -9.142 1.00 87.09 103 B 1 ATOM 1986 C C . ASP B 2 103 ? -7.798 -9.982 -8.296 1.00 90.67 103 B 1 ATOM 1987 O O . ASP B 2 103 ? -7.505 -10.097 -7.107 1.00 89.26 103 B 1 ATOM 1988 C CB . ASP B 2 103 ? -5.786 -9.051 -9.472 1.00 82.62 103 B 1 ATOM 1989 C CG . ASP B 2 103 ? -5.201 -7.981 -10.392 1.00 79.23 103 B 1 ATOM 1990 O OD1 . ASP B 2 103 ? -5.900 -7.609 -11.364 1.00 71.73 103 B 1 ATOM 1991 O OD2 . ASP B 2 103 ? -4.061 -7.554 -10.108 1.00 73.08 103 B 1 ATOM 1992 N N . SER B 2 104 ? -8.574 -10.864 -8.916 1.00 92.44 104 B 1 ATOM 1993 C CA . SER B 2 104 ? -9.043 -12.089 -8.272 1.00 93.22 104 B 1 ATOM 1994 C C . SER B 2 104 ? -8.148 -13.272 -8.626 1.00 94.49 104 B 1 ATOM 1995 O O . SER B 2 104 ? -7.515 -13.307 -9.682 1.00 93.02 104 B 1 ATOM 1996 C CB . SER B 2 104 ? -10.513 -12.352 -8.608 1.00 90.25 104 B 1 ATOM 1997 O OG . SER B 2 104 ? -10.697 -12.596 -9.991 1.00 84.33 104 B 1 ATOM 1998 N N . LEU B 2 105 ? -8.124 -14.273 -7.748 1.00 95.98 105 B 1 ATOM 1999 C CA . LEU B 2 105 ? -7.427 -15.531 -7.983 1.00 96.17 105 B 1 ATOM 2000 C C . LEU B 2 105 ? -8.415 -16.697 -8.036 1.00 96.30 105 B 1 ATOM 2001 O O . LEU B 2 105 ? -9.384 -16.756 -7.279 1.00 95.33 105 B 1 ATOM 2002 C CB . LEU B 2 105 ? -6.345 -15.748 -6.919 1.00 95.77 105 B 1 ATOM 2003 C CG . LEU B 2 105 ? -5.155 -14.769 -6.985 1.00 94.41 105 B 1 ATOM 2004 C CD1 . LEU B 2 105 ? -4.169 -15.112 -5.871 1.00 92.08 105 B 1 ATOM 2005 C CD2 . LEU B 2 105 ? -4.402 -14.852 -8.316 1.00 92.24 105 B 1 ATOM 2006 N N . SER B 2 106 ? -8.141 -17.655 -8.923 1.00 95.89 106 B 1 ATOM 2007 C CA . SER B 2 106 ? -8.855 -18.931 -8.924 1.00 95.79 106 B 1 ATOM 2008 C C . SER B 2 106 ? -8.539 -19.725 -7.654 1.00 96.35 106 B 1 ATOM 2009 O O . SER B 2 106 ? -7.476 -19.556 -7.054 1.00 96.02 106 B 1 ATOM 2010 C CB . SER B 2 106 ? -8.510 -19.759 -10.167 1.00 94.74 106 B 1 ATOM 2011 O OG . SER B 2 106 ? -7.148 -20.129 -10.181 1.00 91.56 106 B 1 ATOM 2012 N N . ASP B 2 107 ? -9.442 -20.632 -7.289 1.00 96.47 107 B 1 ATOM 2013 C CA . ASP B 2 107 ? -9.252 -21.516 -6.135 1.00 96.65 107 B 1 ATOM 2014 C C . ASP B 2 107 ? -7.949 -22.319 -6.259 1.00 97.07 107 B 1 ATOM 2015 O O . ASP B 2 107 ? -7.207 -22.449 -5.295 1.00 96.55 107 B 1 ATOM 2016 C CB . ASP B 2 107 ? -10.453 -22.473 -6.008 1.00 95.88 107 B 1 ATOM 2017 C CG . ASP B 2 107 ? -11.796 -21.774 -5.796 1.00 95.16 107 B 1 ATOM 2018 O OD1 . ASP B 2 107 ? -11.842 -20.560 -5.507 1.00 91.98 107 B 1 ATOM 2019 O OD2 . ASP B 2 107 ? -12.860 -22.411 -5.970 1.00 91.81 107 B 1 ATOM 2020 N N . GLU B 2 108 ? -7.629 -22.777 -7.459 1.00 96.23 108 B 1 ATOM 2021 C CA . GLU B 2 108 ? -6.395 -23.504 -7.753 1.00 96.10 108 B 1 ATOM 2022 C C . GLU B 2 108 ? -5.143 -22.667 -7.456 1.00 96.61 108 B 1 ATOM 2023 O O . GLU B 2 108 ? -4.232 -23.132 -6.778 1.00 95.96 108 B 1 ATOM 2024 C CB . GLU B 2 108 ? -6.433 -23.920 -9.228 1.00 95.33 108 B 1 ATOM 2025 C CG . GLU B 2 108 ? -5.249 -24.803 -9.623 1.00 83.92 108 B 1 ATOM 2026 C CD . GLU B 2 108 ? -5.208 -25.093 -11.132 1.00 76.68 108 B 1 ATOM 2027 O OE1 . GLU B 2 108 ? -4.316 -25.866 -11.535 1.00 67.21 108 B 1 ATOM 2028 O OE2 . GLU B 2 108 ? -6.036 -24.510 -11.875 1.00 69.35 108 B 1 ATOM 2029 N N . LYS B 2 109 ? -5.101 -21.404 -7.893 1.00 96.98 109 B 1 ATOM 2030 C CA . LYS B 2 109 ? -3.955 -20.520 -7.633 1.00 96.84 109 B 1 ATOM 2031 C C . LYS B 2 109 ? -3.767 -20.233 -6.144 1.00 97.40 109 B 1 ATOM 2032 O O . LYS B 2 109 ? -2.636 -20.130 -5.691 1.00 96.83 109 B 1 ATOM 2033 C CB . LYS B 2 109 ? -4.109 -19.200 -8.391 1.00 96.26 109 B 1 ATOM 2034 C CG . LYS B 2 109 ? -3.815 -19.338 -9.890 1.00 93.73 109 B 1 ATOM 2035 C CD . LYS B 2 109 ? -3.936 -17.962 -10.547 1.00 88.44 109 B 1 ATOM 2036 C CE . LYS B 2 109 ? -3.564 -18.020 -12.026 1.00 83.29 109 B 1 ATOM 2037 N NZ . LYS B 2 109 ? -3.545 -16.660 -12.615 1.00 73.67 109 B 1 ATOM 2038 N N . ILE B 2 110 ? -4.859 -20.099 -5.395 1.00 97.32 110 B 1 ATOM 2039 C CA . ILE B 2 110 ? -4.813 -19.918 -3.942 1.00 97.55 110 B 1 ATOM 2040 C C . ILE B 2 110 ? -4.279 -21.194 -3.288 1.00 97.81 110 B 1 ATOM 2041 O O . ILE B 2 110 ? -3.343 -21.128 -2.498 1.00 97.49 110 B 1 ATOM 2042 C CB . ILE B 2 110 ? -6.195 -19.498 -3.397 1.00 97.35 110 B 1 ATOM 2043 C CG1 . ILE B 2 110 ? -6.604 -18.116 -3.966 1.00 96.30 110 B 1 ATOM 2044 C CG2 . ILE B 2 110 ? -6.193 -19.449 -1.855 1.00 96.56 110 B 1 ATOM 2045 C CD1 . ILE B 2 110 ? -8.087 -17.782 -3.777 1.00 93.21 110 B 1 ATOM 2046 N N . GLN B 2 111 ? -4.828 -22.347 -3.649 1.00 97.60 111 B 1 ATOM 2047 C CA . GLN B 2 111 ? -4.441 -23.635 -3.072 1.00 97.54 111 B 1 ATOM 2048 C C . GLN B 2 111 ? -2.988 -24.022 -3.386 1.00 97.77 111 B 1 ATOM 2049 O O . GLN B 2 111 ? -2.327 -24.647 -2.557 1.00 97.28 111 B 1 ATOM 2050 C CB . GLN B 2 111 ? -5.423 -24.703 -3.557 1.00 96.61 111 B 1 ATOM 2051 C CG . GLN B 2 111 ? -5.179 -26.047 -2.858 1.00 92.22 111 B 1 ATOM 2052 C CD . GLN B 2 111 ? -6.233 -27.095 -3.212 1.00 87.61 111 B 1 ATOM 2053 O OE1 . GLN B 2 111 ? -7.399 -26.828 -3.450 1.00 78.13 111 B 1 ATOM 2054 N NE2 . GLN B 2 111 ? -5.854 -28.344 -3.241 1.00 74.36 111 B 1 ATOM 2055 N N . ASN B 2 112 ? -2.470 -23.619 -4.546 1.00 97.18 112 B 1 ATOM 2056 C CA . ASN B 2 112 ? -1.097 -23.902 -4.973 1.00 97.08 112 B 1 ATOM 2057 C C . ASN B 2 112 ? -0.024 -23.137 -4.179 1.00 97.46 112 B 1 ATOM 2058 O O . ASN B 2 112 ? 1.163 -23.423 -4.340 1.00 96.32 112 B 1 ATOM 2059 C CB . ASN B 2 112 ? -0.976 -23.636 -6.484 1.00 96.00 112 B 1 ATOM 2060 C CG . ASN B 2 112 ? -1.646 -24.701 -7.339 1.00 90.24 112 B 1 ATOM 2061 O OD1 . ASN B 2 112 ? -2.024 -25.763 -6.886 1.00 80.56 112 B 1 ATOM 2062 N ND2 . ASN B 2 112 ? -1.789 -24.447 -8.623 1.00 78.67 112 B 1 ATOM 2063 N N . MET B 2 113 ? -0.394 -22.184 -3.316 1.00 97.60 113 B 1 ATOM 2064 C CA . MET B 2 113 ? 0.571 -21.591 -2.386 1.00 97.71 113 B 1 ATOM 2065 C C . MET B 2 113 ? 1.092 -22.669 -1.420 1.00 97.97 113 B 1 ATOM 2066 O O . MET B 2 113 ? 0.298 -23.433 -0.869 1.00 97.45 113 B 1 ATOM 2067 C CB . MET B 2 113 ? -0.048 -20.439 -1.596 1.00 97.26 113 B 1 ATOM 2068 C CG . MET B 2 113 ? -0.436 -19.246 -2.478 1.00 95.99 113 B 1 ATOM 2069 S SD . MET B 2 113 ? -1.012 -17.807 -1.535 1.00 95.56 113 B 1 ATOM 2070 C CE . MET B 2 113 ? -2.504 -18.468 -0.773 1.00 88.36 113 B 1 ATOM 2071 N N . PRO B 2 114 ? 2.407 -22.729 -1.158 1.00 97.94 114 B 1 ATOM 2072 C CA . PRO B 2 114 ? 3.003 -23.789 -0.347 1.00 97.70 114 B 1 ATOM 2073 C C . PRO B 2 114 ? 2.847 -23.534 1.157 1.00 97.88 114 B 1 ATOM 2074 O O . PRO B 2 114 ? 3.822 -23.555 1.909 1.00 96.83 114 B 1 ATOM 2075 C CB . PRO B 2 114 ? 4.457 -23.847 -0.827 1.00 96.94 114 B 1 ATOM 2076 C CG . PRO B 2 114 ? 4.759 -22.387 -1.132 1.00 96.14 114 B 1 ATOM 2077 C CD . PRO B 2 114 ? 3.441 -21.886 -1.727 1.00 97.26 114 B 1 ATOM 2078 N N . ILE B 2 115 ? 1.613 -23.302 1.626 1.00 98.10 115 B 1 ATOM 2079 C CA . ILE B 2 115 ? 1.291 -22.945 3.018 1.00 98.14 115 B 1 ATOM 2080 C C . ILE B 2 115 ? 1.809 -24.002 3.998 1.00 98.02 115 B 1 ATOM 2081 O O . ILE B 2 115 ? 2.309 -23.670 5.074 1.00 97.13 115 B 1 ATOM 2082 C CB . ILE B 2 115 ? -0.228 -22.730 3.180 1.00 97.89 115 B 1 ATOM 2083 C CG1 . ILE B 2 115 ? -0.802 -21.669 2.214 1.00 96.32 115 B 1 ATOM 2084 C CG2 . ILE B 2 115 ? -0.587 -22.367 4.626 1.00 96.83 115 B 1 ATOM 2085 C CD1 . ILE B 2 115 ? -0.146 -20.293 2.293 1.00 92.40 115 B 1 ATOM 2086 N N . GLN B 2 116 ? 1.789 -25.271 3.603 1.00 97.71 116 B 1 ATOM 2087 C CA . GLN B 2 116 ? 2.318 -26.385 4.390 1.00 97.09 116 B 1 ATOM 2088 C C . GLN B 2 116 ? 3.809 -26.242 4.741 1.00 97.15 116 B 1 ATOM 2089 O O . GLN B 2 116 ? 4.253 -26.830 5.725 1.00 95.35 116 B 1 ATOM 2090 C CB . GLN B 2 116 ? 2.050 -27.716 3.668 1.00 95.41 116 B 1 ATOM 2091 C CG . GLN B 2 116 ? 2.784 -27.950 2.323 1.00 88.85 116 B 1 ATOM 2092 C CD . GLN B 2 116 ? 2.154 -27.236 1.119 1.00 86.93 116 B 1 ATOM 2093 O OE1 . GLN B 2 116 ? 1.189 -26.494 1.227 1.00 77.12 116 B 1 ATOM 2094 N NE2 . GLN B 2 116 ? 2.677 -27.445 -0.066 1.00 74.59 116 B 1 ATOM 2095 N N . SER B 2 117 ? 4.569 -25.454 3.980 1.00 97.50 117 B 1 ATOM 2096 C CA . SER B 2 117 ? 5.991 -25.195 4.223 1.00 97.05 117 B 1 ATOM 2097 C C . SER B 2 117 ? 6.238 -23.950 5.080 1.00 97.28 117 B 1 ATOM 2098 O O . SER B 2 117 ? 7.336 -23.782 5.603 1.00 95.72 117 B 1 ATOM 2099 C CB . SER B 2 117 ? 6.738 -25.063 2.892 1.00 95.87 117 B 1 ATOM 2100 O OG . SER B 2 117 ? 6.525 -26.213 2.090 1.00 89.03 117 B 1 ATOM 2101 N N . LEU B 2 118 ? 5.226 -23.088 5.255 1.00 97.92 118 B 1 ATOM 2102 C CA . LEU B 2 118 ? 5.347 -21.821 5.992 1.00 97.90 118 B 1 ATOM 2103 C C . LEU B 2 118 ? 5.117 -21.970 7.502 1.00 97.83 118 B 1 ATOM 2104 O O . LEU B 2 118 ? 5.400 -21.047 8.269 1.00 96.58 118 B 1 ATOM 2105 C CB . LEU B 2 118 ? 4.371 -20.791 5.397 1.00 97.66 118 B 1 ATOM 2106 C CG . LEU B 2 118 ? 4.617 -20.441 3.919 1.00 96.76 118 B 1 ATOM 2107 C CD1 . LEU B 2 118 ? 3.532 -19.487 3.429 1.00 94.47 118 B 1 ATOM 2108 C CD2 . LEU B 2 118 ? 5.968 -19.768 3.701 1.00 93.92 118 B 1 ATOM 2109 N N . GLN B 2 119 ? 4.602 -23.119 7.945 1.00 97.80 119 B 1 ATOM 2110 C CA . GLN B 2 119 ? 4.266 -23.356 9.345 1.00 97.64 119 B 1 ATOM 2111 C C . GLN B 2 119 ? 4.487 -24.822 9.720 1.00 97.50 119 B 1 ATOM 2112 O O . GLN B 2 119 ? 4.093 -25.733 8.986 1.00 96.24 119 B 1 ATOM 2113 C CB . GLN B 2 119 ? 2.818 -22.898 9.570 1.00 96.64 119 B 1 ATOM 2114 C CG . GLN B 2 119 ? 2.409 -22.890 11.040 1.00 95.86 119 B 1 ATOM 2115 C CD . GLN B 2 119 ? 1.030 -22.257 11.205 1.00 97.05 119 B 1 ATOM 2116 O OE1 . GLN B 2 119 ? 0.012 -22.879 10.951 1.00 92.43 119 B 1 ATOM 2117 N NE2 . GLN B 2 119 ? 0.960 -21.008 11.600 1.00 91.87 119 B 1 ATOM 2118 N N . GLN B 2 120 ? 5.117 -25.044 10.881 1.00 97.03 120 B 1 ATOM 2119 C CA . GLN B 2 120 ? 5.262 -26.365 11.512 1.00 96.45 120 B 1 ATOM 2120 C C . GLN B 2 120 ? 4.134 -26.592 12.512 1.00 96.76 120 B 1 ATOM 2121 O O . GLN B 2 120 ? 3.325 -27.504 12.338 1.00 94.53 120 B 1 ATOM 2122 C CB . GLN B 2 120 ? 6.641 -26.456 12.198 1.00 94.57 120 B 1 ATOM 2123 C CG . GLN B 2 120 ? 7.814 -26.594 11.207 1.00 84.94 120 B 1 ATOM 2124 C CD . GLN B 2 120 ? 8.162 -28.050 10.863 1.00 78.17 120 B 1 ATOM 2125 O OE1 . GLN B 2 120 ? 7.778 -28.994 11.529 1.00 69.74 120 B 1 ATOM 2126 N NE2 . GLN B 2 120 ? 8.925 -28.274 9.813 1.00 65.93 120 B 1 ATOM 2127 N N . ASP B 2 121 ? 4.045 -25.719 13.520 1.00 97.23 121 B 1 ATOM 2128 C CA . ASP B 2 121 ? 3.089 -25.758 14.623 1.00 97.03 121 B 1 ATOM 2129 C C . ASP B 2 121 ? 2.392 -24.404 14.732 1.00 97.24 121 B 1 ATOM 2130 O O . ASP B 2 121 ? 3.054 -23.370 14.862 1.00 95.63 121 B 1 ATOM 2131 C CB . ASP B 2 121 ? 3.809 -26.046 15.946 1.00 96.07 121 B 1 ATOM 2132 C CG . ASP B 2 121 ? 4.754 -27.240 15.866 1.00 95.47 121 B 1 ATOM 2133 O OD1 . ASP B 2 121 ? 4.249 -28.383 15.772 1.00 91.40 121 B 1 ATOM 2134 O OD2 . ASP B 2 121 ? 5.984 -26.992 15.888 1.00 91.42 121 B 1 ATOM 2135 N N . GLY B 2 122 ? 1.060 -24.399 14.698 1.00 97.44 122 B 1 ATOM 2136 C CA . GLY B 2 122 ? 0.310 -23.156 14.818 1.00 97.68 122 B 1 ATOM 2137 C C . GLY B 2 122 ? -1.053 -23.188 14.162 1.00 98.15 122 B 1 ATOM 2138 O O . GLY B 2 122 ? -1.624 -24.250 13.909 1.00 97.57 122 B 1 ATOM 2139 N N . PHE B 2 123 ? -1.580 -22.006 13.910 1.00 98.28 123 B 1 ATOM 2140 C CA . PHE B 2 123 ? -2.928 -21.809 13.400 1.00 98.36 123 B 1 ATOM 2141 C C . PHE B 2 123 ? -2.927 -21.112 12.043 1.00 98.50 123 B 1 ATOM 2142 O O . PHE B 2 123 ? -2.087 -20.260 11.753 1.00 98.22 123 B 1 ATOM 2143 C CB . PHE B 2 123 ? -3.769 -21.040 14.421 1.00 98.11 123 B 1 ATOM 2144 C CG . PHE B 2 123 ? -3.935 -21.751 15.748 1.00 98.04 123 B 1 ATOM 2145 C CD1 . PHE B 2 123 ? -5.040 -22.598 15.970 1.00 96.74 123 B 1 ATOM 2146 C CD2 . PHE B 2 123 ? -2.984 -21.575 16.770 1.00 96.69 123 B 1 ATOM 2147 C CE1 . PHE B 2 123 ? -5.202 -23.252 17.202 1.00 96.07 123 B 1 ATOM 2148 C CE2 . PHE B 2 123 ? -3.137 -22.233 18.006 1.00 96.10 123 B 1 ATOM 2149 C CZ . PHE B 2 123 ? -4.248 -23.068 18.224 1.00 96.57 123 B 1 ATOM 2150 N N . ILE B 2 124 ? -3.919 -21.446 11.235 1.00 98.48 124 B 1 ATOM 2151 C CA . ILE B 2 124 ? -4.254 -20.716 10.018 1.00 98.58 124 B 1 ATOM 2152 C C . ILE B 2 124 ? -5.643 -20.107 10.149 1.00 98.62 124 B 1 ATOM 2153 O O . ILE B 2 124 ? -6.573 -20.759 10.612 1.00 98.24 124 B 1 ATOM 2154 C CB . ILE B 2 124 ? -4.090 -21.595 8.768 1.00 98.29 124 B 1 ATOM 2155 C CG1 . ILE B 2 124 ? -4.173 -20.731 7.494 1.00 97.43 124 B 1 ATOM 2156 C CG2 . ILE B 2 124 ? -5.114 -22.753 8.728 1.00 96.92 124 B 1 ATOM 2157 C CD1 . ILE B 2 124 ? -3.759 -21.478 6.225 1.00 94.88 124 B 1 ATOM 2158 N N . PHE B 2 125 ? -5.785 -18.864 9.729 1.00 98.67 125 B 1 ATOM 2159 C CA . PHE B 2 125 ? -7.029 -18.104 9.698 1.00 98.67 125 B 1 ATOM 2160 C C . PHE B 2 125 ? -7.341 -17.756 8.244 1.00 98.69 125 B 1 ATOM 2161 O O . PHE B 2 125 ? -6.587 -17.027 7.604 1.00 98.30 125 B 1 ATOM 2162 C CB . PHE B 2 125 ? -6.866 -16.838 10.550 1.00 98.47 125 B 1 ATOM 2163 C CG . PHE B 2 125 ? -6.851 -17.052 12.052 1.00 98.41 125 B 1 ATOM 2164 C CD1 . PHE B 2 125 ? -7.896 -16.535 12.846 1.00 97.00 125 B 1 ATOM 2165 C CD2 . PHE B 2 125 ? -5.799 -17.742 12.676 1.00 97.14 125 B 1 ATOM 2166 C CE1 . PHE B 2 125 ? -7.895 -16.716 14.238 1.00 96.27 125 B 1 ATOM 2167 C CE2 . PHE B 2 125 ? -5.797 -17.937 14.070 1.00 96.28 125 B 1 ATOM 2168 C CZ . PHE B 2 125 ? -6.847 -17.424 14.851 1.00 97.03 125 B 1 ATOM 2169 N N . VAL B 2 126 ? -8.449 -18.250 7.713 1.00 98.62 126 B 1 ATOM 2170 C CA . VAL B 2 126 ? -8.847 -17.986 6.323 1.00 98.58 126 B 1 ATOM 2171 C C . VAL B 2 126 ? -10.234 -17.367 6.282 1.00 98.59 126 B 1 ATOM 2172 O O . VAL B 2 126 ? -11.231 -18.008 6.619 1.00 98.11 126 B 1 ATOM 2173 C CB . VAL B 2 126 ? -8.767 -19.238 5.430 1.00 98.31 126 B 1 ATOM 2174 C CG1 . VAL B 2 126 ? -8.974 -18.856 3.959 1.00 97.16 126 B 1 ATOM 2175 C CG2 . VAL B 2 126 ? -7.409 -19.942 5.547 1.00 97.26 126 B 1 ATOM 2176 N N . TRP B 2 127 ? -10.314 -16.118 5.832 1.00 98.48 127 B 1 ATOM 2177 C CA . TRP B 2 127 ? -11.588 -15.451 5.581 1.00 98.38 127 B 1 ATOM 2178 C C . TRP B 2 127 ? -12.276 -16.063 4.360 1.00 98.03 127 B 1 ATOM 2179 O O . TRP B 2 127 ? -11.743 -16.051 3.248 1.00 97.09 127 B 1 ATOM 2180 C CB . TRP B 2 127 ? -11.368 -13.951 5.416 1.00 98.35 127 B 1 ATOM 2181 C CG . TRP B 2 127 ? -10.960 -13.251 6.681 1.00 98.41 127 B 1 ATOM 2182 C CD1 . TRP B 2 127 ? -9.693 -12.965 7.048 1.00 97.84 127 B 1 ATOM 2183 C CD2 . TRP B 2 127 ? -11.824 -12.780 7.765 1.00 98.25 127 B 1 ATOM 2184 N NE1 . TRP B 2 127 ? -9.703 -12.336 8.291 1.00 97.65 127 B 1 ATOM 2185 C CE2 . TRP B 2 127 ? -10.991 -12.208 8.765 1.00 97.97 127 B 1 ATOM 2186 C CE3 . TRP B 2 127 ? -13.216 -12.786 7.985 1.00 98.05 127 B 1 ATOM 2187 C CZ2 . TRP B 2 127 ? -11.520 -11.663 9.958 1.00 97.63 127 B 1 ATOM 2188 C CZ3 . TRP B 2 127 ? -13.746 -12.240 9.175 1.00 97.19 127 B 1 ATOM 2189 C CH2 . TRP B 2 127 ? -12.906 -11.688 10.148 1.00 97.03 127 B 1 ATOM 2190 N N . ALA B 2 128 ? -13.485 -16.566 4.555 1.00 97.42 128 B 1 ATOM 2191 C CA . ALA B 2 128 ? -14.254 -17.228 3.514 1.00 96.65 128 B 1 ATOM 2192 C C . ALA B 2 128 ? -15.595 -16.526 3.281 1.00 95.87 128 B 1 ATOM 2193 O O . ALA B 2 128 ? -16.417 -16.365 4.181 1.00 93.14 128 B 1 ATOM 2194 C CB . ALA B 2 128 ? -14.425 -18.700 3.886 1.00 95.42 128 B 1 ATOM 2195 N N . ILE B 2 129 ? -15.852 -16.174 2.028 1.00 95.25 129 B 1 ATOM 2196 C CA . ILE B 2 129 ? -17.210 -15.803 1.611 1.00 93.87 129 B 1 ATOM 2197 C C . ILE B 2 129 ? -18.097 -17.053 1.552 1.00 94.33 129 B 1 ATOM 2198 O O . ILE B 2 129 ? -17.614 -18.159 1.303 1.00 93.50 129 B 1 ATOM 2199 C CB . ILE B 2 129 ? -17.208 -15.032 0.273 1.00 91.78 129 B 1 ATOM 2200 C CG1 . ILE B 2 129 ? -16.616 -15.866 -0.881 1.00 87.05 129 B 1 ATOM 2201 C CG2 . ILE B 2 129 ? -16.463 -13.695 0.449 1.00 85.53 129 B 1 ATOM 2202 C CD1 . ILE B 2 129 ? -16.770 -15.212 -2.264 1.00 82.41 129 B 1 ATOM 2203 N N . ASN B 2 130 ? -19.411 -16.880 1.687 1.00 92.34 130 B 1 ATOM 2204 C CA . ASN B 2 130 ? -20.370 -17.998 1.714 1.00 91.98 130 B 1 ATOM 2205 C C . ASN B 2 130 ? -20.221 -18.971 0.526 1.00 93.11 130 B 1 ATOM 2206 O O . ASN B 2 130 ? -20.274 -20.187 0.708 1.00 92.32 130 B 1 ATOM 2207 C CB . ASN B 2 130 ? -21.803 -17.430 1.748 1.00 90.26 130 B 1 ATOM 2208 C CG . ASN B 2 130 ? -22.174 -16.781 3.069 1.00 85.86 130 B 1 ATOM 2209 O OD1 . ASN B 2 130 ? -21.445 -16.772 4.029 1.00 77.42 130 B 1 ATOM 2210 N ND2 . ASN B 2 130 ? -23.355 -16.206 3.160 1.00 76.02 130 B 1 ATOM 2211 N N . ALA B 2 131 ? -20.004 -18.450 -0.682 1.00 92.19 131 B 1 ATOM 2212 C CA . ALA B 2 131 ? -19.821 -19.266 -1.887 1.00 92.17 131 B 1 ATOM 2213 C C . ALA B 2 131 ? -18.529 -20.110 -1.868 1.00 93.69 131 B 1 ATOM 2214 O O . ALA B 2 131 ? -18.423 -21.091 -2.603 1.00 92.72 131 B 1 ATOM 2215 C CB . ALA B 2 131 ? -19.850 -18.332 -3.100 1.00 90.47 131 B 1 ATOM 2216 N N . LYS B 2 132 ? -17.548 -19.738 -1.041 1.00 94.52 132 B 1 ATOM 2217 C CA . LYS B 2 132 ? -16.236 -20.386 -0.935 1.00 95.71 132 B 1 ATOM 2218 C C . LYS B 2 132 ? -16.031 -21.121 0.387 1.00 96.70 132 B 1 ATOM 2219 O O . LYS B 2 132 ? -14.983 -21.712 0.587 1.00 96.02 132 B 1 ATOM 2220 C CB . LYS B 2 132 ? -15.132 -19.350 -1.208 1.00 95.22 132 B 1 ATOM 2221 C CG . LYS B 2 132 ? -15.174 -18.744 -2.624 1.00 93.84 132 B 1 ATOM 2222 C CD . LYS B 2 132 ? -14.903 -19.784 -3.715 1.00 91.48 132 B 1 ATOM 2223 C CE . LYS B 2 132 ? -14.824 -19.124 -5.088 1.00 89.59 132 B 1 ATOM 2224 N NZ . LYS B 2 132 ? -14.420 -20.086 -6.125 1.00 85.90 132 B 1 ATOM 2225 N N . TYR B 2 133 ? -17.043 -21.170 1.252 1.00 95.44 133 B 1 ATOM 2226 C CA . TYR B 2 133 ? -16.945 -21.785 2.577 1.00 96.17 133 B 1 ATOM 2227 C C . TYR B 2 133 ? -16.435 -23.239 2.517 1.00 96.80 133 B 1 ATOM 2228 O O . TYR B 2 133 ? -15.426 -23.587 3.132 1.00 96.35 133 B 1 ATOM 2229 C CB . TYR B 2 133 ? -18.317 -21.693 3.248 1.00 95.80 133 B 1 ATOM 2230 C CG . TYR B 2 133 ? -18.290 -22.016 4.720 1.00 95.85 133 B 1 ATOM 2231 C CD1 . TYR B 2 133 ? -18.321 -23.356 5.161 1.00 93.00 133 B 1 ATOM 2232 C CD2 . TYR B 2 133 ? -18.231 -20.970 5.661 1.00 93.25 133 B 1 ATOM 2233 C CE1 . TYR B 2 133 ? -18.293 -23.654 6.534 1.00 92.14 133 B 1 ATOM 2234 C CE2 . TYR B 2 133 ? -18.209 -21.255 7.034 1.00 91.92 133 B 1 ATOM 2235 C CZ . TYR B 2 133 ? -18.238 -22.602 7.466 1.00 92.94 133 B 1 ATOM 2236 O OH . TYR B 2 133 ? -18.218 -22.889 8.804 1.00 91.47 133 B 1 ATOM 2237 N N . ARG B 2 134 ? -17.074 -24.083 1.704 1.00 96.14 134 B 1 ATOM 2238 C CA . ARG B 2 134 ? -16.690 -25.502 1.583 1.00 96.22 134 B 1 ATOM 2239 C C . ARG B 2 134 ? -15.325 -25.706 0.927 1.00 96.91 134 B 1 ATOM 2240 O O . ARG B 2 134 ? -14.617 -26.630 1.308 1.00 96.09 134 B 1 ATOM 2241 C CB . ARG B 2 134 ? -17.748 -26.288 0.797 1.00 95.42 134 B 1 ATOM 2242 C CG . ARG B 2 134 ? -19.069 -26.435 1.562 1.00 86.76 134 B 1 ATOM 2243 C CD . ARG B 2 134 ? -19.995 -27.375 0.792 1.00 83.27 134 B 1 ATOM 2244 N NE . ARG B 2 134 ? -21.288 -27.553 1.478 1.00 72.23 134 B 1 ATOM 2245 C CZ . ARG B 2 134 ? -22.092 -28.601 1.395 1.00 63.82 134 B 1 ATOM 2246 N NH1 . ARG B 2 134 ? -21.800 -29.634 0.654 1.00 57.03 134 B 1 ATOM 2247 N NH2 . ARG B 2 134 ? -23.210 -28.623 2.060 1.00 56.60 134 B 1 ATOM 2248 N N . VAL B 2 135 ? -14.974 -24.903 -0.073 1.00 96.86 135 B 1 ATOM 2249 C CA . VAL B 2 135 ? -13.661 -25.031 -0.720 1.00 96.71 135 B 1 ATOM 2250 C C . VAL B 2 135 ? -12.554 -24.571 0.222 1.00 97.50 135 B 1 ATOM 2251 O O . VAL B 2 135 ? -11.502 -25.193 0.242 1.00 96.79 135 B 1 ATOM 2252 C CB . VAL B 2 135 ? -13.613 -24.356 -2.107 1.00 94.67 135 B 1 ATOM 2253 C CG1 . VAL B 2 135 ? -13.640 -22.835 -2.071 1.00 86.27 135 B 1 ATOM 2254 C CG2 . VAL B 2 135 ? -12.377 -24.806 -2.881 1.00 85.46 135 B 1 ATOM 2255 N N . THR B 2 136 ? -12.811 -23.587 1.068 1.00 97.53 136 B 1 ATOM 2256 C CA . THR B 2 136 ? -11.865 -23.123 2.087 1.00 97.75 136 B 1 ATOM 2257 C C . THR B 2 136 ? -11.545 -24.219 3.097 1.00 98.05 136 B 1 ATOM 2258 O O . THR B 2 136 ? -10.374 -24.427 3.397 1.00 97.70 136 B 1 ATOM 2259 C CB . THR B 2 136 ? -12.395 -21.881 2.809 1.00 97.37 136 B 1 ATOM 2260 O OG1 . THR B 2 136 ? -12.653 -20.863 1.868 1.00 93.67 136 B 1 ATOM 2261 C CG2 . THR B 2 136 ? -11.390 -21.316 3.805 1.00 93.95 136 B 1 ATOM 2262 N N . ILE B 2 137 ? -12.536 -24.974 3.568 1.00 97.89 137 B 1 ATOM 2263 C CA . ILE B 2 137 ? -12.302 -26.135 4.443 1.00 97.84 137 B 1 ATOM 2264 C C . ILE B 2 137 ? -11.346 -27.120 3.766 1.00 98.00 137 B 1 ATOM 2265 O O . ILE B 2 137 ? -10.318 -27.473 4.339 1.00 97.46 137 B 1 ATOM 2266 C CB . ILE B 2 137 ? -13.626 -26.820 4.849 1.00 97.39 137 B 1 ATOM 2267 C CG1 . ILE B 2 137 ? -14.516 -25.846 5.657 1.00 95.66 137 B 1 ATOM 2268 C CG2 . ILE B 2 137 ? -13.345 -28.096 5.664 1.00 95.78 137 B 1 ATOM 2269 C CD1 . ILE B 2 137 ? -15.921 -26.379 5.964 1.00 92.18 137 B 1 ATOM 2270 N N . LYS B 2 138 ? -11.621 -27.488 2.513 1.00 98.06 138 B 1 ATOM 2271 C CA . LYS B 2 138 ? -10.754 -28.399 1.754 1.00 97.97 138 B 1 ATOM 2272 C C . LYS B 2 138 ? -9.344 -27.843 1.549 1.00 98.11 138 B 1 ATOM 2273 O O . LYS B 2 138 ? -8.384 -28.603 1.614 1.00 97.32 138 B 1 ATOM 2274 C CB . LYS B 2 138 ? -11.366 -28.725 0.393 1.00 97.44 138 B 1 ATOM 2275 C CG . LYS B 2 138 ? -12.618 -29.604 0.515 1.00 84.71 138 B 1 ATOM 2276 C CD . LYS B 2 138 ? -13.094 -29.987 -0.885 1.00 77.16 138 B 1 ATOM 2277 C CE . LYS B 2 138 ? -14.261 -30.961 -0.790 1.00 64.61 138 B 1 ATOM 2278 N NZ . LYS B 2 138 ? -14.596 -31.525 -2.122 1.00 55.25 138 B 1 ATOM 2279 N N . MET B 2 139 ? -9.195 -26.548 1.301 1.00 97.97 139 B 1 ATOM 2280 C CA . MET B 2 139 ? -7.880 -25.910 1.176 1.00 97.82 139 B 1 ATOM 2281 C C . MET B 2 139 ? -7.084 -26.016 2.474 1.00 98.13 139 B 1 ATOM 2282 O O . MET B 2 139 ? -5.923 -26.417 2.445 1.00 97.66 139 B 1 ATOM 2283 C CB . MET B 2 139 ? -8.026 -24.434 0.796 1.00 96.92 139 B 1 ATOM 2284 C CG . MET B 2 139 ? -8.430 -24.224 -0.662 1.00 92.22 139 B 1 ATOM 2285 S SD . MET B 2 139 ? -8.686 -22.471 -1.050 1.00 91.60 139 B 1 ATOM 2286 C CE . MET B 2 139 ? -8.988 -22.594 -2.819 1.00 82.74 139 B 1 ATOM 2287 N N . ILE B 2 140 ? -7.713 -25.706 3.609 1.00 98.14 140 B 1 ATOM 2288 C CA . ILE B 2 140 ? -7.107 -25.802 4.944 1.00 98.04 140 B 1 ATOM 2289 C C . ILE B 2 140 ? -6.654 -27.243 5.230 1.00 98.14 140 B 1 ATOM 2290 O O . ILE B 2 140 ? -5.520 -27.465 5.645 1.00 97.43 140 B 1 ATOM 2291 C CB . ILE B 2 140 ? -8.112 -25.268 5.997 1.00 97.05 140 B 1 ATOM 2292 C CG1 . ILE B 2 140 ? -8.210 -23.726 5.897 1.00 92.58 140 B 1 ATOM 2293 C CG2 . ILE B 2 140 ? -7.726 -25.679 7.427 1.00 92.26 140 B 1 ATOM 2294 C CD1 . ILE B 2 140 ? -9.339 -23.122 6.748 1.00 90.77 140 B 1 ATOM 2295 N N . GLU B 2 141 ? -7.513 -28.223 4.958 1.00 98.18 141 B 1 ATOM 2296 C CA . GLU B 2 141 ? -7.194 -29.646 5.126 1.00 98.10 141 B 1 ATOM 2297 C C . GLU B 2 141 ? -6.050 -30.095 4.196 1.00 98.03 141 B 1 ATOM 2298 O O . GLU B 2 141 ? -5.111 -30.755 4.641 1.00 97.27 141 B 1 ATOM 2299 C CB . GLU B 2 141 ? -8.456 -30.486 4.873 1.00 97.83 141 B 1 ATOM 2300 C CG . GLU B 2 141 ? -9.510 -30.326 5.977 1.00 96.25 141 B 1 ATOM 2301 C CD . GLU B 2 141 ? -10.854 -31.003 5.656 1.00 95.26 141 B 1 ATOM 2302 O OE1 . GLU B 2 141 ? -11.637 -31.219 6.609 1.00 89.04 141 B 1 ATOM 2303 O OE2 . GLU B 2 141 ? -11.132 -31.287 4.464 1.00 91.33 141 B 1 ATOM 2304 N N . ASN B 2 142 ? -6.067 -29.671 2.934 1.00 98.09 142 B 1 ATOM 2305 C CA . ASN B 2 142 ? -5.027 -29.996 1.957 1.00 97.88 142 B 1 ATOM 2306 C C . ASN B 2 142 ? -3.663 -29.379 2.307 1.00 97.93 142 B 1 ATOM 2307 O O . ASN B 2 142 ? -2.627 -29.950 1.967 1.00 96.72 142 B 1 ATOM 2308 C CB . ASN B 2 142 ? -5.475 -29.533 0.563 1.00 97.36 142 B 1 ATOM 2309 C CG . ASN B 2 142 ? -6.549 -30.412 -0.052 1.00 94.56 142 B 1 ATOM 2310 O OD1 . ASN B 2 142 ? -6.812 -31.529 0.341 1.00 85.66 142 B 1 ATOM 2311 N ND2 . ASN B 2 142 ? -7.190 -29.944 -1.100 1.00 85.30 142 B 1 ATOM 2312 N N . TRP B 2 143 ? -3.631 -28.247 3.016 1.00 97.82 143 B 1 ATOM 2313 C CA . TRP B 2 143 ? -2.398 -27.681 3.574 1.00 97.85 143 B 1 ATOM 2314 C C . TRP B 2 143 ? -1.920 -28.385 4.859 1.00 97.86 143 B 1 ATOM 2315 O O . TRP B 2 143 ? -0.858 -28.045 5.385 1.00 96.97 143 B 1 ATOM 2316 C CB . TRP B 2 143 ? -2.571 -26.174 3.770 1.00 97.73 143 B 1 ATOM 2317 C CG . TRP B 2 143 ? -2.678 -25.359 2.515 1.00 97.83 143 B 1 ATOM 2318 C CD1 . TRP B 2 143 ? -1.976 -25.551 1.370 1.00 97.00 143 B 1 ATOM 2319 C CD2 . TRP B 2 143 ? -3.512 -24.183 2.282 1.00 97.73 143 B 1 ATOM 2320 N NE1 . TRP B 2 143 ? -2.318 -24.569 0.441 1.00 96.88 143 B 1 ATOM 2321 C CE2 . TRP B 2 143 ? -3.249 -23.708 0.968 1.00 97.41 143 B 1 ATOM 2322 C CE3 . TRP B 2 143 ? -4.444 -23.472 3.071 1.00 97.47 143 B 1 ATOM 2323 C CZ2 . TRP B 2 143 ? -3.889 -22.561 0.447 1.00 96.87 143 B 1 ATOM 2324 C CZ3 . TRP B 2 143 ? -5.083 -22.332 2.544 1.00 96.72 143 B 1 ATOM 2325 C CH2 . TRP B 2 143 ? -4.805 -21.886 1.249 1.00 96.47 143 B 1 ATOM 2326 N N . GLY B 2 144 ? -2.660 -29.379 5.350 1.00 97.69 144 B 1 ATOM 2327 C CA . GLY B 2 144 ? -2.281 -30.202 6.501 1.00 97.39 144 B 1 ATOM 2328 C C . GLY B 2 144 ? -2.835 -29.714 7.837 1.00 97.81 144 B 1 ATOM 2329 O O . GLY B 2 144 ? -2.324 -30.117 8.885 1.00 96.48 144 B 1 ATOM 2330 N N . TYR B 2 145 ? -3.855 -28.867 7.824 1.00 98.03 145 B 1 ATOM 2331 C CA . TYR B 2 145 ? -4.523 -28.385 9.030 1.00 98.26 145 B 1 ATOM 2332 C C . TYR B 2 145 ? -5.777 -29.201 9.331 1.00 98.29 145 B 1 ATOM 2333 O O . TYR B 2 145 ? -6.483 -29.658 8.434 1.00 97.56 145 B 1 ATOM 2334 C CB . TYR B 2 145 ? -4.881 -26.901 8.909 1.00 98.16 145 B 1 ATOM 2335 C CG . TYR B 2 145 ? -3.689 -25.991 8.726 1.00 98.40 145 B 1 ATOM 2336 C CD1 . TYR B 2 145 ? -3.095 -25.359 9.834 1.00 97.51 145 B 1 ATOM 2337 C CD2 . TYR B 2 145 ? -3.153 -25.783 7.445 1.00 97.64 145 B 1 ATOM 2338 C CE1 . TYR B 2 145 ? -1.971 -24.535 9.670 1.00 97.38 145 B 1 ATOM 2339 C CE2 . TYR B 2 145 ? -2.022 -24.966 7.266 1.00 97.45 145 B 1 ATOM 2340 C CZ . TYR B 2 145 ? -1.434 -24.347 8.382 1.00 97.91 145 B 1 ATOM 2341 O OH . TYR B 2 145 ? -0.320 -23.568 8.204 1.00 97.23 145 B 1 ATOM 2342 N N . LYS B 2 146 ? -6.098 -29.300 10.624 1.00 98.03 146 B 1 ATOM 2343 C CA . LYS B 2 146 ? -7.413 -29.730 11.093 1.00 97.97 146 B 1 ATOM 2344 C C . LYS B 2 146 ? -8.261 -28.487 11.348 1.00 98.05 146 B 1 ATOM 2345 O O . LYS B 2 146 ? -7.833 -27.614 12.097 1.00 97.06 146 B 1 ATOM 2346 C CB . LYS B 2 146 ? -7.229 -30.591 12.348 1.00 97.32 146 B 1 ATOM 2347 C CG . LYS B 2 146 ? -8.563 -31.103 12.895 1.00 88.37 146 B 1 ATOM 2348 C CD . LYS B 2 146 ? -8.337 -31.894 14.189 1.00 84.31 146 B 1 ATOM 2349 C CE . LYS B 2 146 ? -9.682 -32.313 14.769 1.00 69.88 146 B 1 ATOM 2350 N NZ . LYS B 2 146 ? -9.521 -32.966 16.094 1.00 61.61 146 B 1 ATOM 2351 N N . LEU B 2 147 ? -9.462 -28.419 10.774 1.00 98.06 147 B 1 ATOM 2352 C CA . LEU B 2 147 ? -10.424 -27.370 11.117 1.00 97.75 147 B 1 ATOM 2353 C C . LEU B 2 147 ? -10.855 -27.540 12.580 1.00 97.60 147 B 1 ATOM 2354 O O . LEU B 2 147 ? -11.262 -28.635 12.975 1.00 95.95 147 B 1 ATOM 2355 C CB . LEU B 2 147 ? -11.618 -27.439 10.155 1.00 96.84 147 B 1 ATOM 2356 C CG . LEU B 2 147 ? -12.597 -26.252 10.309 1.00 92.26 147 B 1 ATOM 2357 C CD1 . LEU B 2 147 ? -12.028 -24.979 9.677 1.00 86.10 147 B 1 ATOM 2358 C CD2 . LEU B 2 147 ? -13.916 -26.573 9.615 1.00 86.10 147 B 1 ATOM 2359 N N . VAL B 2 148 ? -10.748 -26.473 13.381 1.00 97.64 148 B 1 ATOM 2360 C CA . VAL B 2 148 ? -11.024 -26.513 14.827 1.00 96.88 148 B 1 ATOM 2361 C C . VAL B 2 148 ? -11.991 -25.443 15.299 1.00 96.76 148 B 1 ATOM 2362 O O . VAL B 2 148 ? -12.658 -25.667 16.304 1.00 93.70 148 B 1 ATOM 2363 C CB . VAL B 2 148 ? -9.742 -26.441 15.677 1.00 95.25 148 B 1 ATOM 2364 C CG1 . VAL B 2 148 ? -8.952 -27.749 15.541 1.00 90.85 148 B 1 ATOM 2365 C CG2 . VAL B 2 148 ? -8.836 -25.250 15.342 1.00 91.64 148 B 1 ATOM 2366 N N . ASP B 2 149 ? -12.071 -24.317 14.617 1.00 96.78 149 B 1 ATOM 2367 C CA . ASP B 2 149 ? -12.909 -23.196 15.046 1.00 97.07 149 B 1 ATOM 2368 C C . ASP B 2 149 ? -13.289 -22.282 13.875 1.00 97.61 149 B 1 ATOM 2369 O O . ASP B 2 149 ? -12.814 -22.439 12.743 1.00 96.39 149 B 1 ATOM 2370 C CB . ASP B 2 149 ? -12.180 -22.421 16.170 1.00 95.66 149 B 1 ATOM 2371 C CG . ASP B 2 149 ? -13.133 -21.932 17.261 1.00 93.18 149 B 1 ATOM 2372 O OD1 . ASP B 2 149 ? -14.321 -21.710 16.930 1.00 86.97 149 B 1 ATOM 2373 O OD2 . ASP B 2 149 ? -12.673 -21.812 18.419 1.00 87.21 149 B 1 ATOM 2374 N N . GLU B 2 150 ? -14.173 -21.320 14.149 1.00 97.30 150 B 1 ATOM 2375 C CA . GLU B 2 150 ? -14.582 -20.283 13.213 1.00 97.45 150 B 1 ATOM 2376 C C . GLU B 2 150 ? -14.870 -18.987 13.973 1.00 97.87 150 B 1 ATOM 2377 O O . GLU B 2 150 ? -15.746 -18.945 14.831 1.00 96.32 150 B 1 ATOM 2378 C CB . GLU B 2 150 ? -15.831 -20.743 12.425 1.00 95.17 150 B 1 ATOM 2379 C CG . GLU B 2 150 ? -16.398 -19.633 11.515 1.00 92.67 150 B 1 ATOM 2380 C CD . GLU B 2 150 ? -17.658 -20.034 10.720 1.00 93.69 150 B 1 ATOM 2381 O OE1 . GLU B 2 150 ? -18.385 -19.123 10.255 1.00 85.03 150 B 1 ATOM 2382 O OE2 . GLU B 2 150 ? -17.920 -21.230 10.485 1.00 87.71 150 B 1 ATOM 2383 N N . ILE B 2 151 ? -14.216 -17.899 13.597 1.00 97.82 151 B 1 ATOM 2384 C CA . ILE B 2 151 ? -14.604 -16.563 14.055 1.00 97.80 151 B 1 ATOM 2385 C C . ILE B 2 151 ? -15.667 -16.007 13.115 1.00 97.89 151 B 1 ATOM 2386 O O . ILE B 2 151 ? -15.460 -15.869 11.905 1.00 97.18 151 B 1 ATOM 2387 C CB . ILE B 2 151 ? -13.390 -15.629 14.214 1.00 97.18 151 B 1 ATOM 2388 C CG1 . ILE B 2 151 ? -12.526 -16.106 15.402 1.00 94.35 151 B 1 ATOM 2389 C CG2 . ILE B 2 151 ? -13.841 -14.172 14.435 1.00 94.94 151 B 1 ATOM 2390 C CD1 . ILE B 2 151 ? -11.169 -15.411 15.497 1.00 88.99 151 B 1 ATOM 2391 N N . THR B 2 152 ? -16.806 -15.609 13.681 1.00 97.75 152 B 1 ATOM 2392 C CA . THR B 2 152 ? -17.857 -14.897 12.962 1.00 97.58 152 B 1 ATOM 2393 C C . THR B 2 152 ? -17.768 -13.401 13.237 1.00 97.85 152 B 1 ATOM 2394 O O . THR B 2 152 ? -18.047 -12.931 14.338 1.00 96.92 152 B 1 ATOM 2395 C CB . THR B 2 152 ? -19.236 -15.468 13.305 1.00 96.49 152 B 1 ATOM 2396 O OG1 . THR B 2 152 ? -19.336 -16.787 12.810 1.00 91.45 152 B 1 ATOM 2397 C CG2 . THR B 2 152 ? -20.367 -14.685 12.644 1.00 91.42 152 B 1 ATOM 2398 N N . TRP B 2 153 ? -17.448 -12.619 12.209 1.00 97.57 153 B 1 ATOM 2399 C CA . TRP B 2 153 ? -17.571 -11.165 12.286 1.00 97.51 153 B 1 ATOM 2400 C C . TRP B 2 153 ? -19.005 -10.742 11.996 1.00 97.25 153 B 1 ATOM 2401 O O . TRP B 2 153 ? -19.440 -10.689 10.840 1.00 96.25 153 B 1 ATOM 2402 C CB . TRP B 2 153 ? -16.573 -10.483 11.356 1.00 97.21 153 B 1 ATOM 2403 C CG . TRP B 2 153 ? -16.708 -8.987 11.291 1.00 97.28 153 B 1 ATOM 2404 C CD1 . TRP B 2 153 ? -17.126 -8.174 12.293 1.00 96.08 153 B 1 ATOM 2405 C CD2 . TRP B 2 153 ? -16.446 -8.116 10.149 1.00 96.87 153 B 1 ATOM 2406 N NE1 . TRP B 2 153 ? -17.133 -6.853 11.848 1.00 95.87 153 B 1 ATOM 2407 C CE2 . TRP B 2 153 ? -16.708 -6.771 10.545 1.00 96.31 153 B 1 ATOM 2408 C CE3 . TRP B 2 153 ? -15.994 -8.338 8.828 1.00 96.06 153 B 1 ATOM 2409 C CZ2 . TRP B 2 153 ? -16.516 -5.681 9.673 1.00 95.56 153 B 1 ATOM 2410 C CZ3 . TRP B 2 153 ? -15.803 -7.252 7.959 1.00 94.91 153 B 1 ATOM 2411 C CH2 . TRP B 2 153 ? -16.061 -5.937 8.383 1.00 94.52 153 B 1 ATOM 2412 N N . VAL B 2 154 ? -19.736 -10.378 13.035 1.00 96.89 154 B 1 ATOM 2413 C CA . VAL B 2 154 ? -21.072 -9.782 12.947 1.00 96.48 154 B 1 ATOM 2414 C C . VAL B 2 154 ? -20.933 -8.275 12.749 1.00 96.57 154 B 1 ATOM 2415 O O . VAL B 2 154 ? -20.381 -7.551 13.577 1.00 95.74 154 B 1 ATOM 2416 C CB . VAL B 2 154 ? -21.928 -10.123 14.175 1.00 95.66 154 B 1 ATOM 2417 C CG1 . VAL B 2 154 ? -23.333 -9.525 14.041 1.00 92.64 154 B 1 ATOM 2418 C CG2 . VAL B 2 154 ? -22.081 -11.640 14.341 1.00 93.28 154 B 1 ATOM 2419 N N . LYS B 2 155 ? -21.460 -7.782 11.638 1.00 95.81 155 B 1 ATOM 2420 C CA . LYS B 2 155 ? -21.337 -6.380 11.240 1.00 95.07 155 B 1 ATOM 2421 C C . LYS B 2 155 ? -22.342 -5.514 11.994 1.00 94.76 155 B 1 ATOM 2422 O O . LYS B 2 155 ? -23.556 -5.700 11.878 1.00 93.13 155 B 1 ATOM 2423 C CB . LYS B 2 155 ? -21.499 -6.264 9.722 1.00 93.88 155 B 1 ATOM 2424 C CG . LYS B 2 155 ? -20.373 -7.010 8.983 1.00 91.72 155 B 1 ATOM 2425 C CD . LYS B 2 155 ? -20.640 -7.061 7.479 1.00 87.16 155 B 1 ATOM 2426 C CE . LYS B 2 155 ? -19.498 -7.838 6.830 1.00 82.80 155 B 1 ATOM 2427 N NZ . LYS B 2 155 ? -19.701 -8.077 5.388 1.00 76.81 155 B 1 ATOM 2428 N N . LYS B 2 156 ? -21.812 -4.553 12.717 1.00 95.57 156 B 1 ATOM 2429 C CA . LYS B 2 156 ? -22.561 -3.580 13.512 1.00 95.46 156 B 1 ATOM 2430 C C . LYS B 2 156 ? -22.870 -2.328 12.683 1.00 95.44 156 B 1 ATOM 2431 O O . LYS B 2 156 ? -22.069 -1.891 11.856 1.00 93.68 156 B 1 ATOM 2432 C CB . LYS B 2 156 ? -21.722 -3.281 14.766 1.00 93.51 156 B 1 ATOM 2433 C CG . LYS B 2 156 ? -22.437 -2.451 15.837 1.00 89.72 156 B 1 ATOM 2434 C CD . LYS B 2 156 ? -21.474 -2.245 17.015 1.00 89.22 156 B 1 ATOM 2435 C CE . LYS B 2 156 ? -22.069 -1.369 18.108 1.00 81.94 156 B 1 ATOM 2436 N NZ . LYS B 2 156 ? -21.082 -1.138 19.190 1.00 77.56 156 B 1 ATOM 2437 N N . THR B 2 157 ? -24.049 -1.746 12.892 1.00 94.21 157 B 1 ATOM 2438 C CA . THR B 2 157 ? -24.374 -0.405 12.389 1.00 93.31 157 B 1 ATOM 2439 C C . THR B 2 157 ? -23.871 0.667 13.359 1.00 93.75 157 B 1 ATOM 2440 O O . THR B 2 157 ? -23.677 0.387 14.541 1.00 92.02 157 B 1 ATOM 2441 C CB . THR B 2 157 ? -25.882 -0.219 12.176 1.00 91.49 157 B 1 ATOM 2442 O OG1 . THR B 2 157 ? -26.587 -0.296 13.387 1.00 85.10 157 B 1 ATOM 2443 C CG2 . THR B 2 157 ? -26.479 -1.252 11.221 1.00 84.32 157 B 1 ATOM 2444 N N . VAL B 2 158 ? -23.795 1.920 12.898 1.00 92.66 158 B 1 ATOM 2445 C CA . VAL B 2 158 ? -23.487 3.088 13.754 1.00 91.69 158 B 1 ATOM 2446 C C . VAL B 2 158 ? -24.402 3.192 14.988 1.00 92.46 158 B 1 ATOM 2447 O O . VAL B 2 158 ? -23.984 3.620 16.050 1.00 89.46 158 B 1 ATOM 2448 C CB . VAL B 2 158 ? -23.557 4.398 12.945 1.00 90.16 158 B 1 ATOM 2449 C CG1 . VAL B 2 158 ? -22.478 4.415 11.850 1.00 79.31 158 B 1 ATOM 2450 C CG2 . VAL B 2 158 ? -24.924 4.625 12.279 1.00 79.57 158 B 1 ATOM 2451 N N . ASN B 2 159 ? -25.641 2.698 14.884 1.00 92.56 159 B 1 ATOM 2452 C CA . ASN B 2 159 ? -26.617 2.670 15.983 1.00 92.24 159 B 1 ATOM 2453 C C . ASN B 2 159 ? -26.529 1.401 16.855 1.00 93.00 159 B 1 ATOM 2454 O O . ASN B 2 159 ? -27.480 1.065 17.565 1.00 89.17 159 B 1 ATOM 2455 C CB . ASN B 2 159 ? -28.026 2.874 15.400 1.00 90.78 159 B 1 ATOM 2456 C CG . ASN B 2 159 ? -28.203 4.223 14.720 1.00 86.70 159 B 1 ATOM 2457 O OD1 . ASN B 2 159 ? -27.481 5.165 14.929 1.00 76.13 159 B 1 ATOM 2458 N ND2 . ASN B 2 159 ? -29.199 4.355 13.872 1.00 76.03 159 B 1 ATOM 2459 N N . GLY B 2 160 ? -25.448 0.629 16.750 1.00 91.55 160 B 1 ATOM 2460 C CA . GLY B 2 160 ? -25.231 -0.577 17.558 1.00 90.77 160 B 1 ATOM 2461 C C . GLY B 2 160 ? -26.065 -1.799 17.168 1.00 92.65 160 B 1 ATOM 2462 O O . GLY B 2 160 ? -26.052 -2.795 17.892 1.00 88.59 160 B 1 ATOM 2463 N N . LYS B 2 161 ? -26.792 -1.749 16.047 1.00 91.64 161 B 1 ATOM 2464 C CA . LYS B 2 161 ? -27.625 -2.859 15.561 1.00 91.83 161 B 1 ATOM 2465 C C . LYS B 2 161 ? -26.865 -3.735 14.563 1.00 93.16 161 B 1 ATOM 2466 O O . LYS B 2 161 ? -25.912 -3.287 13.935 1.00 90.94 161 B 1 ATOM 2467 C CB . LYS B 2 161 ? -28.936 -2.330 14.956 1.00 90.03 161 B 1 ATOM 2468 C CG . LYS B 2 161 ? -29.781 -1.570 15.991 1.00 86.73 161 B 1 ATOM 2469 C CD . LYS B 2 161 ? -31.147 -1.171 15.419 1.00 78.67 161 B 1 ATOM 2470 C CE . LYS B 2 161 ? -31.943 -0.429 16.494 1.00 71.24 161 B 1 ATOM 2471 N NZ . LYS B 2 161 ? -33.316 -0.067 16.056 1.00 60.93 161 B 1 ATOM 2472 N N . ILE B 2 162 ? -27.347 -4.968 14.370 1.00 92.34 162 B 1 ATOM 2473 C CA . ILE B 2 162 ? -26.844 -5.853 13.316 1.00 91.85 162 B 1 ATOM 2474 C C . ILE B 2 162 ? -27.122 -5.217 11.946 1.00 91.42 162 B 1 ATOM 2475 O O . ILE B 2 162 ? -28.253 -4.829 11.638 1.00 87.80 162 B 1 ATOM 2476 C CB . ILE B 2 162 ? -27.438 -7.271 13.445 1.00 90.42 162 B 1 ATOM 2477 C CG1 . ILE B 2 162 ? -27.059 -7.892 14.809 1.00 86.12 162 B 1 ATOM 2478 C CG2 . ILE B 2 162 ? -26.946 -8.161 12.291 1.00 86.44 162 B 1 ATOM 2479 C CD1 . ILE B 2 162 ? -27.702 -9.258 15.080 1.00 84.21 162 B 1 ATOM 2480 N N . ALA B 2 163 ? -26.084 -5.108 11.123 1.00 92.06 163 B 1 ATOM 2481 C CA . ALA B 2 163 ? -26.194 -4.548 9.785 1.00 89.34 163 B 1 ATOM 2482 C C . ALA B 2 163 ? -27.076 -5.426 8.889 1.00 89.19 163 B 1 ATOM 2483 O O . ALA B 2 163 ? -27.135 -6.643 9.031 1.00 85.11 163 B 1 ATOM 2484 C CB . ALA B 2 163 ? -24.789 -4.356 9.196 1.00 86.20 163 B 1 ATOM 2485 N N . LYS B 2 164 ? -27.738 -4.800 7.917 1.00 88.72 164 B 1 ATOM 2486 C CA . LYS B 2 164 ? -28.536 -5.499 6.909 1.00 85.96 164 B 1 ATOM 2487 C C . LYS B 2 164 ? -27.841 -5.361 5.560 1.00 85.25 164 B 1 ATOM 2488 O O . LYS B 2 164 ? -27.756 -4.261 5.014 1.00 76.99 164 B 1 ATOM 2489 C CB . LYS B 2 164 ? -29.976 -4.962 6.897 1.00 80.77 164 B 1 ATOM 2490 C CG . LYS B 2 164 ? -30.707 -5.234 8.222 1.00 74.05 164 B 1 ATOM 2491 C CD . LYS B 2 164 ? -32.162 -4.760 8.149 1.00 67.76 164 B 1 ATOM 2492 C CE . LYS B 2 164 ? -32.886 -5.065 9.458 1.00 61.04 164 B 1 ATOM 2493 N NZ . LYS B 2 164 ? -34.324 -4.704 9.391 1.00 52.51 164 B 1 ATOM 2494 N N . GLY B 2 165 ? -27.305 -6.476 5.055 1.00 86.22 165 B 1 ATOM 2495 C CA . GLY B 2 165 ? -26.702 -6.563 3.729 1.00 83.87 165 B 1 ATOM 2496 C C . GLY B 2 165 ? -27.596 -7.302 2.741 1.00 85.38 165 B 1 ATOM 2497 O O . GLY B 2 165 ? -28.585 -7.926 3.124 1.00 80.68 165 B 1 ATOM 2498 N N . HIS B 2 166 ? -27.240 -7.239 1.471 1.00 85.82 166 B 1 ATOM 2499 C CA . HIS B 2 166 ? -27.917 -8.007 0.434 1.00 85.14 166 B 1 ATOM 2500 C C . HIS B 2 166 ? -27.586 -9.500 0.549 1.00 86.41 166 B 1 ATOM 2501 O O . HIS B 2 166 ? -26.456 -9.879 0.845 1.00 81.12 166 B 1 ATOM 2502 C CB . HIS B 2 166 ? -27.570 -7.445 -0.948 1.00 80.69 166 B 1 ATOM 2503 C CG . HIS B 2 166 ? -28.149 -6.069 -1.160 1.00 73.80 166 B 1 ATOM 2504 N ND1 . HIS B 2 166 ? -29.476 -5.775 -1.375 1.00 63.29 166 B 1 ATOM 2505 C CD2 . HIS B 2 166 ? -27.480 -4.869 -1.135 1.00 63.42 166 B 1 ATOM 2506 C CE1 . HIS B 2 166 ? -29.597 -4.440 -1.483 1.00 59.41 166 B 1 ATOM 2507 N NE2 . HIS B 2 166 ? -28.409 -3.857 -1.339 1.00 61.20 166 B 1 ATOM 2508 N N . GLY B 2 167 ? -28.583 -10.333 0.297 1.00 85.59 167 B 1 ATOM 2509 C CA . GLY B 2 167 ? -28.453 -11.781 0.205 1.00 84.88 167 B 1 ATOM 2510 C C . GLY B 2 167 ? -29.615 -12.342 -0.606 1.00 86.25 167 B 1 ATOM 2511 O O . GLY B 2 167 ? -30.627 -11.662 -0.776 1.00 82.36 167 B 1 ATOM 2512 N N . PHE B 2 168 ? -29.457 -13.560 -1.125 1.00 85.07 168 B 1 ATOM 2513 C CA . PHE B 2 168 ? -30.480 -14.166 -1.985 1.00 85.29 168 B 1 ATOM 2514 C C . PHE B 2 168 ? -31.665 -14.712 -1.175 1.00 87.15 168 B 1 ATOM 2515 O O . PHE B 2 168 ? -32.810 -14.365 -1.450 1.00 83.77 168 B 1 ATOM 2516 C CB . PHE B 2 168 ? -29.827 -15.242 -2.860 1.00 81.74 168 B 1 ATOM 2517 C CG . PHE B 2 168 ? -30.758 -15.770 -3.927 1.00 76.10 168 B 1 ATOM 2518 C CD1 . PHE B 2 168 ? -31.451 -16.976 -3.732 1.00 71.14 168 B 1 ATOM 2519 C CD2 . PHE B 2 168 ? -30.948 -15.047 -5.117 1.00 70.76 168 B 1 ATOM 2520 C CE1 . PHE B 2 168 ? -32.328 -17.461 -4.717 1.00 66.38 168 B 1 ATOM 2521 C CE2 . PHE B 2 168 ? -31.827 -15.527 -6.106 1.00 67.00 168 B 1 ATOM 2522 C CZ . PHE B 2 168 ? -32.517 -16.734 -5.906 1.00 65.83 168 B 1 ATOM 2523 N N . TYR B 2 169 ? -31.384 -15.511 -0.135 1.00 86.97 169 B 1 ATOM 2524 C CA . TYR B 2 169 ? -32.406 -16.049 0.772 1.00 88.31 169 B 1 ATOM 2525 C C . TYR B 2 169 ? -32.509 -15.222 2.056 1.00 89.69 169 B 1 ATOM 2526 O O . TYR B 2 169 ? -33.549 -14.633 2.351 1.00 86.86 169 B 1 ATOM 2527 C CB . TYR B 2 169 ? -32.088 -17.516 1.088 1.00 87.63 169 B 1 ATOM 2528 C CG . TYR B 2 169 ? -32.074 -18.425 -0.123 1.00 88.32 169 B 1 ATOM 2529 C CD1 . TYR B 2 169 ? -33.286 -18.797 -0.736 1.00 84.03 169 B 1 ATOM 2530 C CD2 . TYR B 2 169 ? -30.861 -18.909 -0.646 1.00 85.53 169 B 1 ATOM 2531 C CE1 . TYR B 2 169 ? -33.294 -19.646 -1.850 1.00 84.03 169 B 1 ATOM 2532 C CE2 . TYR B 2 169 ? -30.856 -19.759 -1.763 1.00 84.44 169 B 1 ATOM 2533 C CZ . TYR B 2 169 ? -32.075 -20.128 -2.362 1.00 85.11 169 B 1 ATOM 2534 O OH . TYR B 2 169 ? -32.078 -20.964 -3.453 1.00 82.13 169 B 1 ATOM 2535 N N . LEU B 2 170 ? -31.411 -15.155 2.819 1.00 91.11 170 B 1 ATOM 2536 C CA . LEU B 2 170 ? -31.308 -14.365 4.039 1.00 91.23 170 B 1 ATOM 2537 C C . LEU B 2 170 ? -30.457 -13.117 3.789 1.00 90.73 170 B 1 ATOM 2538 O O . LEU B 2 170 ? -29.562 -13.107 2.941 1.00 88.87 170 B 1 ATOM 2539 C CB . LEU B 2 170 ? -30.737 -15.219 5.182 1.00 91.08 170 B 1 ATOM 2540 C CG . LEU B 2 170 ? -31.562 -16.471 5.542 1.00 90.61 170 B 1 ATOM 2541 C CD1 . LEU B 2 170 ? -30.867 -17.234 6.655 1.00 87.03 170 B 1 ATOM 2542 C CD2 . LEU B 2 170 ? -32.979 -16.120 6.005 1.00 86.64 170 B 1 ATOM 2543 N N . GLN B 2 171 ? -30.707 -12.059 4.568 1.00 90.66 171 B 1 ATOM 2544 C CA . GLN B 2 171 ? -29.831 -10.896 4.565 1.00 89.96 171 B 1 ATOM 2545 C C . GLN B 2 171 ? -28.471 -11.269 5.161 1.00 90.86 171 B 1 ATOM 2546 O O . GLN B 2 171 ? -28.404 -11.902 6.212 1.00 89.10 171 B 1 ATOM 2547 C CB . GLN B 2 171 ? -30.473 -9.729 5.325 1.00 87.96 171 B 1 ATOM 2548 C CG . GLN B 2 171 ? -31.705 -9.196 4.582 1.00 83.33 171 B 1 ATOM 2549 C CD . GLN B 2 171 ? -32.334 -7.971 5.246 1.00 80.79 171 B 1 ATOM 2550 O OE1 . GLN B 2 171 ? -32.270 -7.736 6.438 1.00 73.01 171 B 1 ATOM 2551 N NE2 . GLN B 2 171 ? -32.991 -7.134 4.477 1.00 71.62 171 B 1 ATOM 2552 N N . HIS B 2 172 ? -27.388 -10.848 4.514 1.00 92.06 172 B 1 ATOM 2553 C CA . HIS B 2 172 ? -26.039 -11.100 5.008 1.00 91.55 172 B 1 ATOM 2554 C C . HIS B 2 172 ? -25.618 -10.001 5.986 1.00 92.10 172 B 1 ATOM 2555 O O . HIS B 2 172 ? -25.639 -8.814 5.661 1.00 90.18 172 B 1 ATOM 2556 C CB . HIS B 2 172 ? -25.058 -11.232 3.833 1.00 89.56 172 B 1 ATOM 2557 C CG . HIS B 2 172 ? -25.289 -12.430 2.951 1.00 87.06 172 B 1 ATOM 2558 N ND1 . HIS B 2 172 ? -24.580 -12.712 1.800 1.00 75.36 172 B 1 ATOM 2559 C CD2 . HIS B 2 172 ? -26.184 -13.454 3.112 1.00 75.28 172 B 1 ATOM 2560 C CE1 . HIS B 2 172 ? -25.044 -13.855 1.289 1.00 77.18 172 B 1 ATOM 2561 N NE2 . HIS B 2 172 ? -26.018 -14.341 2.060 1.00 79.06 172 B 1 ATOM 2562 N N . ALA B 2 173 ? -25.226 -10.410 7.183 1.00 93.06 173 B 1 ATOM 2563 C CA . ALA B 2 173 ? -24.767 -9.510 8.237 1.00 93.04 173 B 1 ATOM 2564 C C . ALA B 2 173 ? -23.460 -9.965 8.894 1.00 94.37 173 B 1 ATOM 2565 O O . ALA B 2 173 ? -23.009 -9.332 9.845 1.00 92.51 173 B 1 ATOM 2566 C CB . ALA B 2 173 ? -25.895 -9.356 9.255 1.00 90.56 173 B 1 ATOM 2567 N N . LYS B 2 174 ? -22.855 -11.045 8.403 1.00 94.44 174 B 1 ATOM 2568 C CA . LYS B 2 174 ? -21.622 -11.622 8.936 1.00 94.55 174 B 1 ATOM 2569 C C . LYS B 2 174 ? -20.626 -11.974 7.837 1.00 95.15 174 B 1 ATOM 2570 O O . LYS B 2 174 ? -21.004 -12.129 6.674 1.00 94.25 174 B 1 ATOM 2571 C CB . LYS B 2 174 ? -21.948 -12.833 9.840 1.00 92.30 174 B 1 ATOM 2572 C CG . LYS B 2 174 ? -22.559 -14.037 9.100 1.00 89.99 174 B 1 ATOM 2573 C CD . LYS B 2 174 ? -22.478 -15.303 9.962 1.00 88.61 174 B 1 ATOM 2574 C CE . LYS B 2 174 ? -22.818 -16.575 9.183 1.00 82.33 174 B 1 ATOM 2575 N NZ . LYS B 2 174 ? -21.957 -17.723 9.609 1.00 78.65 174 B 1 ATOM 2576 N N . GLU B 2 175 ? -19.379 -12.129 8.226 1.00 95.92 175 B 1 ATOM 2577 C CA . GLU B 2 175 ? -18.345 -12.856 7.489 1.00 95.88 175 B 1 ATOM 2578 C C . GLU B 2 175 ? -17.718 -13.892 8.414 1.00 96.73 175 B 1 ATOM 2579 O O . GLU B 2 175 ? -17.740 -13.719 9.627 1.00 96.13 175 B 1 ATOM 2580 C CB . GLU B 2 175 ? -17.291 -11.894 6.923 1.00 94.64 175 B 1 ATOM 2581 C CG . GLU B 2 175 ? -17.870 -11.074 5.766 1.00 90.90 175 B 1 ATOM 2582 C CD . GLU B 2 175 ? -16.905 -10.059 5.153 1.00 90.87 175 B 1 ATOM 2583 O OE1 . GLU B 2 175 ? -17.425 -9.048 4.617 1.00 82.94 175 B 1 ATOM 2584 O OE2 . GLU B 2 175 ? -15.680 -10.234 5.221 1.00 85.77 175 B 1 ATOM 2585 N N . SER B 2 176 ? -17.188 -14.966 7.836 1.00 97.02 176 B 1 ATOM 2586 C CA . SER B 2 176 ? -16.604 -16.077 8.576 1.00 97.28 176 B 1 ATOM 2587 C C . SER B 2 176 ? -15.102 -16.153 8.318 1.00 97.94 176 B 1 ATOM 2588 O O . SER B 2 176 ? -14.662 -16.019 7.175 1.00 97.32 176 B 1 ATOM 2589 C CB . SER B 2 176 ? -17.282 -17.391 8.187 1.00 95.94 176 B 1 ATOM 2590 O OG . SER B 2 176 ? -18.644 -17.412 8.586 1.00 88.87 176 B 1 ATOM 2591 N N . CYS B 2 177 ? -14.335 -16.378 9.379 1.00 97.99 177 B 1 ATOM 2592 C CA . CYS B 2 177 ? -12.910 -16.670 9.334 1.00 98.15 177 B 1 ATOM 2593 C C . CYS B 2 177 ? -12.691 -18.079 9.882 1.00 98.29 177 B 1 ATOM 2594 O O . CYS B 2 177 ? -12.839 -18.306 11.082 1.00 97.73 177 B 1 ATOM 2595 C CB . CYS B 2 177 ? -12.162 -15.603 10.136 1.00 97.92 177 B 1 ATOM 2596 S SG . CYS B 2 177 ? -10.380 -15.801 9.880 1.00 97.32 177 B 1 ATOM 2597 N N . LEU B 2 178 ? -12.383 -19.026 9.006 1.00 98.34 178 B 1 ATOM 2598 C CA . LEU B 2 178 ? -12.183 -20.424 9.377 1.00 98.42 178 B 1 ATOM 2599 C C . LEU B 2 178 ? -10.799 -20.612 9.985 1.00 98.49 178 B 1 ATOM 2600 O O . LEU B 2 178 ? -9.824 -20.079 9.453 1.00 98.01 178 B 1 ATOM 2601 C CB . LEU B 2 178 ? -12.374 -21.317 8.142 1.00 98.18 178 B 1 ATOM 2602 C CG . LEU B 2 178 ? -13.791 -21.269 7.536 1.00 96.02 178 B 1 ATOM 2603 C CD1 . LEU B 2 178 ? -13.847 -22.126 6.276 1.00 88.72 178 B 1 ATOM 2604 C CD2 . LEU B 2 178 ? -14.844 -21.805 8.501 1.00 88.68 178 B 1 ATOM 2605 N N . ILE B 2 179 ? -10.708 -21.386 11.069 1.00 98.24 179 B 1 ATOM 2606 C CA . ILE B 2 179 ? -9.475 -21.602 11.825 1.00 98.16 179 B 1 ATOM 2607 C C . ILE B 2 179 ? -9.069 -23.072 11.758 1.00 98.13 179 B 1 ATOM 2608 O O . ILE B 2 179 ? -9.804 -23.968 12.185 1.00 97.38 179 B 1 ATOM 2609 C CB . ILE B 2 179 ? -9.598 -21.094 13.276 1.00 97.72 179 B 1 ATOM 2610 C CG1 . ILE B 2 179 ? -10.055 -19.613 13.294 1.00 96.19 179 B 1 ATOM 2611 C CG2 . ILE B 2 179 ? -8.247 -21.258 14.000 1.00 96.30 179 B 1 ATOM 2612 C CD1 . ILE B 2 179 ? -10.286 -19.052 14.695 1.00 91.03 179 B 1 ATOM 2613 N N . GLY B 2 180 ? -7.877 -23.314 11.240 1.00 98.28 180 B 1 ATOM 2614 C CA . GLY B 2 180 ? -7.217 -24.609 11.247 1.00 98.22 180 B 1 ATOM 2615 C C . GLY B 2 180 ? -6.041 -24.643 12.211 1.00 98.40 180 B 1 ATOM 2616 O O . GLY B 2 180 ? -5.394 -23.625 12.444 1.00 97.94 180 B 1 ATOM 2617 N N . VAL B 2 181 ? -5.731 -25.820 12.740 1.00 98.21 181 B 1 ATOM 2618 C CA . VAL B 2 181 ? -4.553 -26.088 13.573 1.00 98.17 181 B 1 ATOM 2619 C C . VAL B 2 181 ? -3.669 -27.152 12.930 1.00 98.21 181 B 1 ATOM 2620 O O . VAL B 2 181 ? -4.160 -28.089 12.289 1.00 97.37 181 B 1 ATOM 2621 C CB . VAL B 2 181 ? -4.962 -26.455 15.012 1.00 97.05 181 B 1 ATOM 2622 C CG1 . VAL B 2 181 ? -5.592 -27.847 15.129 1.00 90.69 181 B 1 ATOM 2623 C CG2 . VAL B 2 181 ? -3.772 -26.381 15.971 1.00 90.34 181 B 1 ATOM 2624 N N . LYS B 2 182 ? -2.353 -27.019 13.123 1.00 97.85 182 B 1 ATOM 2625 C CA . LYS B 2 182 ? -1.348 -27.971 12.654 1.00 97.47 182 B 1 ATOM 2626 C C . LYS B 2 182 ? -0.262 -28.160 13.707 1.00 97.68 182 B 1 ATOM 2627 O O . LYS B 2 182 ? 0.137 -27.197 14.357 1.00 96.15 182 B 1 ATOM 2628 C CB . LYS B 2 182 ? -0.767 -27.443 11.332 1.00 94.62 182 B 1 ATOM 2629 C CG . LYS B 2 182 ? 0.329 -28.337 10.731 1.00 90.79 182 B 1 ATOM 2630 C CD . LYS B 2 182 ? 0.922 -27.661 9.496 1.00 90.99 182 B 1 ATOM 2631 C CE . LYS B 2 182 ? 2.105 -28.464 8.964 1.00 86.24 182 B 1 ATOM 2632 N NZ . LYS B 2 182 ? 2.852 -27.691 7.955 1.00 84.38 182 B 1 ATOM 2633 N N . GLY B 2 183 ? 0.243 -29.387 13.826 1.00 96.12 183 B 1 ATOM 2634 C CA . GLY B 2 183 ? 1.349 -29.714 14.716 1.00 95.86 183 B 1 ATOM 2635 C C . GLY B 2 183 ? 0.992 -29.603 16.196 1.00 96.44 183 B 1 ATOM 2636 O O . GLY B 2 183 ? -0.166 -29.801 16.585 1.00 93.25 183 B 1 ATOM 2637 N N . ASP B 2 184 ? 2.005 -29.319 17.019 1.00 94.84 184 B 1 ATOM 2638 C CA . ASP B 2 184 ? 1.877 -29.173 18.467 1.00 94.77 184 B 1 ATOM 2639 C C . ASP B 2 184 ? 1.711 -27.698 18.854 1.00 94.90 184 B 1 ATOM 2640 O O . ASP B 2 184 ? 2.647 -26.897 18.788 1.00 91.70 184 B 1 ATOM 2641 C CB . ASP B 2 184 ? 3.087 -29.812 19.162 1.00 92.87 184 B 1 ATOM 2642 C CG . ASP B 2 184 ? 3.015 -29.680 20.688 1.00 90.14 184 B 1 ATOM 2643 O OD1 . ASP B 2 184 ? 1.914 -29.386 21.211 1.00 84.23 184 B 1 ATOM 2644 O OD2 . ASP B 2 184 ? 4.072 -29.855 21.335 1.00 83.99 184 B 1 ATOM 2645 N N . VAL B 2 185 ? 0.500 -27.343 19.295 1.00 94.92 185 B 1 ATOM 2646 C CA . VAL B 2 185 ? 0.182 -26.003 19.813 1.00 94.34 185 B 1 ATOM 2647 C C . VAL B 2 185 ? 0.185 -25.938 21.344 1.00 94.35 185 B 1 ATOM 2648 O O . VAL B 2 185 ? -0.069 -24.881 21.919 1.00 89.71 185 B 1 ATOM 2649 C CB . VAL B 2 185 ? -1.123 -25.449 19.214 1.00 91.81 185 B 1 ATOM 2650 C CG1 . VAL B 2 185 ? -0.978 -25.268 17.692 1.00 84.76 185 B 1 ATOM 2651 C CG2 . VAL B 2 185 ? -2.327 -26.346 19.510 1.00 86.69 185 B 1 ATOM 2652 N N . ASP B 2 186 ? 0.534 -27.041 22.014 1.00 93.72 186 B 1 ATOM 2653 C CA . ASP B 2 186 ? 0.725 -27.122 23.470 1.00 92.52 186 B 1 ATOM 2654 C C . ASP B 2 186 ? 2.189 -26.878 23.876 1.00 92.12 186 B 1 ATOM 2655 O O . ASP B 2 186 ? 2.594 -27.100 25.013 1.00 86.91 186 B 1 ATOM 2656 C CB . ASP B 2 186 ? 0.123 -28.438 24.009 1.00 90.37 186 B 1 ATOM 2657 C CG . ASP B 2 186 ? -1.411 -28.427 23.968 1.00 86.54 186 B 1 ATOM 2658 O OD1 . ASP B 2 186 ? -2.002 -27.341 23.788 1.00 80.58 186 B 1 ATOM 2659 O OD2 . ASP B 2 186 ? -2.085 -29.441 24.258 1.00 82.20 186 B 1 ATOM 2660 N N . ASN B 2 187 ? 2.977 -26.302 22.969 1.00 91.58 187 B 1 ATOM 2661 C CA . ASN B 2 187 ? 4.390 -25.946 23.148 1.00 89.20 187 B 1 ATOM 2662 C C . ASN B 2 187 ? 4.644 -24.706 24.044 1.00 90.31 187 B 1 ATOM 2663 O O . ASN B 2 187 ? 5.778 -24.231 24.146 1.00 84.76 187 B 1 ATOM 2664 C CB . ASN B 2 187 ? 5.021 -25.812 21.751 1.00 83.32 187 B 1 ATOM 2665 C CG . ASN B 2 187 ? 4.387 -24.712 20.906 1.00 80.97 187 B 1 ATOM 2666 O OD1 . ASN B 2 187 ? 3.979 -23.659 21.368 1.00 72.55 187 B 1 ATOM 2667 N ND2 . ASN B 2 187 ? 4.297 -24.939 19.612 1.00 76.22 187 B 1 ATOM 2668 N N . GLY B 2 188 ? 3.605 -24.155 24.669 1.00 90.16 188 B 1 ATOM 2669 C CA . GLY B 2 188 ? 3.685 -22.993 25.564 1.00 90.70 188 B 1 ATOM 2670 C C . GLY B 2 188 ? 3.697 -21.625 24.868 1.00 92.74 188 B 1 ATOM 2671 O O . GLY B 2 188 ? 3.627 -20.603 25.560 1.00 88.64 188 B 1 ATOM 2672 N N . ARG B 2 189 ? 3.751 -21.567 23.536 1.00 92.62 189 B 1 ATOM 2673 C CA . ARG B 2 189 ? 3.662 -20.310 22.770 1.00 92.63 189 B 1 ATOM 2674 C C . ARG B 2 189 ? 2.226 -19.814 22.626 1.00 94.01 189 B 1 ATOM 2675 O O . ARG B 2 189 ? 2.006 -18.607 22.557 1.00 91.88 189 B 1 ATOM 2676 C CB . ARG B 2 189 ? 4.304 -20.469 21.389 1.00 90.14 189 B 1 ATOM 2677 C CG . ARG B 2 189 ? 5.821 -20.709 21.492 1.00 84.45 189 B 1 ATOM 2678 C CD . ARG B 2 189 ? 6.463 -20.775 20.109 1.00 79.22 189 B 1 ATOM 2679 N NE . ARG B 2 189 ? 6.097 -22.006 19.390 1.00 72.96 189 B 1 ATOM 2680 C CZ . ARG B 2 189 ? 6.304 -22.233 18.105 1.00 68.45 189 B 1 ATOM 2681 N NH1 . ARG B 2 189 ? 6.858 -21.348 17.332 1.00 61.37 189 B 1 ATOM 2682 N NH2 . ARG B 2 189 ? 5.963 -23.364 17.568 1.00 60.76 189 B 1 ATOM 2683 N N . PHE B 2 190 ? 1.274 -20.737 22.614 1.00 94.90 190 B 1 ATOM 2684 C CA . PHE B 2 190 ? -0.139 -20.436 22.431 1.00 94.87 190 B 1 ATOM 2685 C C . PHE B 2 190 ? -0.891 -20.430 23.762 1.00 94.87 190 B 1 ATOM 2686 O O . PHE B 2 190 ? -0.574 -21.167 24.699 1.00 91.99 190 B 1 ATOM 2687 C CB . PHE B 2 190 ? -0.755 -21.420 21.430 1.00 94.20 190 B 1 ATOM 2688 C CG . PHE B 2 190 ? -0.068 -21.400 20.079 1.00 95.74 190 B 1 ATOM 2689 C CD1 . PHE B 2 190 ? -0.441 -20.458 19.105 1.00 94.58 190 B 1 ATOM 2690 C CD2 . PHE B 2 190 ? 0.980 -22.298 19.805 1.00 94.98 190 B 1 ATOM 2691 C CE1 . PHE B 2 190 ? 0.216 -20.417 17.866 1.00 94.50 190 B 1 ATOM 2692 C CE2 . PHE B 2 190 ? 1.644 -22.260 18.565 1.00 94.88 190 B 1 ATOM 2693 C CZ . PHE B 2 190 ? 1.259 -21.320 17.596 1.00 95.40 190 B 1 ATOM 2694 N N . LYS B 2 191 ? -1.917 -19.584 23.843 1.00 95.00 191 B 1 ATOM 2695 C CA . LYS B 2 191 ? -2.870 -19.539 24.948 1.00 94.63 191 B 1 ATOM 2696 C C . LYS B 2 191 ? -4.142 -20.284 24.559 1.00 94.76 191 B 1 ATOM 2697 O O . LYS B 2 191 ? -4.473 -20.406 23.383 1.00 91.33 191 B 1 ATOM 2698 C CB . LYS B 2 191 ? -3.146 -18.082 25.355 1.00 93.61 191 B 1 ATOM 2699 C CG . LYS B 2 191 ? -1.892 -17.288 25.774 1.00 90.02 191 B 1 ATOM 2700 C CD . LYS B 2 191 ? -1.170 -17.929 26.963 1.00 82.29 191 B 1 ATOM 2701 C CE . LYS B 2 191 ? 0.033 -17.075 27.369 1.00 75.65 191 B 1 ATOM 2702 N NZ . LYS B 2 191 ? 0.827 -17.737 28.437 1.00 65.41 191 B 1 ATOM 2703 N N . LYS B 2 192 ? -4.862 -20.774 25.573 1.00 95.04 192 B 1 ATOM 2704 C CA . LYS B 2 192 ? -6.156 -21.445 25.403 1.00 94.07 192 B 1 ATOM 2705 C C . LYS B 2 192 ? -7.262 -20.616 26.043 1.00 94.32 192 B 1 ATOM 2706 O O . LYS B 2 192 ? -6.997 -19.864 26.986 1.00 89.10 192 B 1 ATOM 2707 C CB . LYS B 2 192 ? -6.107 -22.874 25.980 1.00 90.44 192 B 1 ATOM 2708 C CG . LYS B 2 192 ? -5.148 -23.781 25.196 1.00 85.90 192 B 1 ATOM 2709 C CD . LYS B 2 192 ? -5.211 -25.235 25.679 1.00 79.30 192 B 1 ATOM 2710 C CE . LYS B 2 192 ? -4.277 -26.071 24.805 1.00 72.22 192 B 1 ATOM 2711 N NZ . LYS B 2 192 ? -4.259 -27.519 25.135 1.00 62.94 192 B 1 ATOM 2712 N N . ASN B 2 193 ? -8.491 -20.809 25.572 1.00 93.72 193 B 1 ATOM 2713 C CA . ASN B 2 193 ? -9.688 -20.168 26.118 1.00 93.63 193 B 1 ATOM 2714 C C . ASN B 2 193 ? -9.576 -18.630 26.169 1.00 93.98 193 B 1 ATOM 2715 O O . ASN B 2 193 ? -9.768 -18.003 27.213 1.00 89.59 193 B 1 ATOM 2716 C CB . ASN B 2 193 ? -10.024 -20.835 27.465 1.00 92.22 193 B 1 ATOM 2717 C CG . ASN B 2 193 ? -11.412 -20.461 27.950 1.00 90.47 193 B 1 ATOM 2718 O OD1 . ASN B 2 193 ? -12.370 -20.453 27.213 1.00 82.72 193 B 1 ATOM 2719 N ND2 . ASN B 2 193 ? -11.572 -20.174 29.223 1.00 82.88 193 B 1 ATOM 2720 N N . ILE B 2 194 ? -9.188 -18.036 25.047 1.00 94.52 194 B 1 ATOM 2721 C CA . ILE B 2 194 ? -8.978 -16.590 24.893 1.00 93.40 194 B 1 ATOM 2722 C C . ILE B 2 194 ? -9.990 -15.979 23.923 1.00 93.75 194 B 1 ATOM 2723 O O . ILE B 2 194 ? -10.581 -16.692 23.113 1.00 89.53 194 B 1 ATOM 2724 C CB . ILE B 2 194 ? -7.522 -16.274 24.497 1.00 90.49 194 B 1 ATOM 2725 C CG1 . ILE B 2 194 ? -7.030 -16.928 23.186 1.00 81.56 194 B 1 ATOM 2726 C CG2 . ILE B 2 194 ? -6.568 -16.670 25.651 1.00 78.18 194 B 1 ATOM 2727 C CD1 . ILE B 2 194 ? -7.470 -16.217 21.903 1.00 76.07 194 B 1 ATOM 2728 N N . ALA B 2 195 ? -10.146 -14.669 24.006 1.00 93.71 195 B 1 ATOM 2729 C CA . ALA B 2 195 ? -10.987 -13.884 23.103 1.00 92.84 195 B 1 ATOM 2730 C C . ALA B 2 195 ? -12.429 -14.431 22.991 1.00 93.91 195 B 1 ATOM 2731 O O . ALA B 2 195 ? -13.046 -14.796 23.995 1.00 89.10 195 B 1 ATOM 2732 C CB . ALA B 2 195 ? -10.235 -13.698 21.772 1.00 89.80 195 B 1 ATOM 2733 N N . SER B 2 196 ? -12.978 -14.436 21.785 1.00 93.35 196 B 1 ATOM 2734 C CA . SER B 2 196 ? -14.310 -14.946 21.455 1.00 93.99 196 B 1 ATOM 2735 C C . SER B 2 196 ? -14.301 -15.443 20.012 1.00 95.29 196 B 1 ATOM 2736 O O . SER B 2 196 ? -13.522 -14.957 19.195 1.00 92.15 196 B 1 ATOM 2737 C CB . SER B 2 196 ? -15.335 -13.815 21.623 1.00 91.42 196 B 1 ATOM 2738 O OG . SER B 2 196 ? -16.643 -14.236 21.294 1.00 87.57 196 B 1 ATOM 2739 N N . ASP B 2 197 ? -15.204 -16.360 19.688 1.00 96.03 197 B 1 ATOM 2740 C CA . ASP B 2 197 ? -15.499 -16.758 18.307 1.00 96.32 197 B 1 ATOM 2741 C C . ASP B 2 197 ? -16.394 -15.746 17.563 1.00 97.00 197 B 1 ATOM 2742 O O . ASP B 2 197 ? -16.757 -15.930 16.402 1.00 95.16 197 B 1 ATOM 2743 C CB . ASP B 2 197 ? -16.116 -18.166 18.320 1.00 94.59 197 B 1 ATOM 2744 C CG . ASP B 2 197 ? -17.502 -18.230 18.984 1.00 94.83 197 B 1 ATOM 2745 O OD1 . ASP B 2 197 ? -17.887 -17.260 19.687 1.00 89.69 197 B 1 ATOM 2746 O OD2 . ASP B 2 197 ? -18.196 -19.245 18.774 1.00 90.83 197 B 1 ATOM 2747 N N . VAL B 2 198 ? -16.740 -14.632 18.213 1.00 96.68 198 B 1 ATOM 2748 C CA . VAL B 2 198 ? -17.530 -13.544 17.636 1.00 96.50 198 B 1 ATOM 2749 C C . VAL B 2 198 ? -16.789 -12.215 17.745 1.00 96.80 198 B 1 ATOM 2750 O O . VAL B 2 198 ? -16.402 -11.770 18.824 1.00 95.54 198 B 1 ATOM 2751 C CB . VAL B 2 198 ? -18.932 -13.464 18.273 1.00 95.04 198 B 1 ATOM 2752 C CG1 . VAL B 2 198 ? -19.757 -12.308 17.690 1.00 90.36 198 B 1 ATOM 2753 C CG2 . VAL B 2 198 ? -19.730 -14.752 18.035 1.00 90.99 198 B 1 ATOM 2754 N N . ILE B 2 199 ? -16.688 -11.519 16.628 1.00 97.15 199 B 1 ATOM 2755 C CA . ILE B 2 199 ? -16.342 -10.096 16.571 1.00 97.17 199 B 1 ATOM 2756 C C . ILE B 2 199 ? -17.613 -9.319 16.228 1.00 96.99 199 B 1 ATOM 2757 O O . ILE B 2 199 ? -18.274 -9.601 15.228 1.00 96.16 199 B 1 ATOM 2758 C CB . ILE B 2 199 ? -15.199 -9.830 15.568 1.00 97.15 199 B 1 ATOM 2759 C CG1 . ILE B 2 199 ? -13.905 -10.567 15.995 1.00 95.99 199 B 1 ATOM 2760 C CG2 . ILE B 2 199 ? -14.948 -8.318 15.440 1.00 95.74 199 B 1 ATOM 2761 C CD1 . ILE B 2 199 ? -12.785 -10.528 14.943 1.00 94.84 199 B 1 ATOM 2762 N N . PHE B 2 200 ? -17.961 -8.329 17.042 1.00 96.38 200 B 1 ATOM 2763 C CA . PHE B 2 200 ? -19.113 -7.465 16.793 1.00 95.96 200 B 1 ATOM 2764 C C . PHE B 2 200 ? -18.673 -6.011 16.630 1.00 95.95 200 B 1 ATOM 2765 O O . PHE B 2 200 ? -18.626 -5.245 17.592 1.00 94.07 200 B 1 ATOM 2766 C CB . PHE B 2 200 ? -20.169 -7.653 17.892 1.00 94.68 200 B 1 ATOM 2767 C CG . PHE B 2 200 ? -21.444 -6.847 17.663 1.00 94.09 200 B 1 ATOM 2768 C CD1 . PHE B 2 200 ? -21.952 -6.009 18.677 1.00 89.40 200 B 1 ATOM 2769 C CD2 . PHE B 2 200 ? -22.135 -6.937 16.442 1.00 90.21 200 B 1 ATOM 2770 C CE1 . PHE B 2 200 ? -23.143 -5.286 18.480 1.00 89.33 200 B 1 ATOM 2771 C CE2 . PHE B 2 200 ? -23.321 -6.209 16.232 1.00 88.63 200 B 1 ATOM 2772 C CZ . PHE B 2 200 ? -23.828 -5.389 17.254 1.00 90.00 200 B 1 ATOM 2773 N N . SER B 2 201 ? -18.364 -5.622 15.395 1.00 96.45 201 B 1 ATOM 2774 C CA . SER B 2 201 ? -17.868 -4.277 15.104 1.00 96.30 201 B 1 ATOM 2775 C C . SER B 2 201 ? -18.344 -3.725 13.759 1.00 96.33 201 B 1 ATOM 2776 O O . SER B 2 201 ? -18.951 -4.416 12.926 1.00 95.63 201 B 1 ATOM 2777 C CB . SER B 2 201 ? -16.345 -4.227 15.242 1.00 95.23 201 B 1 ATOM 2778 O OG . SER B 2 201 ? -15.682 -4.928 14.219 1.00 92.41 201 B 1 ATOM 2779 N N . GLU B 2 202 ? -18.132 -2.429 13.575 1.00 96.11 202 B 1 ATOM 2780 C CA . GLU B 2 202 ? -18.566 -1.714 12.384 1.00 95.61 202 B 1 ATOM 2781 C C . GLU B 2 202 ? -17.699 -2.045 11.168 1.00 95.58 202 B 1 ATOM 2782 O O . GLU B 2 202 ? -16.503 -2.310 11.262 1.00 94.22 202 B 1 ATOM 2783 C CB . GLU B 2 202 ? -18.609 -0.201 12.635 1.00 94.61 202 B 1 ATOM 2784 C CG . GLU B 2 202 ? -19.680 0.159 13.669 1.00 89.17 202 B 1 ATOM 2785 C CD . GLU B 2 202 ? -19.873 1.667 13.871 1.00 87.10 202 B 1 ATOM 2786 O OE1 . GLU B 2 202 ? -20.502 2.019 14.897 1.00 79.66 202 B 1 ATOM 2787 O OE2 . GLU B 2 202 ? -19.467 2.453 12.988 1.00 81.26 202 B 1 ATOM 2788 N N . ARG B 2 203 ? -18.315 -1.976 9.978 1.00 95.09 203 B 1 ATOM 2789 C CA . ARG B 2 203 ? -17.548 -1.995 8.737 1.00 93.72 203 B 1 ATOM 2790 C C . ARG B 2 203 ? -16.778 -0.692 8.595 1.00 93.73 203 B 1 ATOM 2791 O O . ARG B 2 203 ? -17.332 0.383 8.781 1.00 91.42 203 B 1 ATOM 2792 C CB . ARG B 2 203 ? -18.460 -2.220 7.522 1.00 91.22 203 B 1 ATOM 2793 C CG . ARG B 2 203 ? -19.040 -3.639 7.502 1.00 82.36 203 B 1 ATOM 2794 C CD . ARG B 2 203 ? -19.814 -3.905 6.211 1.00 79.23 203 B 1 ATOM 2795 N NE . ARG B 2 203 ? -21.037 -3.097 6.128 1.00 70.61 203 B 1 ATOM 2796 C CZ . ARG B 2 203 ? -21.927 -3.135 5.145 1.00 64.30 203 B 1 ATOM 2797 N NH1 . ARG B 2 203 ? -21.770 -3.915 4.110 1.00 59.12 203 B 1 ATOM 2798 N NH2 . ARG B 2 203 ? -22.997 -2.392 5.205 1.00 57.06 203 B 1 ATOM 2799 N N . ARG B 2 204 ? -15.529 -0.820 8.166 1.00 93.73 204 B 1 ATOM 2800 C CA . ARG B 2 204 ? -14.658 0.300 7.780 1.00 91.88 204 B 1 ATOM 2801 C C . ARG B 2 204 ? -14.610 0.401 6.249 1.00 90.99 204 B 1 ATOM 2802 O O . ARG B 2 204 ? -15.670 0.510 5.601 1.00 85.25 204 B 1 ATOM 2803 C CB . ARG B 2 204 ? -13.300 0.139 8.500 1.00 89.23 204 B 1 ATOM 2804 C CG . ARG B 2 204 ? -13.429 0.173 10.040 1.00 86.41 204 B 1 ATOM 2805 C CD . ARG B 2 204 ? -12.065 0.058 10.737 1.00 84.21 204 B 1 ATOM 2806 N NE . ARG B 2 204 ? -11.463 -1.289 10.590 1.00 81.79 204 B 1 ATOM 2807 C CZ . ARG B 2 204 ? -10.199 -1.619 10.810 1.00 81.28 204 B 1 ATOM 2808 N NH1 . ARG B 2 204 ? -9.310 -0.749 11.190 1.00 70.52 204 B 1 ATOM 2809 N NH2 . ARG B 2 204 ? -9.802 -2.852 10.666 1.00 74.48 204 B 1 ATOM 2810 N N . GLY B 2 205 ? -13.425 0.345 5.657 1.00 91.97 205 B 1 ATOM 2811 C CA . GLY B 2 205 ? -13.256 0.372 4.203 1.00 91.23 205 B 1 ATOM 2812 C C . GLY B 2 205 ? -13.882 -0.825 3.470 1.00 92.86 205 B 1 ATOM 2813 O O . GLY B 2 205 ? -14.292 -1.822 4.070 1.00 90.73 205 B 1 ATOM 2814 N N . GLN B 2 206 ? -13.937 -0.737 2.147 1.00 89.59 206 B 1 ATOM 2815 C CA . GLN B 2 206 ? -14.392 -1.843 1.303 1.00 89.49 206 B 1 ATOM 2816 C C . GLN B 2 206 ? -13.514 -3.082 1.525 1.00 90.67 206 B 1 ATOM 2817 O O . GLN B 2 206 ? -12.290 -2.985 1.466 1.00 87.60 206 B 1 ATOM 2818 C CB . GLN B 2 206 ? -14.374 -1.399 -0.167 1.00 86.32 206 B 1 ATOM 2819 C CG . GLN B 2 206 ? -14.893 -2.477 -1.147 1.00 77.64 206 B 1 ATOM 2820 C CD . GLN B 2 206 ? -16.371 -2.842 -0.944 1.00 70.19 206 B 1 ATOM 2821 O OE1 . GLN B 2 206 ? -17.131 -2.157 -0.279 1.00 65.03 206 B 1 ATOM 2822 N NE2 . GLN B 2 206 ? -16.818 -3.937 -1.512 1.00 61.50 206 B 1 ATOM 2823 N N . SER B 2 207 ? -14.149 -4.228 1.777 1.00 91.52 207 B 1 ATOM 2824 C CA . SER B 2 207 ? -13.479 -5.506 2.073 1.00 92.32 207 B 1 ATOM 2825 C C . SER B 2 207 ? -12.527 -5.487 3.278 1.00 94.01 207 B 1 ATOM 2826 O O . SER B 2 207 ? -11.886 -6.496 3.558 1.00 92.29 207 B 1 ATOM 2827 C CB . SER B 2 207 ? -12.804 -6.085 0.818 1.00 89.62 207 B 1 ATOM 2828 O OG . SER B 2 207 ? -13.758 -6.198 -0.223 1.00 80.31 207 B 1 ATOM 2829 N N . GLN B 2 208 ? -12.454 -4.390 4.030 1.00 94.28 208 B 1 ATOM 2830 C CA . GLN B 2 208 ? -11.577 -4.273 5.194 1.00 95.23 208 B 1 ATOM 2831 C C . GLN B 2 208 ? -12.099 -5.126 6.348 1.00 96.12 208 B 1 ATOM 2832 O O . GLN B 2 208 ? -13.230 -4.935 6.807 1.00 95.44 208 B 1 ATOM 2833 C CB . GLN B 2 208 ? -11.436 -2.799 5.587 1.00 94.35 208 B 1 ATOM 2834 C CG . GLN B 2 208 ? -10.359 -2.584 6.658 1.00 91.35 208 B 1 ATOM 2835 C CD . GLN B 2 208 ? -10.141 -1.109 6.989 1.00 89.52 208 B 1 ATOM 2836 O OE1 . GLN B 2 208 ? -10.908 -0.229 6.630 1.00 83.44 208 B 1 ATOM 2837 N NE2 . GLN B 2 208 ? -9.084 -0.782 7.701 1.00 80.90 208 B 1 ATOM 2838 N N . LYS B 2 209 ? -11.259 -6.045 6.829 1.00 96.37 209 B 1 ATOM 2839 C CA . LYS B 2 209 ? -11.549 -6.894 7.988 1.00 96.55 209 B 1 ATOM 2840 C C . LYS B 2 209 ? -11.433 -6.101 9.294 1.00 96.55 209 B 1 ATOM 2841 O O . LYS B 2 209 ? -10.824 -5.019 9.304 1.00 95.48 209 B 1 ATOM 2842 C CB . LYS B 2 209 ? -10.664 -8.148 7.936 1.00 95.46 209 B 1 ATOM 2843 C CG . LYS B 2 209 ? -10.917 -9.021 6.683 1.00 93.70 209 B 1 ATOM 2844 C CD . LYS B 2 209 ? -12.375 -9.505 6.560 1.00 90.43 209 B 1 ATOM 2845 C CE . LYS B 2 209 ? -12.572 -10.450 5.372 1.00 88.82 209 B 1 ATOM 2846 N NZ . LYS B 2 209 ? -12.570 -9.741 4.071 1.00 83.77 209 B 1 ATOM 2847 N N . PRO B 2 210 ? -12.089 -6.566 10.368 1.00 97.57 210 B 1 ATOM 2848 C CA . PRO B 2 210 ? -12.103 -5.854 11.641 1.00 97.58 210 B 1 ATOM 2849 C C . PRO B 2 210 ? -10.718 -5.870 12.302 1.00 97.70 210 B 1 ATOM 2850 O O . PRO B 2 210 ? -9.971 -6.830 12.153 1.00 96.86 210 B 1 ATOM 2851 C CB . PRO B 2 210 ? -13.170 -6.559 12.477 1.00 96.83 210 B 1 ATOM 2852 C CG . PRO B 2 210 ? -13.121 -7.996 11.966 1.00 95.45 210 B 1 ATOM 2853 C CD . PRO B 2 210 ? -12.836 -7.812 10.479 1.00 97.00 210 B 1 ATOM 2854 N N . GLU B 2 211 ? -10.406 -4.815 13.048 1.00 97.40 211 B 1 ATOM 2855 C CA . GLU B 2 211 ? -9.129 -4.669 13.761 1.00 97.12 211 B 1 ATOM 2856 C C . GLU B 2 211 ? -8.953 -5.722 14.866 1.00 97.50 211 B 1 ATOM 2857 O O . GLU B 2 211 ? -7.852 -6.168 15.160 1.00 96.59 211 B 1 ATOM 2858 C CB . GLU B 2 211 ? -9.098 -3.253 14.368 1.00 95.87 211 B 1 ATOM 2859 C CG . GLU B 2 211 ? -7.724 -2.869 14.937 1.00 89.44 211 B 1 ATOM 2860 C CD . GLU B 2 211 ? -6.643 -2.868 13.842 1.00 90.00 211 B 1 ATOM 2861 O OE1 . GLU B 2 211 ? -5.482 -3.139 14.185 1.00 81.75 211 B 1 ATOM 2862 O OE2 . GLU B 2 211 ? -6.987 -2.597 12.657 1.00 83.60 211 B 1 ATOM 2863 N N . GLU B 2 212 ? -10.067 -6.151 15.454 1.00 96.91 212 B 1 ATOM 2864 C CA . GLU B 2 212 ? -10.125 -7.096 16.563 1.00 96.86 212 B 1 ATOM 2865 C C . GLU B 2 212 ? -9.458 -8.433 16.214 1.00 97.31 212 B 1 ATOM 2866 O O . GLU B 2 212 ? -8.937 -9.094 17.106 1.00 96.51 212 B 1 ATOM 2867 C CB . GLU B 2 212 ? -11.594 -7.310 16.969 1.00 96.36 212 B 1 ATOM 2868 C CG . GLU B 2 212 ? -12.311 -6.050 17.507 1.00 93.37 212 B 1 ATOM 2869 C CD . GLU B 2 212 ? -13.014 -5.192 16.434 1.00 93.48 212 B 1 ATOM 2870 O OE1 . GLU B 2 212 ? -14.009 -4.526 16.773 1.00 85.09 212 B 1 ATOM 2871 O OE2 . GLU B 2 212 ? -12.619 -5.193 15.246 1.00 87.58 212 B 1 ATOM 2872 N N . ILE B 2 213 ? -9.391 -8.808 14.933 1.00 97.64 213 B 1 ATOM 2873 C CA . ILE B 2 213 ? -8.758 -10.068 14.529 1.00 97.88 213 B 1 ATOM 2874 C C . ILE B 2 213 ? -7.268 -10.098 14.895 1.00 97.97 213 B 1 ATOM 2875 O O . ILE B 2 213 ? -6.780 -11.115 15.386 1.00 97.65 213 B 1 ATOM 2876 C CB . ILE B 2 213 ? -8.998 -10.359 13.031 1.00 97.57 213 B 1 ATOM 2877 C CG1 . ILE B 2 213 ? -8.716 -11.829 12.652 1.00 95.65 213 B 1 ATOM 2878 C CG2 . ILE B 2 213 ? -8.179 -9.443 12.106 1.00 96.52 213 B 1 ATOM 2879 C CD1 . ILE B 2 213 ? -9.645 -12.827 13.343 1.00 94.13 213 B 1 ATOM 2880 N N . TYR B 2 214 ? -6.564 -8.972 14.747 1.00 98.08 214 B 1 ATOM 2881 C CA . TYR B 2 214 ? -5.155 -8.860 15.120 1.00 98.00 214 B 1 ATOM 2882 C C . TYR B 2 214 ? -4.980 -8.950 16.636 1.00 97.75 214 B 1 ATOM 2883 O O . TYR B 2 214 ? -4.060 -9.599 17.131 1.00 96.93 214 B 1 ATOM 2884 C CB . TYR B 2 214 ? -4.582 -7.538 14.595 1.00 97.90 214 B 1 ATOM 2885 C CG . TYR B 2 214 ? -4.681 -7.382 13.092 1.00 98.19 214 B 1 ATOM 2886 C CD1 . TYR B 2 214 ? -3.787 -8.056 12.239 1.00 97.33 214 B 1 ATOM 2887 C CD2 . TYR B 2 214 ? -5.695 -6.576 12.536 1.00 97.36 214 B 1 ATOM 2888 C CE1 . TYR B 2 214 ? -3.900 -7.936 10.844 1.00 97.06 214 B 1 ATOM 2889 C CE2 . TYR B 2 214 ? -5.820 -6.451 11.139 1.00 97.07 214 B 1 ATOM 2890 C CZ . TYR B 2 214 ? -4.922 -7.138 10.297 1.00 97.69 214 B 1 ATOM 2891 O OH . TYR B 2 214 ? -5.066 -7.030 8.941 1.00 96.85 214 B 1 ATOM 2892 N N . GLN B 2 215 ? -5.906 -8.356 17.401 1.00 97.57 215 B 1 ATOM 2893 C CA . GLN B 2 215 ? -5.908 -8.430 18.862 1.00 96.98 215 B 1 ATOM 2894 C C . GLN B 2 215 ? -6.145 -9.865 19.344 1.00 97.14 215 B 1 ATOM 2895 O O . GLN B 2 215 ? -5.484 -10.317 20.279 1.00 96.26 215 B 1 ATOM 2896 C CB . GLN B 2 215 ? -6.984 -7.505 19.443 1.00 96.16 215 B 1 ATOM 2897 C CG . GLN B 2 215 ? -6.773 -6.030 19.069 1.00 90.69 215 B 1 ATOM 2898 C CD . GLN B 2 215 ? -7.900 -5.129 19.579 1.00 85.24 215 B 1 ATOM 2899 O OE1 . GLN B 2 215 ? -8.823 -5.550 20.262 1.00 77.56 215 B 1 ATOM 2900 N NE2 . GLN B 2 215 ? -7.866 -3.856 19.262 1.00 74.14 215 B 1 ATOM 2901 N N . TYR B 2 216 ? -7.054 -10.595 18.701 1.00 97.29 216 B 1 ATOM 2902 C CA . TYR B 2 216 ? -7.336 -11.993 19.028 1.00 97.22 216 B 1 ATOM 2903 C C . TYR B 2 216 ? -6.129 -12.888 18.734 1.00 97.25 216 B 1 ATOM 2904 O O . TYR B 2 216 ? -5.754 -13.706 19.574 1.00 96.47 216 B 1 ATOM 2905 C CB . TYR B 2 216 ? -8.578 -12.468 18.259 1.00 96.75 216 B 1 ATOM 2906 C CG . TYR B 2 216 ? -9.922 -11.940 18.729 1.00 95.02 216 B 1 ATOM 2907 C CD1 . TYR B 2 216 ? -10.052 -10.844 19.613 1.00 90.67 216 B 1 ATOM 2908 C CD2 . TYR B 2 216 ? -11.094 -12.582 18.266 1.00 91.09 216 B 1 ATOM 2909 C CE1 . TYR B 2 216 ? -11.317 -10.399 20.043 1.00 89.54 216 B 1 ATOM 2910 C CE2 . TYR B 2 216 ? -12.365 -12.148 18.688 1.00 89.80 216 B 1 ATOM 2911 C CZ . TYR B 2 216 ? -12.473 -11.058 19.581 1.00 89.15 216 B 1 ATOM 2912 O OH . TYR B 2 216 ? -13.711 -10.655 20.010 1.00 85.07 216 B 1 ATOM 2913 N N . ILE B 2 217 ? -5.466 -12.686 17.595 1.00 97.53 217 B 1 ATOM 2914 C CA . ILE B 2 217 ? -4.246 -13.417 17.243 1.00 97.51 217 B 1 ATOM 2915 C C . ILE B 2 217 ? -3.109 -13.098 18.225 1.00 97.22 217 B 1 ATOM 2916 O O . ILE B 2 217 ? -2.431 -14.012 18.692 1.00 96.49 217 B 1 ATOM 2917 C CB . ILE B 2 217 ? -3.878 -13.143 15.770 1.00 97.63 217 B 1 ATOM 2918 C CG1 . ILE B 2 217 ? -4.908 -13.857 14.858 1.00 96.97 217 B 1 ATOM 2919 C CG2 . ILE B 2 217 ? -2.452 -13.621 15.450 1.00 97.14 217 B 1 ATOM 2920 C CD1 . ILE B 2 217 ? -4.873 -13.402 13.394 1.00 95.77 217 B 1 ATOM 2921 N N . ASN B 2 218 ? -2.945 -11.837 18.626 1.00 97.41 218 B 1 ATOM 2922 C CA . ASN B 2 218 ? -1.967 -11.450 19.647 1.00 96.77 218 B 1 ATOM 2923 C C . ASN B 2 218 ? -2.255 -12.096 21.014 1.00 96.80 218 B 1 ATOM 2924 O O . ASN B 2 218 ? -1.327 -12.452 21.740 1.00 95.98 218 B 1 ATOM 2925 C CB . ASN B 2 218 ? -1.945 -9.915 19.775 1.00 95.60 218 B 1 ATOM 2926 C CG . ASN B 2 218 ? -1.309 -9.205 18.590 1.00 86.83 218 B 1 ATOM 2927 O OD1 . ASN B 2 218 ? -0.617 -9.770 17.767 1.00 75.87 218 B 1 ATOM 2928 N ND2 . ASN B 2 218 ? -1.500 -7.907 18.488 1.00 74.11 218 B 1 ATOM 2929 N N . GLN B 2 219 ? -3.526 -12.273 21.385 1.00 97.09 219 B 1 ATOM 2930 C CA . GLN B 2 219 ? -3.915 -12.987 22.608 1.00 96.86 219 B 1 ATOM 2931 C C . GLN B 2 219 ? -3.680 -14.497 22.491 1.00 96.95 219 B 1 ATOM 2932 O O . GLN B 2 219 ? -3.251 -15.120 23.464 1.00 95.89 219 B 1 ATOM 2933 C CB . GLN B 2 219 ? -5.390 -12.717 22.935 1.00 96.45 219 B 1 ATOM 2934 C CG . GLN B 2 219 ? -5.643 -11.290 23.440 1.00 92.49 219 B 1 ATOM 2935 C CD . GLN B 2 219 ? -7.140 -11.024 23.617 1.00 89.49 219 B 1 ATOM 2936 O OE1 . GLN B 2 219 ? -7.893 -11.837 24.140 1.00 80.79 219 B 1 ATOM 2937 N NE2 . GLN B 2 219 ? -7.631 -9.880 23.199 1.00 77.61 219 B 1 ATOM 2938 N N . LEU B 2 220 ? -3.932 -15.071 21.314 1.00 96.96 220 B 1 ATOM 2939 C CA . LEU B 2 220 ? -3.724 -16.494 21.035 1.00 96.83 220 B 1 ATOM 2940 C C . LEU B 2 220 ? -2.238 -16.864 21.068 1.00 96.89 220 B 1 ATOM 2941 O O . LEU B 2 220 ? -1.867 -17.885 21.646 1.00 96.02 220 B 1 ATOM 2942 C CB . LEU B 2 220 ? -4.360 -16.819 19.671 1.00 96.74 220 B 1 ATOM 2943 C CG . LEU B 2 220 ? -4.208 -18.290 19.226 1.00 96.31 220 B 1 ATOM 2944 C CD1 . LEU B 2 220 ? -4.945 -19.252 20.156 1.00 94.64 220 B 1 ATOM 2945 C CD2 . LEU B 2 220 ? -4.766 -18.453 17.812 1.00 94.44 220 B 1 ATOM 2946 N N . CYS B 2 221 ? -1.386 -16.038 20.473 1.00 96.91 221 B 1 ATOM 2947 C CA . CYS B 2 221 ? 0.055 -16.257 20.411 1.00 96.74 221 B 1 ATOM 2948 C C . CYS B 2 221 ? 0.827 -14.964 20.725 1.00 96.72 221 B 1 ATOM 2949 O O . CYS B 2 221 ? 1.292 -14.280 19.808 1.00 95.75 221 B 1 ATOM 2950 C CB . CYS B 2 221 ? 0.396 -16.848 19.037 1.00 96.30 221 B 1 ATOM 2951 S SG . CYS B 2 221 ? 2.129 -17.398 19.020 1.00 94.69 221 B 1 ATOM 2952 N N . PRO B 2 222 ? 0.991 -14.607 22.013 1.00 96.38 222 B 1 ATOM 2953 C CA . PRO B 2 222 ? 1.747 -13.418 22.388 1.00 95.31 222 B 1 ATOM 2954 C C . PRO B 2 222 ? 3.198 -13.492 21.897 1.00 94.33 222 B 1 ATOM 2955 O O . PRO B 2 222 ? 3.859 -14.518 22.064 1.00 90.46 222 B 1 ATOM 2956 C CB . PRO B 2 222 ? 1.669 -13.342 23.917 1.00 94.05 222 B 1 ATOM 2957 C CG . PRO B 2 222 ? 0.423 -14.158 24.260 1.00 92.97 222 B 1 ATOM 2958 C CD . PRO B 2 222 ? 0.421 -15.242 23.192 1.00 95.67 222 B 1 ATOM 2959 N N . ASN B 2 223 ? 3.701 -12.391 21.333 1.00 95.27 223 B 1 ATOM 2960 C CA . ASN B 2 223 ? 5.055 -12.304 20.768 1.00 94.95 223 B 1 ATOM 2961 C C . ASN B 2 223 ? 5.343 -13.364 19.684 1.00 95.56 223 B 1 ATOM 2962 O O . ASN B 2 223 ? 6.490 -13.784 19.504 1.00 92.96 223 B 1 ATOM 2963 C CB . ASN B 2 223 ? 6.107 -12.306 21.892 1.00 92.87 223 B 1 ATOM 2964 C CG . ASN B 2 223 ? 5.850 -11.252 22.957 1.00 89.08 223 B 1 ATOM 2965 O OD1 . ASN B 2 223 ? 5.499 -10.119 22.691 1.00 78.79 223 B 1 ATOM 2966 N ND2 . ASN B 2 223 ? 6.017 -11.605 24.216 1.00 76.92 223 B 1 ATOM 2967 N N . GLY B 2 224 ? 4.304 -13.821 18.985 1.00 95.43 224 B 1 ATOM 2968 C CA . GLY B 2 224 ? 4.428 -14.767 17.888 1.00 95.98 224 B 1 ATOM 2969 C C . GLY B 2 224 ? 4.991 -14.152 16.611 1.00 96.80 224 B 1 ATOM 2970 O O . GLY B 2 224 ? 5.101 -12.932 16.460 1.00 95.72 224 B 1 ATOM 2971 N N . ASN B 2 225 ? 5.320 -15.028 15.675 1.00 96.76 225 B 1 ATOM 2972 C CA . ASN B 2 225 ? 5.601 -14.648 14.294 1.00 97.44 225 B 1 ATOM 2973 C C . ASN B 2 225 ? 4.325 -14.799 13.462 1.00 97.97 225 B 1 ATOM 2974 O O . ASN B 2 225 ? 3.783 -15.902 13.357 1.00 97.26 225 B 1 ATOM 2975 C CB . ASN B 2 225 ? 6.746 -15.506 13.745 1.00 96.91 225 B 1 ATOM 2976 C CG . ASN B 2 225 ? 8.077 -15.139 14.372 1.00 96.27 225 B 1 ATOM 2977 O OD1 . ASN B 2 225 ? 8.587 -15.805 15.245 1.00 86.62 225 B 1 ATOM 2978 N ND2 . ASN B 2 225 ? 8.691 -14.061 13.923 1.00 86.41 225 B 1 ATOM 2979 N N . TYR B 2 226 ? 3.867 -13.703 12.875 1.00 98.09 226 B 1 ATOM 2980 C CA . TYR B 2 226 ? 2.598 -13.654 12.150 1.00 98.32 226 B 1 ATOM 2981 C C . TYR B 2 226 ? 2.832 -13.374 10.664 1.00 98.49 226 B 1 ATOM 2982 O O . TYR B 2 226 ? 3.642 -12.520 10.300 1.00 97.95 226 B 1 ATOM 2983 C CB . TYR B 2 226 ? 1.676 -12.600 12.773 1.00 97.97 226 B 1 ATOM 2984 C CG . TYR B 2 226 ? 1.651 -12.548 14.286 1.00 97.93 226 B 1 ATOM 2985 C CD1 . TYR B 2 226 ? 1.219 -13.654 15.046 1.00 96.12 226 B 1 ATOM 2986 C CD2 . TYR B 2 226 ? 2.069 -11.376 14.948 1.00 96.05 226 B 1 ATOM 2987 C CE1 . TYR B 2 226 ? 1.199 -13.593 16.454 1.00 95.16 226 B 1 ATOM 2988 C CE2 . TYR B 2 226 ? 2.049 -11.303 16.352 1.00 95.27 226 B 1 ATOM 2989 C CZ . TYR B 2 226 ? 1.614 -12.413 17.102 1.00 95.99 226 B 1 ATOM 2990 O OH . TYR B 2 226 ? 1.601 -12.334 18.469 1.00 94.46 226 B 1 ATOM 2991 N N . LEU B 2 227 ? 2.093 -14.063 9.813 1.00 98.56 227 B 1 ATOM 2992 C CA . LEU B 2 227 ? 2.088 -13.847 8.368 1.00 98.71 227 B 1 ATOM 2993 C C . LEU B 2 227 ? 0.666 -13.545 7.898 1.00 98.80 227 B 1 ATOM 2994 O O . LEU B 2 227 ? -0.238 -14.350 8.109 1.00 98.61 227 B 1 ATOM 2995 C CB . LEU B 2 227 ? 2.669 -15.095 7.682 1.00 98.53 227 B 1 ATOM 2996 C CG . LEU B 2 227 ? 2.603 -15.075 6.140 1.00 98.13 227 B 1 ATOM 2997 C CD1 . LEU B 2 227 ? 3.489 -13.992 5.532 1.00 97.03 227 B 1 ATOM 2998 C CD2 . LEU B 2 227 ? 3.073 -16.421 5.589 1.00 96.82 227 B 1 ATOM 2999 N N . GLU B 2 228 ? 0.482 -12.445 7.192 1.00 98.76 228 B 1 ATOM 3000 C CA . GLU B 2 228 ? -0.758 -12.147 6.484 1.00 98.76 228 B 1 ATOM 3001 C C . GLU B 2 228 ? -0.537 -12.217 4.973 1.00 98.76 228 B 1 ATOM 3002 O O . GLU B 2 228 ? 0.370 -11.594 4.421 1.00 98.38 228 B 1 ATOM 3003 C CB . GLU B 2 228 ? -1.332 -10.794 6.936 1.00 98.51 228 B 1 ATOM 3004 C CG . GLU B 2 228 ? -2.702 -10.523 6.286 1.00 97.80 228 B 1 ATOM 3005 C CD . GLU B 2 228 ? -3.430 -9.296 6.849 1.00 97.75 228 B 1 ATOM 3006 O OE1 . GLU B 2 228 ? -4.599 -9.077 6.447 1.00 94.39 228 B 1 ATOM 3007 O OE2 . GLU B 2 228 ? -2.858 -8.557 7.680 1.00 95.58 228 B 1 ATOM 3008 N N . ILE B 2 229 ? -1.391 -12.952 4.285 1.00 98.68 229 B 1 ATOM 3009 C CA . ILE B 2 229 ? -1.395 -13.062 2.827 1.00 98.64 229 B 1 ATOM 3010 C C . ILE B 2 229 ? -2.635 -12.353 2.278 1.00 98.60 229 B 1 ATOM 3011 O O . ILE B 2 229 ? -3.725 -12.470 2.831 1.00 98.14 229 B 1 ATOM 3012 C CB . ILE B 2 229 ? -1.284 -14.536 2.371 1.00 98.45 229 B 1 ATOM 3013 C CG1 . ILE B 2 229 ? -0.112 -15.254 3.084 1.00 97.66 229 B 1 ATOM 3014 C CG2 . ILE B 2 229 ? -1.105 -14.588 0.841 1.00 97.78 229 B 1 ATOM 3015 C CD1 . ILE B 2 229 ? 0.061 -16.728 2.700 1.00 95.96 229 B 1 ATOM 3016 N N . PHE B 2 230 ? -2.464 -11.627 1.172 1.00 98.43 230 B 1 ATOM 3017 C CA . PHE B 2 230 ? -3.468 -10.737 0.581 1.00 98.27 230 B 1 ATOM 3018 C C . PHE B 2 230 ? -3.746 -9.478 1.413 1.00 97.92 230 B 1 ATOM 3019 O O . PHE B 2 230 ? -4.860 -8.941 1.428 1.00 96.91 230 B 1 ATOM 3020 C CB . PHE B 2 230 ? -4.733 -11.518 0.191 1.00 98.09 230 B 1 ATOM 3021 C CG . PHE B 2 230 ? -4.463 -12.775 -0.606 1.00 98.22 230 B 1 ATOM 3022 C CD1 . PHE B 2 230 ? -3.920 -12.680 -1.900 1.00 97.74 230 B 1 ATOM 3023 C CD2 . PHE B 2 230 ? -4.739 -14.042 -0.060 1.00 97.77 230 B 1 ATOM 3024 C CE1 . PHE B 2 230 ? -3.671 -13.836 -2.651 1.00 97.48 230 B 1 ATOM 3025 C CE2 . PHE B 2 230 ? -4.495 -15.208 -0.814 1.00 97.38 230 B 1 ATOM 3026 C CZ . PHE B 2 230 ? -3.962 -15.101 -2.109 1.00 97.55 230 B 1 ATOM 3027 N N . ALA B 2 231 ? -2.707 -8.986 2.067 1.00 98.13 231 B 1 ATOM 3028 C CA . ALA B 2 231 ? -2.754 -7.743 2.814 1.00 97.90 231 B 1 ATOM 3029 C C . ALA B 2 231 ? -2.822 -6.514 1.892 1.00 97.33 231 B 1 ATOM 3030 O O . ALA B 2 231 ? -2.285 -6.480 0.780 1.00 95.84 231 B 1 ATOM 3031 C CB . ALA B 2 231 ? -1.536 -7.675 3.737 1.00 97.60 231 B 1 ATOM 3032 N N . ARG B 2 232 ? -3.435 -5.462 2.420 1.00 97.13 232 B 1 ATOM 3033 C CA . ARG B 2 232 ? -3.364 -4.090 1.913 1.00 96.71 232 B 1 ATOM 3034 C C . ARG B 2 232 ? -2.652 -3.208 2.939 1.00 96.98 232 B 1 ATOM 3035 O O . ARG B 2 232 ? -2.407 -3.635 4.062 1.00 96.23 232 B 1 ATOM 3036 C CB . ARG B 2 232 ? -4.776 -3.581 1.614 1.00 95.13 232 B 1 ATOM 3037 C CG . ARG B 2 232 ? -5.494 -4.426 0.545 1.00 92.57 232 B 1 ATOM 3038 C CD . ARG B 2 232 ? -6.868 -3.838 0.216 1.00 90.10 232 B 1 ATOM 3039 N NE . ARG B 2 232 ? -7.728 -3.795 1.404 1.00 85.83 232 B 1 ATOM 3040 C CZ . ARG B 2 232 ? -9.010 -3.469 1.447 1.00 85.38 232 B 1 ATOM 3041 N NH1 . ARG B 2 232 ? -9.677 -3.150 0.374 1.00 77.27 232 B 1 ATOM 3042 N NH2 . ARG B 2 232 ? -9.635 -3.466 2.585 1.00 78.45 232 B 1 ATOM 3043 N N . ARG B 2 233 ? -2.395 -1.958 2.592 1.00 96.63 233 B 1 ATOM 3044 C CA . ARG B 2 233 ? -1.721 -1.007 3.504 1.00 96.36 233 B 1 ATOM 3045 C C . ARG B 2 233 ? -2.399 -0.867 4.877 1.00 96.69 233 B 1 ATOM 3046 O O . ARG B 2 233 ? -1.719 -0.678 5.871 1.00 95.18 233 B 1 ATOM 3047 C CB . ARG B 2 233 ? -1.617 0.371 2.845 1.00 95.19 233 B 1 ATOM 3048 C CG . ARG B 2 233 ? -0.642 0.365 1.661 1.00 93.54 233 B 1 ATOM 3049 C CD . ARG B 2 233 ? -0.481 1.773 1.111 1.00 91.97 233 B 1 ATOM 3050 N NE . ARG B 2 233 ? 0.522 1.793 0.031 1.00 90.82 233 B 1 ATOM 3051 C CZ . ARG B 2 233 ? 1.076 2.866 -0.494 1.00 90.43 233 B 1 ATOM 3052 N NH1 . ARG B 2 233 ? 0.720 4.078 -0.165 1.00 86.06 233 B 1 ATOM 3053 N NH2 . ARG B 2 233 ? 2.029 2.727 -1.367 1.00 85.81 233 B 1 ATOM 3054 N N . ASN B 2 234 ? -3.727 -0.958 4.936 1.00 96.18 234 B 1 ATOM 3055 C CA . ASN B 2 234 ? -4.474 -0.897 6.194 1.00 96.08 234 B 1 ATOM 3056 C C . ASN B 2 234 ? -4.363 -2.169 7.056 1.00 97.07 234 B 1 ATOM 3057 O O . ASN B 2 234 ? -4.879 -2.168 8.169 1.00 96.46 234 B 1 ATOM 3058 C CB . ASN B 2 234 ? -5.948 -0.563 5.893 1.00 94.75 234 B 1 ATOM 3059 C CG . ASN B 2 234 ? -6.607 -1.634 5.033 1.00 92.92 234 B 1 ATOM 3060 O OD1 . ASN B 2 234 ? -6.718 -1.504 3.819 1.00 84.42 234 B 1 ATOM 3061 N ND2 . ASN B 2 234 ? -7.074 -2.717 5.620 1.00 84.91 234 B 1 ATOM 3062 N N . ASN B 2 235 ? -3.762 -3.237 6.537 1.00 97.13 235 B 1 ATOM 3063 C CA . ASN B 2 235 ? -3.516 -4.480 7.264 1.00 97.62 235 B 1 ATOM 3064 C C . ASN B 2 235 ? -2.106 -4.534 7.861 1.00 98.05 235 B 1 ATOM 3065 O O . ASN B 2 235 ? -1.792 -5.474 8.582 1.00 97.45 235 B 1 ATOM 3066 C CB . ASN B 2 235 ? -3.735 -5.678 6.321 1.00 97.24 235 B 1 ATOM 3067 C CG . ASN B 2 235 ? -5.139 -5.737 5.740 1.00 96.94 235 B 1 ATOM 3068 O OD1 . ASN B 2 235 ? -5.365 -5.554 4.549 1.00 88.46 235 B 1 ATOM 3069 N ND2 . ASN B 2 235 ? -6.126 -5.988 6.570 1.00 88.74 235 B 1 ATOM 3070 N N . LEU B 2 236 ? -1.254 -3.564 7.558 1.00 97.96 236 B 1 ATOM 3071 C CA . LEU B 2 236 ? 0.107 -3.545 8.077 1.00 98.00 236 B 1 ATOM 3072 C C . LEU B 2 236 ? 0.080 -3.286 9.587 1.00 98.00 236 B 1 ATOM 3073 O O . LEU B 2 236 ? -0.421 -2.257 10.032 1.00 97.09 236 B 1 ATOM 3074 C CB . LEU B 2 236 ? 0.949 -2.505 7.321 1.00 97.68 236 B 1 ATOM 3075 C CG . LEU B 2 236 ? 1.070 -2.768 5.807 1.00 97.09 236 B 1 ATOM 3076 C CD1 . LEU B 2 236 ? 1.875 -1.656 5.142 1.00 96.31 236 B 1 ATOM 3077 C CD2 . LEU B 2 236 ? 1.753 -4.100 5.497 1.00 95.91 236 B 1 ATOM 3078 N N . HIS B 2 237 ? 0.636 -4.241 10.352 1.00 98.28 237 B 1 ATOM 3079 C CA . HIS B 2 237 ? 0.723 -4.203 11.809 1.00 98.30 237 B 1 ATOM 3080 C C . HIS B 2 237 ? 2.149 -4.535 12.251 1.00 98.36 237 B 1 ATOM 3081 O O . HIS B 2 237 ? 2.903 -5.191 11.523 1.00 97.72 237 B 1 ATOM 3082 C CB . HIS B 2 237 ? -0.284 -5.185 12.429 1.00 97.94 237 B 1 ATOM 3083 C CG . HIS B 2 237 ? -1.713 -4.736 12.303 1.00 97.57 237 B 1 ATOM 3084 N ND1 . HIS B 2 237 ? -2.486 -4.805 11.149 1.00 86.84 237 B 1 ATOM 3085 C CD2 . HIS B 2 237 ? -2.472 -4.141 13.272 1.00 89.37 237 B 1 ATOM 3086 C CE1 . HIS B 2 237 ? -3.670 -4.250 11.425 1.00 90.25 237 B 1 ATOM 3087 N NE2 . HIS B 2 237 ? -3.704 -3.852 12.699 1.00 92.85 237 B 1 ATOM 3088 N N . ASP B 2 238 ? 2.504 -4.093 13.451 1.00 97.59 238 B 1 ATOM 3089 C CA . ASP B 2 238 ? 3.786 -4.450 14.046 1.00 97.28 238 B 1 ATOM 3090 C C . ASP B 2 238 ? 3.933 -5.973 14.172 1.00 97.21 238 B 1 ATOM 3091 O O . ASP B 2 238 ? 3.005 -6.688 14.557 1.00 95.85 238 B 1 ATOM 3092 C CB . ASP B 2 238 ? 3.962 -3.773 15.412 1.00 96.55 238 B 1 ATOM 3093 C CG . ASP B 2 238 ? 4.393 -2.304 15.297 1.00 95.92 238 B 1 ATOM 3094 O OD1 . ASP B 2 238 ? 5.158 -1.983 14.356 1.00 93.07 238 B 1 ATOM 3095 O OD2 . ASP B 2 238 ? 3.985 -1.506 16.166 1.00 92.97 238 B 1 ATOM 3096 N N . ASN B 2 239 ? 5.122 -6.452 13.843 1.00 96.97 239 B 1 ATOM 3097 C CA . ASN B 2 239 ? 5.527 -7.861 13.896 1.00 96.79 239 B 1 ATOM 3098 C C . ASN B 2 239 ? 4.849 -8.775 12.860 1.00 97.36 239 B 1 ATOM 3099 O O . ASN B 2 239 ? 5.123 -9.974 12.841 1.00 96.13 239 B 1 ATOM 3100 C CB . ASN B 2 239 ? 5.410 -8.395 15.336 1.00 95.22 239 B 1 ATOM 3101 C CG . ASN B 2 239 ? 5.958 -7.437 16.388 1.00 93.26 239 B 1 ATOM 3102 O OD1 . ASN B 2 239 ? 6.874 -6.657 16.165 1.00 84.73 239 B 1 ATOM 3103 N ND2 . ASN B 2 239 ? 5.405 -7.470 17.579 1.00 83.52 239 B 1 ATOM 3104 N N . TRP B 2 240 ? 4.033 -8.222 11.968 1.00 98.20 240 B 1 ATOM 3105 C CA . TRP B 2 240 ? 3.416 -8.959 10.871 1.00 98.47 240 B 1 ATOM 3106 C C . TRP B 2 240 ? 4.255 -8.871 9.598 1.00 98.52 240 B 1 ATOM 3107 O O . TRP B 2 240 ? 4.556 -7.774 9.109 1.00 98.00 240 B 1 ATOM 3108 C CB . TRP B 2 240 ? 1.989 -8.468 10.623 1.00 98.39 240 B 1 ATOM 3109 C CG . TRP B 2 240 ? 0.986 -8.929 11.640 1.00 98.40 240 B 1 ATOM 3110 C CD1 . TRP B 2 240 ? 0.828 -8.428 12.889 1.00 97.83 240 B 1 ATOM 3111 C CD2 . TRP B 2 240 ? 0.006 -10.011 11.508 1.00 98.25 240 B 1 ATOM 3112 N NE1 . TRP B 2 240 ? -0.188 -9.125 13.548 1.00 97.72 240 B 1 ATOM 3113 C CE2 . TRP B 2 240 ? -0.715 -10.101 12.729 1.00 98.00 240 B 1 ATOM 3114 C CE3 . TRP B 2 240 ? -0.327 -10.909 10.475 1.00 98.08 240 B 1 ATOM 3115 C CZ2 . TRP B 2 240 ? -1.737 -11.057 12.925 1.00 97.65 240 B 1 ATOM 3116 C CZ3 . TRP B 2 240 ? -1.347 -11.861 10.669 1.00 97.35 240 B 1 ATOM 3117 C CH2 . TRP B 2 240 ? -2.037 -11.933 11.881 1.00 97.17 240 B 1 ATOM 3118 N N . VAL B 2 241 ? 4.550 -10.023 9.012 1.00 98.62 241 B 1 ATOM 3119 C CA . VAL B 2 241 ? 4.947 -10.116 7.604 1.00 98.63 241 B 1 ATOM 3120 C C . VAL B 2 241 ? 3.673 -10.079 6.771 1.00 98.71 241 B 1 ATOM 3121 O O . VAL B 2 241 ? 2.796 -10.918 6.949 1.00 98.46 241 B 1 ATOM 3122 C CB . VAL B 2 241 ? 5.751 -11.393 7.323 1.00 98.38 241 B 1 ATOM 3123 C CG1 . VAL B 2 241 ? 6.175 -11.472 5.852 1.00 97.42 241 B 1 ATOM 3124 C CG2 . VAL B 2 241 ? 7.023 -11.446 8.176 1.00 97.46 241 B 1 ATOM 3125 N N . SER B 2 242 ? 3.553 -9.120 5.874 1.00 98.66 242 B 1 ATOM 3126 C CA . SER B 2 242 ? 2.320 -8.884 5.123 1.00 98.59 242 B 1 ATOM 3127 C C . SER B 2 242 ? 2.591 -8.894 3.624 1.00 98.51 242 B 1 ATOM 3128 O O . SER B 2 242 ? 3.344 -8.064 3.119 1.00 97.85 242 B 1 ATOM 3129 C CB . SER B 2 242 ? 1.692 -7.556 5.549 1.00 98.29 242 B 1 ATOM 3130 O OG . SER B 2 242 ? 1.381 -7.556 6.929 1.00 96.04 242 B 1 ATOM 3131 N N . ILE B 2 243 ? 1.968 -9.811 2.900 1.00 98.53 243 B 1 ATOM 3132 C CA . ILE B 2 243 ? 2.141 -9.982 1.453 1.00 98.50 243 B 1 ATOM 3133 C C . ILE B 2 243 ? 0.893 -9.484 0.731 1.00 98.41 243 B 1 ATOM 3134 O O . ILE B 2 243 ? -0.219 -9.935 1.008 1.00 97.83 243 B 1 ATOM 3135 C CB . ILE B 2 243 ? 2.457 -11.448 1.093 1.00 98.37 243 B 1 ATOM 3136 C CG1 . ILE B 2 243 ? 3.666 -11.993 1.896 1.00 97.60 243 B 1 ATOM 3137 C CG2 . ILE B 2 243 ? 2.714 -11.570 -0.424 1.00 97.61 243 B 1 ATOM 3138 C CD1 . ILE B 2 243 ? 3.844 -13.510 1.781 1.00 96.23 243 B 1 ATOM 3139 N N . GLY B 2 244 ? 1.070 -8.610 -0.241 1.00 97.58 244 B 1 ATOM 3140 C CA . GLY B 2 244 ? -0.027 -8.162 -1.095 1.00 97.21 244 B 1 ATOM 3141 C C . GLY B 2 244 ? 0.474 -7.473 -2.353 1.00 96.80 244 B 1 ATOM 3142 O O . GLY B 2 244 ? 1.508 -6.809 -2.344 1.00 95.30 244 B 1 ATOM 3143 N N . ASN B 2 245 ? -0.270 -7.605 -3.452 1.00 96.14 245 B 1 ATOM 3144 C CA . ASN B 2 245 ? 0.106 -6.980 -4.727 1.00 95.18 245 B 1 ATOM 3145 C C . ASN B 2 245 ? -0.212 -5.478 -4.793 1.00 94.82 245 B 1 ATOM 3146 O O . ASN B 2 245 ? 0.152 -4.832 -5.773 1.00 91.69 245 B 1 ATOM 3147 C CB . ASN B 2 245 ? -0.523 -7.757 -5.903 1.00 93.56 245 B 1 ATOM 3148 C CG . ASN B 2 245 ? -2.030 -7.577 -6.027 1.00 94.39 245 B 1 ATOM 3149 O OD1 . ASN B 2 245 ? -2.717 -7.215 -5.087 1.00 87.55 245 B 1 ATOM 3150 N ND2 . ASN B 2 245 ? -2.588 -7.828 -7.197 1.00 88.02 245 B 1 ATOM 3151 N N . GLU B 2 246 ? -0.872 -4.916 -3.778 1.00 94.52 246 B 1 ATOM 3152 C CA . GLU B 2 246 ? -1.251 -3.491 -3.691 1.00 93.93 246 B 1 ATOM 3153 C C . GLU B 2 246 ? -0.517 -2.714 -2.584 1.00 94.89 246 B 1 ATOM 3154 O O . GLU B 2 246 ? -0.867 -1.566 -2.306 1.00 92.75 246 B 1 ATOM 3155 C CB . GLU B 2 246 ? -2.774 -3.352 -3.517 1.00 91.16 246 B 1 ATOM 3156 C CG . GLU B 2 246 ? -3.585 -3.879 -4.704 1.00 87.10 246 B 1 ATOM 3157 C CD . GLU B 2 246 ? -5.078 -3.558 -4.563 1.00 83.49 246 B 1 ATOM 3158 O OE1 . GLU B 2 246 ? -5.727 -3.342 -5.610 1.00 74.64 246 B 1 ATOM 3159 O OE2 . GLU B 2 246 ? -5.586 -3.498 -3.413 1.00 75.50 246 B 1 ATOM 3160 N N . LEU B 2 247 ? 0.491 -3.325 -1.960 1.00 95.62 247 B 1 ATOM 3161 C CA . LEU B 2 247 ? 1.289 -2.689 -0.915 1.00 96.00 247 B 1 ATOM 3162 C C . LEU B 2 247 ? 2.182 -1.563 -1.451 1.00 94.54 247 B 1 ATOM 3163 O O . LEU B 2 247 ? 2.579 -1.575 -2.632 1.00 88.92 247 B 1 ATOM 3164 C CB . LEU B 2 247 ? 2.054 -3.746 -0.097 1.00 95.42 247 B 1 ATOM 3165 C CG . LEU B 2 247 ? 1.140 -4.634 0.781 1.00 96.43 247 B 1 ATOM 3166 C CD1 . LEU B 2 247 ? 1.979 -5.701 1.483 1.00 94.43 247 B 1 ATOM 3167 C CD2 . LEU B 2 247 ? 0.405 -3.824 1.862 1.00 93.56 247 B 1 ATOM 3168 O OXT . LEU B 2 247 ? 2.440 -0.631 -0.663 1.00 91.85 247 B 1 HETATM 3169 N N . SAH C 3 . ? -8.070 -8.174 4.268 1.00 95.04 1 C 1 HETATM 3170 C CA . SAH C 3 . ? -7.955 -6.885 3.590 1.00 95.98 1 C 1 HETATM 3171 C CB . SAH C 3 . ? -8.647 -6.898 2.229 1.00 94.85 1 C 1 HETATM 3172 C CG . SAH C 3 . ? -7.995 -7.833 1.237 1.00 94.23 1 C 1 HETATM 3173 S SD . SAH C 3 . ? -8.747 -7.693 -0.368 1.00 94.42 1 C 1 HETATM 3174 C C . SAH C 3 . ? -8.489 -5.773 4.461 1.00 95.87 1 C 1 HETATM 3175 O O . SAH C 3 . ? -8.522 -4.615 4.028 1.00 92.56 1 C 1 HETATM 3176 O OXT . SAH C 3 . ? -8.839 -6.030 5.626 1.00 94.76 1 C 1 HETATM 3177 C "C5'" . SAH C 3 . ? -7.722 -8.851 -1.280 1.00 94.95 1 C 1 HETATM 3178 C "C4'" . SAH C 3 . ? -6.366 -8.268 -1.635 1.00 96.33 1 C 1 HETATM 3179 O "O4'" . SAH C 3 . ? -5.631 -9.262 -2.355 1.00 96.52 1 C 1 HETATM 3180 C "C3'" . SAH C 3 . ? -6.421 -7.047 -2.557 1.00 95.50 1 C 1 HETATM 3181 O "O3'" . SAH C 3 . ? -5.645 -6.000 -1.977 1.00 94.51 1 C 1 HETATM 3182 C "C2'" . SAH C 3 . ? -5.782 -7.508 -3.856 1.00 95.32 1 C 1 HETATM 3183 O "O2'" . SAH C 3 . ? -5.065 -6.478 -4.511 1.00 94.27 1 C 1 HETATM 3184 C "C1'" . SAH C 3 . ? -4.863 -8.592 -3.352 1.00 96.58 1 C 1 HETATM 3185 N N9 . SAH C 3 . ? -4.451 -9.538 -4.388 1.00 96.81 1 C 1 HETATM 3186 C C8 . SAH C 3 . ? -5.162 -9.951 -5.452 1.00 96.34 1 C 1 HETATM 3187 N N7 . SAH C 3 . ? -4.463 -10.812 -6.191 1.00 96.25 1 C 1 HETATM 3188 C C5 . SAH C 3 . ? -3.251 -10.943 -5.591 1.00 96.98 1 C 1 HETATM 3189 C C6 . SAH C 3 . ? -2.068 -11.678 -5.880 1.00 97.00 1 C 1 HETATM 3190 N N6 . SAH C 3 . ? -1.992 -12.467 -6.959 1.00 96.21 1 C 1 HETATM 3191 N N1 . SAH C 3 . ? -1.006 -11.571 -5.055 1.00 96.76 1 C 1 HETATM 3192 C C2 . SAH C 3 . ? -1.075 -10.766 -3.966 1.00 96.68 1 C 1 HETATM 3193 N N3 . SAH C 3 . ? -2.156 -10.039 -3.642 1.00 96.87 1 C 1 HETATM 3194 C C4 . SAH C 3 . ? -3.238 -10.125 -4.436 1.00 97.05 1 C 1 #