# 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 03:25:48)" _ma_model_list.model_id 1 _ma_model_list.model_name "Top ranked model" _ma_model_list.model_type "Ab initio model" _ma_model_list.ordinal_id 1 # loop_ _ma_protocol_step.method_type _ma_protocol_step.ordinal_id _ma_protocol_step.protocol_id _ma_protocol_step.step_id "coevolution MSA" 1 1 1 "template search" 2 1 2 modeling 3 1 3 # loop_ _ma_qa_metric.id _ma_qa_metric.mode _ma_qa_metric.name _ma_qa_metric.software_group_id _ma_qa_metric.type 1 global pLDDT 1 pLDDT 2 local pLDDT 1 pLDDT # _ma_qa_metric_global.metric_id 1 _ma_qa_metric_global.metric_value 89.37 _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 36.45 1 1 A LYS 2 2 33.77 1 2 A LYS 3 2 32.83 1 3 A ASN 4 2 33.69 1 4 A GLY 5 2 38.59 1 5 A LYS 6 2 36.14 1 6 A SER 7 2 47.01 1 7 A GLN 8 2 42.66 1 8 A ASN 9 2 54.54 1 9 A GLN 10 2 59.93 1 10 A PRO 11 2 81.05 1 11 A LEU 12 2 91.56 1 12 A ASP 13 2 94.07 1 13 A PHE 14 2 93.48 1 14 A THR 15 2 95.00 1 15 A GLN 16 2 92.20 1 16 A TYR 17 2 98.01 1 17 A ALA 18 2 98.26 1 18 A LYS 19 2 94.06 1 19 A ASN 20 2 96.49 1 20 A MET 21 2 97.60 1 21 A ARG 22 2 95.96 1 22 A LYS 23 2 92.45 1 23 A ASP 24 2 96.28 1 24 A LEU 25 2 96.97 1 25 A SER 26 2 94.54 1 26 A ASN 27 2 85.55 1 27 A GLN 28 2 79.21 1 28 A ASP 29 2 92.59 1 29 A ILE 30 2 95.67 1 30 A CYS 31 2 95.42 1 31 A LEU 32 2 92.99 1 32 A GLU 33 2 83.84 1 33 A ASP 34 2 92.13 1 34 A GLY 35 2 96.53 1 35 A ALA 36 2 96.30 1 36 A LEU 37 2 94.84 1 37 A ASN 38 2 95.17 1 38 A HIS 39 2 94.33 1 39 A SER 40 2 92.98 1 40 A TYR 41 2 96.16 1 41 A PHE 42 2 96.13 1 42 A LEU 43 2 93.78 1 43 A THR 44 2 88.91 1 44 A LYS 45 2 79.50 1 45 A LYS 46 2 77.78 1 46 A GLY 47 2 85.67 1 47 A GLN 48 2 82.67 1 48 A TYR 49 2 93.51 1 49 A TRP 50 2 96.32 1 50 A THR 51 2 94.57 1 51 A PRO 52 2 94.28 1 52 A LEU 53 2 91.78 1 53 A ASN 54 2 95.43 1 54 A GLN 55 2 96.01 1 55 A LYS 56 2 88.47 1 56 A ALA 57 2 98.60 1 57 A LEU 58 2 98.59 1 58 A GLN 59 2 96.82 1 59 A ARG 60 2 89.09 1 60 A GLY 61 2 98.73 1 61 A ILE 62 2 98.29 1 62 A GLU 63 2 96.06 1 63 A LEU 64 2 96.50 1 64 A PHE 65 2 97.90 1 65 A GLY 66 2 98.34 1 66 A VAL 67 2 98.04 1 67 A GLY 68 2 97.33 1 68 A ASN 69 2 95.69 1 69 A TRP 70 2 97.03 1 70 A LYS 71 2 87.88 1 71 A GLU 72 2 91.60 1 72 A ILE 73 2 98.39 1 73 A ASN 74 2 97.37 1 74 A TYR 75 2 86.41 1 75 A ASP 76 2 93.70 1 76 A GLU 77 2 95.02 1 77 A PHE 78 2 97.52 1 78 A SER 79 2 95.73 1 79 A GLY 80 2 96.65 1 80 A LYS 81 2 87.24 1 81 A ALA 82 2 95.54 1 82 A ASN 83 2 91.18 1 83 A ILE 84 2 89.33 1 84 A VAL 85 2 92.20 1 85 A GLU 86 2 93.97 1 86 A LEU 87 2 97.22 1 87 A GLU 88 2 89.81 1 88 A LEU 89 2 94.88 1 89 A ARG 90 2 94.38 1 90 A THR 91 2 97.99 1 91 A CYS 92 2 97.67 1 92 A MET 93 2 93.72 1 93 A ILE 94 2 98.22 1 94 A LEU 95 2 98.30 1 95 A GLY 96 2 97.81 1 96 A ILE 97 2 96.35 1 97 A ASN 98 2 92.54 1 98 A ASP 99 2 91.79 1 99 A ILE 100 2 95.19 1 100 A THR 101 2 91.38 1 101 A GLU 102 2 88.26 1 102 A TYR 103 2 97.58 1 103 A TYR 104 2 90.84 1 104 A GLY 105 2 97.47 1 105 A LYS 106 2 92.65 1 106 A LYS 107 2 96.96 1 107 A ILE 108 2 98.20 1 108 A SER 109 2 98.24 1 109 A GLU 110 2 90.63 1 110 A GLU 111 2 87.74 1 111 A GLU 112 2 87.67 1 112 A GLN 113 2 97.77 1 113 A GLU 114 2 85.45 1 114 A GLU 115 2 88.22 1 115 A ILE 116 2 98.21 1 116 A LYS 117 2 95.58 1 117 A LYS 118 2 91.40 1 118 A SER 119 2 95.93 1 119 A ASN 120 2 97.59 1 120 A ILE 121 2 96.39 1 121 A ALA 122 2 98.08 1 122 A LYS 123 2 89.15 1 123 A GLY 124 2 97.40 1 124 A LYS 125 2 90.41 1 125 A LYS 126 2 88.24 1 126 A GLU 127 2 93.53 1 127 A ASN 128 2 90.55 1 128 A LYS 129 2 91.07 1 129 A LEU 130 2 94.64 1 130 A LYS 131 2 87.83 1 131 A ASP 132 2 94.72 1 132 A ASN 133 2 90.61 1 133 A ILE 134 2 94.68 1 134 A TYR 135 2 95.84 1 135 A GLN 136 2 90.04 1 136 A LYS 137 2 77.49 1 137 A LEU 138 2 67.77 1 138 A GLN 139 2 56.70 1 139 A GLN 140 2 44.49 1 140 A MET 141 2 42.66 1 141 A GLN 142 2 30.91 1 142 B ASP 1 2 55.09 1 143 B ASP 2 2 63.10 1 144 B TYR 3 2 66.08 1 145 B LEU 4 2 77.95 1 146 B ASP 5 2 74.89 1 147 B ARG 6 2 68.41 1 148 B LEU 7 2 82.18 1 149 B PRO 8 2 81.51 1 150 B LYS 9 2 74.52 1 151 B SER 10 2 84.94 1 152 B LYS 11 2 80.95 1 153 B LYS 12 2 80.25 1 154 B GLY 13 2 91.54 1 155 B LEU 14 2 89.09 1 156 B GLN 15 2 85.10 1 157 B GLY 16 2 91.55 1 158 B LEU 17 2 90.05 1 159 B LEU 18 2 87.43 1 160 B GLN 19 2 85.69 1 161 B ASP 20 2 87.47 1 162 B ILE 21 2 89.41 1 163 B GLU 22 2 85.63 1 164 B LYS 23 2 84.08 1 165 B ARG 24 2 77.94 1 166 B ILE 25 2 86.82 1 167 B LEU 26 2 84.69 1 168 B HIS 27 2 86.63 1 169 B TYR 28 2 81.39 1 170 B LYS 29 2 89.17 1 171 B GLN 30 2 86.10 1 172 B LEU 31 2 91.16 1 173 B PHE 32 2 94.83 1 174 B PHE 33 2 95.69 1 175 B LYS 34 2 90.82 1 176 B GLU 35 2 87.32 1 177 B GLN 36 2 92.69 1 178 B ASN 37 2 92.77 1 179 B GLU 38 2 92.98 1 180 B ILE 39 2 91.89 1 181 B ALA 40 2 92.43 1 182 B ASN 41 2 89.41 1 183 B GLY 42 2 92.85 1 184 B LYS 43 2 91.28 1 185 B ARG 44 2 83.44 1 186 B SER 45 2 95.97 1 187 B MET 46 2 88.79 1 188 B VAL 47 2 96.60 1 189 B PRO 48 2 97.51 1 190 B ASP 49 2 93.83 1 191 B ASN 50 2 95.17 1 192 B SER 51 2 97.55 1 193 B ILE 52 2 97.99 1 194 B PRO 53 2 98.03 1 195 B ILE 54 2 97.69 1 196 B CYS 55 2 96.15 1 197 B SER 56 2 95.62 1 198 B ASP 57 2 95.79 1 199 B VAL 58 2 96.49 1 200 B THR 59 2 94.68 1 201 B LYS 60 2 89.87 1 202 B LEU 61 2 96.24 1 203 B ASN 62 2 94.85 1 204 B PHE 63 2 97.51 1 205 B GLN 64 2 94.21 1 206 B ALA 65 2 97.92 1 207 B LEU 66 2 97.79 1 208 B ILE 67 2 97.20 1 209 B ASP 68 2 96.70 1 210 B ALA 69 2 98.24 1 211 B GLN 70 2 96.95 1 212 B MET 71 2 94.22 1 213 B ARG 72 2 87.07 1 214 B HIS 73 2 94.92 1 215 B ALA 74 2 96.54 1 216 B GLY 75 2 95.74 1 217 B LYS 76 2 91.44 1 218 B MET 77 2 93.58 1 219 B PHE 78 2 98.14 1 220 B ASP 79 2 97.02 1 221 B VAL 80 2 98.19 1 222 B ILE 81 2 98.42 1 223 B MET 82 2 96.94 1 224 B MET 83 2 93.99 1 225 B ASP 84 2 96.87 1 226 B PRO 85 2 97.49 1 227 B PRO 86 2 96.54 1 228 B TRP 87 2 95.85 1 229 B GLN 88 2 86.94 1 230 B LEU 89 2 80.71 1 231 B SER 90 2 70.94 1 232 B SER 91 2 61.22 1 233 B SER 92 2 54.41 1 234 B GLN 93 2 46.90 1 235 B PRO 94 2 52.57 1 236 B SER 95 2 52.89 1 237 B ARG 96 2 42.78 1 238 B GLY 97 2 56.95 1 239 B VAL 98 2 56.48 1 240 B ALA 99 2 61.10 1 241 B ILE 100 2 62.42 1 242 B ALA 101 2 69.19 1 243 B TYR 102 2 76.07 1 244 B ASP 103 2 84.15 1 245 B SER 104 2 92.26 1 246 B LEU 105 2 95.52 1 247 B SER 106 2 95.83 1 248 B ASP 107 2 95.92 1 249 B GLU 108 2 87.17 1 250 B LYS 109 2 92.35 1 251 B ILE 110 2 97.22 1 252 B GLN 111 2 91.05 1 253 B ASN 112 2 92.28 1 254 B MET 113 2 96.57 1 255 B PRO 114 2 97.60 1 256 B ILE 115 2 97.26 1 257 B GLN 116 2 90.58 1 258 B SER 117 2 95.82 1 259 B LEU 118 2 97.00 1 260 B GLN 119 2 95.91 1 261 B GLN 120 2 86.83 1 262 B ASP 121 2 95.86 1 263 B GLY 122 2 98.06 1 264 B PHE 123 2 97.84 1 265 B ILE 124 2 97.98 1 266 B PHE 125 2 98.10 1 267 B VAL 126 2 98.38 1 268 B TRP 127 2 98.16 1 269 B ALA 128 2 96.41 1 270 B ILE 129 2 91.63 1 271 B ASN 130 2 88.27 1 272 B ALA 131 2 93.09 1 273 B LYS 132 2 94.16 1 274 B TYR 133 2 95.22 1 275 B ARG 134 2 82.75 1 276 B VAL 135 2 94.36 1 277 B THR 136 2 97.25 1 278 B ILE 137 2 97.08 1 279 B LYS 138 2 86.14 1 280 B MET 139 2 94.87 1 281 B ILE 140 2 96.05 1 282 B GLU 141 2 96.07 1 283 B ASN 142 2 94.59 1 284 B TRP 143 2 97.69 1 285 B GLY 144 2 97.66 1 286 B TYR 145 2 98.09 1 287 B LYS 146 2 88.59 1 288 B LEU 147 2 94.61 1 289 B VAL 148 2 95.52 1 290 B ASP 149 2 94.63 1 291 B GLU 150 2 94.49 1 292 B ILE 151 2 96.57 1 293 B THR 152 2 96.47 1 294 B TRP 153 2 96.92 1 295 B VAL 154 2 96.15 1 296 B LYS 155 2 91.02 1 297 B LYS 156 2 91.23 1 298 B THR 157 2 91.84 1 299 B VAL 158 2 89.00 1 300 B ASN 159 2 88.23 1 301 B GLY 160 2 92.17 1 302 B LYS 161 2 85.47 1 303 B ILE 162 2 90.45 1 304 B ALA 163 2 90.02 1 305 B LYS 164 2 76.08 1 306 B GLY 165 2 85.11 1 307 B HIS 166 2 75.27 1 308 B GLY 167 2 85.98 1 309 B PHE 168 2 78.22 1 310 B TYR 169 2 88.10 1 311 B LEU 170 2 91.30 1 312 B GLN 171 2 85.84 1 313 B HIS 172 2 85.94 1 314 B ALA 173 2 93.85 1 315 B LYS 174 2 91.23 1 316 B GLU 175 2 92.90 1 317 B SER 176 2 96.42 1 318 B CYS 177 2 98.33 1 319 B LEU 178 2 96.07 1 320 B ILE 179 2 97.15 1 321 B GLY 180 2 98.48 1 322 B VAL 181 2 96.26 1 323 B LYS 182 2 93.46 1 324 B GLY 183 2 96.35 1 325 B ASP 184 2 93.01 1 326 B VAL 185 2 93.17 1 327 B ASP 186 2 90.76 1 328 B ASN 187 2 87.03 1 329 B GLY 188 2 92.27 1 330 B ARG 189 2 82.53 1 331 B PHE 190 2 96.02 1 332 B LYS 191 2 88.71 1 333 B LYS 192 2 86.16 1 334 B ASN 193 2 91.41 1 335 B ILE 194 2 87.32 1 336 B ALA 195 2 93.11 1 337 B SER 196 2 93.73 1 338 B ASP 197 2 95.60 1 339 B VAL 198 2 95.55 1 340 B ILE 199 2 97.19 1 341 B PHE 200 2 93.73 1 342 B SER 201 2 96.12 1 343 B GLU 202 2 91.36 1 344 B ARG 203 2 80.39 1 345 B ARG 204 2 85.61 1 346 B GLY 205 2 91.84 1 347 B GLN 206 2 78.86 1 348 B SER 207 2 89.63 1 349 B GLN 208 2 91.43 1 350 B LYS 209 2 93.55 1 351 B PRO 210 2 97.41 1 352 B GLU 211 2 92.66 1 353 B GLU 212 2 94.56 1 354 B ILE 213 2 97.50 1 355 B TYR 214 2 97.88 1 356 B GLN 215 2 90.80 1 357 B TYR 216 2 93.91 1 358 B ILE 217 2 97.62 1 359 B ASN 218 2 90.57 1 360 B GLN 219 2 92.19 1 361 B LEU 220 2 96.90 1 362 B CYS 221 2 96.95 1 363 B PRO 222 2 95.16 1 364 B ASN 223 2 90.44 1 365 B GLY 224 2 96.65 1 366 B ASN 225 2 95.10 1 367 B TYR 226 2 97.35 1 368 B LEU 227 2 98.37 1 369 B GLU 228 2 97.82 1 370 B ILE 229 2 98.21 1 371 B PHE 230 2 98.01 1 372 B ALA 231 2 97.60 1 373 B ARG 232 2 90.42 1 374 B ARG 233 2 93.19 1 375 B ASN 234 2 93.41 1 376 B ASN 235 2 95.71 1 377 B LEU 236 2 97.65 1 378 B HIS 237 2 95.12 1 379 B ASP 238 2 96.30 1 380 B ASN 239 2 93.60 1 381 B TRP 240 2 98.24 1 382 B VAL 241 2 98.47 1 383 B SER 242 2 98.22 1 384 B ILE 243 2 98.20 1 385 B GLY 244 2 97.11 1 386 B ASN 245 2 93.48 1 387 B GLU 246 2 87.97 1 388 B LEU 247 2 94.72 1 389 C SAH . 2 96.04 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 ? -4.343 52.612 20.475 1.00 29.92 1 A 1 ATOM 2 C CA . MET A 1 1 ? -3.687 51.367 20.929 1.00 38.37 1 A 1 ATOM 3 C C . MET A 1 1 ? -3.724 50.357 19.788 1.00 43.55 1 A 1 ATOM 4 O O . MET A 1 1 ? -4.766 49.771 19.543 1.00 42.49 1 A 1 ATOM 5 C CB . MET A 1 1 ? -4.405 50.791 22.159 1.00 37.02 1 A 1 ATOM 6 C CG . MET A 1 1 ? -4.070 51.570 23.435 1.00 35.79 1 A 1 ATOM 7 S SD . MET A 1 1 ? -5.093 51.074 24.823 1.00 34.22 1 A 1 ATOM 8 C CE . MET A 1 1 ? -4.144 51.737 26.219 1.00 30.26 1 A 1 ATOM 9 N N . LYS A 1 2 ? -2.631 50.197 19.022 1.00 36.48 2 A 1 ATOM 10 C CA . LYS A 1 2 ? -2.545 49.180 17.965 1.00 38.16 2 A 1 ATOM 11 C C . LYS A 1 2 ? -2.510 47.816 18.661 1.00 37.25 2 A 1 ATOM 12 O O . LYS A 1 2 ? -1.544 47.521 19.352 1.00 35.12 2 A 1 ATOM 13 C CB . LYS A 1 2 ? -1.303 49.394 17.078 1.00 37.26 2 A 1 ATOM 14 C CG . LYS A 1 2 ? -1.461 50.548 16.067 1.00 34.26 2 A 1 ATOM 15 C CD . LYS A 1 2 ? -0.211 50.686 15.172 1.00 32.31 2 A 1 ATOM 16 C CE . LYS A 1 2 ? -0.402 51.785 14.108 1.00 27.88 2 A 1 ATOM 17 N NZ . LYS A 1 2 ? 0.790 51.950 13.235 1.00 25.24 2 A 1 ATOM 18 N N . LYS A 1 3 ? -3.579 47.025 18.543 1.00 35.93 3 A 1 ATOM 19 C CA . LYS A 1 3 ? -3.554 45.626 18.979 1.00 36.77 3 A 1 ATOM 20 C C . LYS A 1 3 ? -2.512 44.922 18.103 1.00 35.39 3 A 1 ATOM 21 O O . LYS A 1 3 ? -2.795 44.609 16.952 1.00 32.22 3 A 1 ATOM 22 C CB . LYS A 1 3 ? -4.946 44.964 18.856 1.00 35.50 3 A 1 ATOM 23 C CG . LYS A 1 3 ? -5.908 45.336 20.000 1.00 33.44 3 A 1 ATOM 24 C CD . LYS A 1 3 ? -7.239 44.568 19.866 1.00 31.96 3 A 1 ATOM 25 C CE . LYS A 1 3 ? -8.178 44.850 21.052 1.00 28.22 3 A 1 ATOM 26 N NZ . LYS A 1 3 ? -9.466 44.112 20.952 1.00 26.08 3 A 1 ATOM 27 N N . ASN A 1 4 ? -1.305 44.722 18.641 1.00 38.60 4 A 1 ATOM 28 C CA . ASN A 1 4 ? -0.334 43.784 18.091 1.00 37.99 4 A 1 ATOM 29 C C . ASN A 1 4 ? -0.957 42.388 18.210 1.00 37.13 4 A 1 ATOM 30 O O . ASN A 1 4 ? -0.742 41.688 19.193 1.00 33.29 4 A 1 ATOM 31 C CB . ASN A 1 4 ? 1.008 43.890 18.843 1.00 34.78 4 A 1 ATOM 32 C CG . ASN A 1 4 ? 1.933 44.977 18.314 1.00 30.20 4 A 1 ATOM 33 O OD1 . ASN A 1 4 ? 1.729 45.551 17.265 1.00 29.13 4 A 1 ATOM 34 N ND2 . ASN A 1 4 ? 2.999 45.274 19.025 1.00 28.41 4 A 1 ATOM 35 N N . GLY A 1 5 ? -1.778 42.023 17.234 1.00 38.96 5 A 1 ATOM 36 C CA . GLY A 1 5 ? -2.217 40.658 17.031 1.00 38.93 5 A 1 ATOM 37 C C . GLY A 1 5 ? -0.999 39.840 16.630 1.00 39.92 5 A 1 ATOM 38 O O . GLY A 1 5 ? -0.807 39.577 15.454 1.00 36.53 5 A 1 ATOM 39 N N . LYS A 1 6 ? -0.146 39.500 17.611 1.00 39.72 6 A 1 ATOM 40 C CA . LYS A 1 6 ? 0.770 38.377 17.470 1.00 40.57 6 A 1 ATOM 41 C C . LYS A 1 6 ? -0.140 37.172 17.255 1.00 41.06 6 A 1 ATOM 42 O O . LYS A 1 6 ? -0.621 36.592 18.226 1.00 38.59 6 A 1 ATOM 43 C CB . LYS A 1 6 ? 1.657 38.194 18.719 1.00 39.16 6 A 1 ATOM 44 C CG . LYS A 1 6 ? 2.797 39.217 18.829 1.00 36.01 6 A 1 ATOM 45 C CD . LYS A 1 6 ? 3.672 38.897 20.051 1.00 33.74 6 A 1 ATOM 46 C CE . LYS A 1 6 ? 4.865 39.856 20.156 1.00 29.59 6 A 1 ATOM 47 N NZ . LYS A 1 6 ? 5.751 39.518 21.302 1.00 26.86 6 A 1 ATOM 48 N N . SER A 1 7 ? -0.417 36.826 15.996 1.00 47.82 7 A 1 ATOM 49 C CA . SER A 1 7 ? -0.815 35.474 15.644 1.00 49.08 7 A 1 ATOM 50 C C . SER A 1 7 ? 0.334 34.595 16.134 1.00 50.34 7 A 1 ATOM 51 O O . SER A 1 7 ? 1.379 34.505 15.488 1.00 47.60 7 A 1 ATOM 52 C CB . SER A 1 7 ? -1.036 35.342 14.128 1.00 45.80 7 A 1 ATOM 53 O OG . SER A 1 7 ? 0.046 35.892 13.404 1.00 41.45 7 A 1 ATOM 54 N N . GLN A 1 8 ? 0.202 34.077 17.365 1.00 46.96 8 A 1 ATOM 55 C CA . GLN A 1 8 ? 1.081 33.035 17.852 1.00 48.93 8 A 1 ATOM 56 C C . GLN A 1 8 ? 0.820 31.865 16.911 1.00 52.53 8 A 1 ATOM 57 O O . GLN A 1 8 ? -0.191 31.185 17.049 1.00 49.36 8 A 1 ATOM 58 C CB . GLN A 1 8 ? 0.755 32.689 19.314 1.00 43.98 8 A 1 ATOM 59 C CG . GLN A 1 8 ? 1.274 33.752 20.307 1.00 39.53 8 A 1 ATOM 60 C CD . GLN A 1 8 ? 0.965 33.392 21.764 1.00 35.37 8 A 1 ATOM 61 O OE1 . GLN A 1 8 ? 0.108 32.591 22.076 1.00 33.91 8 A 1 ATOM 62 N NE2 . GLN A 1 8 ? 1.641 33.990 22.717 1.00 33.37 8 A 1 ATOM 63 N N . ASN A 1 9 ? 1.697 31.695 15.909 1.00 60.49 9 A 1 ATOM 64 C CA . ASN A 1 9 ? 1.730 30.486 15.098 1.00 61.12 9 A 1 ATOM 65 C C . ASN A 1 9 ? 2.037 29.339 16.060 1.00 63.40 9 A 1 ATOM 66 O O . ASN A 1 9 ? 3.199 29.050 16.344 1.00 59.29 9 A 1 ATOM 67 C CB . ASN A 1 9 ? 2.786 30.614 13.978 1.00 55.03 9 A 1 ATOM 68 C CG . ASN A 1 9 ? 2.274 31.289 12.713 1.00 48.67 9 A 1 ATOM 69 O OD1 . ASN A 1 9 ? 1.098 31.515 12.519 1.00 45.39 9 A 1 ATOM 70 N ND2 . ASN A 1 9 ? 3.163 31.616 11.796 1.00 42.94 9 A 1 ATOM 71 N N . GLN A 1 10 ? 0.985 28.772 16.660 1.00 68.64 10 A 1 ATOM 72 C CA . GLN A 1 10 ? 1.127 27.567 17.452 1.00 72.24 10 A 1 ATOM 73 C C . GLN A 1 10 ? 1.719 26.499 16.535 1.00 76.05 10 A 1 ATOM 74 O O . GLN A 1 10 ? 1.351 26.438 15.353 1.00 70.95 10 A 1 ATOM 75 C CB . GLN A 1 10 ? -0.213 27.132 18.053 1.00 64.09 10 A 1 ATOM 76 C CG . GLN A 1 10 ? -0.585 28.010 19.262 1.00 54.44 10 A 1 ATOM 77 C CD . GLN A 1 10 ? -1.830 27.509 19.995 1.00 47.62 10 A 1 ATOM 78 O OE1 . GLN A 1 10 ? -2.638 26.753 19.491 1.00 44.12 10 A 1 ATOM 79 N NE2 . GLN A 1 10 ? -2.036 27.927 21.222 1.00 41.24 10 A 1 ATOM 80 N N . PRO A 1 11 ? 2.673 25.696 17.038 1.00 82.32 11 A 1 ATOM 81 C CA . PRO A 1 11 ? 3.224 24.602 16.259 1.00 85.22 11 A 1 ATOM 82 C C . PRO A 1 11 ? 2.076 23.707 15.781 1.00 88.79 11 A 1 ATOM 83 O O . PRO A 1 11 ? 1.142 23.424 16.537 1.00 85.25 11 A 1 ATOM 84 C CB . PRO A 1 11 ? 4.205 23.889 17.193 1.00 78.24 11 A 1 ATOM 85 C CG . PRO A 1 11 ? 3.714 24.253 18.592 1.00 72.40 11 A 1 ATOM 86 C CD . PRO A 1 11 ? 3.145 25.651 18.413 1.00 75.14 11 A 1 ATOM 87 N N . LEU A 1 12 ? 2.136 23.292 14.528 1.00 89.53 12 A 1 ATOM 88 C CA . LEU A 1 12 ? 1.121 22.428 13.933 1.00 93.14 12 A 1 ATOM 89 C C . LEU A 1 12 ? 1.048 21.108 14.713 1.00 94.82 12 A 1 ATOM 90 O O . LEU A 1 12 ? 2.051 20.404 14.836 1.00 93.22 12 A 1 ATOM 91 C CB . LEU A 1 12 ? 1.473 22.223 12.447 1.00 91.46 12 A 1 ATOM 92 C CG . LEU A 1 12 ? 0.459 21.373 11.654 1.00 91.66 12 A 1 ATOM 93 C CD1 . LEU A 1 12 ? -0.902 22.066 11.544 1.00 89.37 12 A 1 ATOM 94 C CD2 . LEU A 1 12 ? 0.983 21.151 10.234 1.00 89.25 12 A 1 ATOM 95 N N . ASP A 1 13 ? -0.134 20.761 15.206 1.00 95.15 13 A 1 ATOM 96 C CA . ASP A 1 13 ? -0.386 19.415 15.723 1.00 96.23 13 A 1 ATOM 97 C C . ASP A 1 13 ? -0.484 18.449 14.537 1.00 97.01 13 A 1 ATOM 98 O O . ASP A 1 13 ? -1.525 18.323 13.885 1.00 96.41 13 A 1 ATOM 99 C CB . ASP A 1 13 ? -1.642 19.387 16.606 1.00 94.79 13 A 1 ATOM 100 C CG . ASP A 1 13 ? -1.978 17.982 17.144 1.00 93.75 13 A 1 ATOM 101 O OD1 . ASP A 1 13 ? -1.338 16.985 16.736 1.00 90.24 13 A 1 ATOM 102 O OD2 . ASP A 1 13 ? -2.930 17.889 17.953 1.00 88.95 13 A 1 ATOM 103 N N . PHE A 1 14 ? 0.620 17.770 14.244 1.00 96.79 14 A 1 ATOM 104 C CA . PHE A 1 14 ? 0.702 16.844 13.119 1.00 96.95 14 A 1 ATOM 105 C C . PHE A 1 14 ? -0.228 15.633 13.256 1.00 97.50 14 A 1 ATOM 106 O O . PHE A 1 14 ? -0.664 15.093 12.242 1.00 96.97 14 A 1 ATOM 107 C CB . PHE A 1 14 ? 2.152 16.395 12.927 1.00 95.77 14 A 1 ATOM 108 C CG . PHE A 1 14 ? 3.014 17.434 12.243 1.00 93.76 14 A 1 ATOM 109 C CD1 . PHE A 1 14 ? 2.905 17.627 10.855 1.00 91.41 14 A 1 ATOM 110 C CD2 . PHE A 1 14 ? 3.923 18.208 12.982 1.00 91.21 14 A 1 ATOM 111 C CE1 . PHE A 1 14 ? 3.703 18.577 10.200 1.00 89.74 14 A 1 ATOM 112 C CE2 . PHE A 1 14 ? 4.726 19.163 12.332 1.00 89.31 14 A 1 ATOM 113 C CZ . PHE A 1 14 ? 4.616 19.346 10.940 1.00 88.82 14 A 1 ATOM 114 N N . THR A 1 15 ? -0.578 15.218 14.475 1.00 97.30 15 A 1 ATOM 115 C CA . THR A 1 15 ? -1.522 14.109 14.672 1.00 97.17 15 A 1 ATOM 116 C C . THR A 1 15 ? -2.931 14.535 14.267 1.00 97.66 15 A 1 ATOM 117 O O . THR A 1 15 ? -3.603 13.831 13.510 1.00 97.11 15 A 1 ATOM 118 C CB . THR A 1 15 ? -1.504 13.617 16.124 1.00 96.10 15 A 1 ATOM 119 O OG1 . THR A 1 15 ? -0.207 13.165 16.447 1.00 90.44 15 A 1 ATOM 120 C CG2 . THR A 1 15 ? -2.450 12.441 16.353 1.00 89.25 15 A 1 ATOM 121 N N . GLN A 1 16 ? -3.365 15.712 14.713 1.00 97.04 16 A 1 ATOM 122 C CA . GLN A 1 16 ? -4.666 16.250 14.324 1.00 97.27 16 A 1 ATOM 123 C C . GLN A 1 16 ? -4.693 16.665 12.851 1.00 97.80 16 A 1 ATOM 124 O O . GLN A 1 16 ? -5.671 16.389 12.155 1.00 97.69 16 A 1 ATOM 125 C CB . GLN A 1 16 ? -5.042 17.415 15.255 1.00 96.64 16 A 1 ATOM 126 C CG . GLN A 1 16 ? -6.502 17.859 15.046 1.00 91.22 16 A 1 ATOM 127 C CD . GLN A 1 16 ? -7.494 16.708 15.283 1.00 90.13 16 A 1 ATOM 128 O OE1 . GLN A 1 16 ? -7.451 16.016 16.287 1.00 82.16 16 A 1 ATOM 129 N NE2 . GLN A 1 16 ? -8.390 16.443 14.362 1.00 79.87 16 A 1 ATOM 130 N N . TYR A 1 17 ? -3.605 17.255 12.354 1.00 97.69 17 A 1 ATOM 131 C CA . TYR A 1 17 ? -3.422 17.567 10.939 1.00 98.06 17 A 1 ATOM 132 C C . TYR A 1 17 ? -3.587 16.315 10.069 1.00 98.38 17 A 1 ATOM 133 O O . TYR A 1 17 ? -4.393 16.319 9.144 1.00 98.25 17 A 1 ATOM 134 C CB . TYR A 1 17 ? -2.042 18.211 10.732 1.00 97.90 17 A 1 ATOM 135 C CG . TYR A 1 17 ? -1.621 18.322 9.282 1.00 98.31 17 A 1 ATOM 136 C CD1 . TYR A 1 17 ? -0.672 17.427 8.743 1.00 97.90 17 A 1 ATOM 137 C CD2 . TYR A 1 17 ? -2.181 19.315 8.455 1.00 98.06 17 A 1 ATOM 138 C CE1 . TYR A 1 17 ? -0.278 17.532 7.402 1.00 97.92 17 A 1 ATOM 139 C CE2 . TYR A 1 17 ? -1.791 19.426 7.108 1.00 97.85 17 A 1 ATOM 140 C CZ . TYR A 1 17 ? -0.834 18.535 6.589 1.00 98.13 17 A 1 ATOM 141 O OH . TYR A 1 17 ? -0.438 18.650 5.279 1.00 97.64 17 A 1 ATOM 142 N N . ALA A 1 18 ? -2.905 15.224 10.400 1.00 98.40 18 A 1 ATOM 143 C CA . ALA A 1 18 ? -2.999 13.978 9.643 1.00 98.35 18 A 1 ATOM 144 C C . ALA A 1 18 ? -4.428 13.411 9.643 1.00 98.41 18 A 1 ATOM 145 O O . ALA A 1 18 ? -4.916 12.982 8.597 1.00 98.12 18 A 1 ATOM 146 C CB . ALA A 1 18 ? -1.984 12.976 10.203 1.00 98.01 18 A 1 ATOM 147 N N . LYS A 1 19 ? -5.128 13.452 10.777 1.00 98.20 19 A 1 ATOM 148 C CA . LYS A 1 19 ? -6.540 13.045 10.855 1.00 98.18 19 A 1 ATOM 149 C C . LYS A 1 19 ? -7.434 13.911 9.964 1.00 98.19 19 A 1 ATOM 150 O O . LYS A 1 19 ? -8.220 13.370 9.193 1.00 97.76 19 A 1 ATOM 151 C CB . LYS A 1 19 ? -7.044 13.084 12.305 1.00 97.84 19 A 1 ATOM 152 C CG . LYS A 1 19 ? -6.499 11.926 13.152 1.00 95.62 19 A 1 ATOM 153 C CD . LYS A 1 19 ? -7.156 11.945 14.536 1.00 93.82 19 A 1 ATOM 154 C CE . LYS A 1 19 ? -6.722 10.733 15.357 1.00 87.01 19 A 1 ATOM 155 N NZ . LYS A 1 19 ? -7.723 10.413 16.410 1.00 79.93 19 A 1 ATOM 156 N N . ASN A 1 20 ? -7.281 15.222 10.035 1.00 98.22 20 A 1 ATOM 157 C CA . ASN A 1 20 ? -8.081 16.162 9.249 1.00 98.15 20 A 1 ATOM 158 C C . ASN A 1 20 ? -7.840 15.992 7.742 1.00 98.23 20 A 1 ATOM 159 O O . ASN A 1 20 ? -8.793 15.848 6.978 1.00 97.81 20 A 1 ATOM 160 C CB . ASN A 1 20 ? -7.752 17.591 9.697 1.00 97.91 20 A 1 ATOM 161 C CG . ASN A 1 20 ? -8.232 17.929 11.097 1.00 97.22 20 A 1 ATOM 162 O OD1 . ASN A 1 20 ? -9.001 17.229 11.736 1.00 92.54 20 A 1 ATOM 163 N ND2 . ASN A 1 20 ? -7.792 19.061 11.614 1.00 91.85 20 A 1 ATOM 164 N N . MET A 1 21 ? -6.580 15.917 7.330 1.00 98.48 21 A 1 ATOM 165 C CA . MET A 1 21 ? -6.212 15.720 5.923 1.00 98.46 21 A 1 ATOM 166 C C . MET A 1 21 ? -6.740 14.389 5.378 1.00 98.40 21 A 1 ATOM 167 O O . MET A 1 21 ? -7.272 14.350 4.273 1.00 97.99 21 A 1 ATOM 168 C CB . MET A 1 21 ? -4.687 15.794 5.770 1.00 98.36 21 A 1 ATOM 169 C CG . MET A 1 21 ? -4.134 17.204 6.000 1.00 97.61 21 A 1 ATOM 170 S SD . MET A 1 21 ? -4.629 18.444 4.765 1.00 97.51 21 A 1 ATOM 171 C CE . MET A 1 21 ? -3.578 17.957 3.373 1.00 94.02 21 A 1 ATOM 172 N N . ARG A 1 22 ? -6.658 13.308 6.158 1.00 98.56 22 A 1 ATOM 173 C CA . ARG A 1 22 ? -7.227 12.012 5.752 1.00 98.42 22 A 1 ATOM 174 C C . ARG A 1 22 ? -8.744 12.073 5.602 1.00 98.28 22 A 1 ATOM 175 O O . ARG A 1 22 ? -9.255 11.541 4.622 1.00 97.68 22 A 1 ATOM 176 C CB . ARG A 1 22 ? -6.840 10.908 6.736 1.00 98.09 22 A 1 ATOM 177 C CG . ARG A 1 22 ? -5.390 10.425 6.531 1.00 97.01 22 A 1 ATOM 178 C CD . ARG A 1 22 ? -5.109 9.175 7.349 1.00 96.58 22 A 1 ATOM 179 N NE . ARG A 1 22 ? -5.215 9.414 8.797 1.00 94.94 22 A 1 ATOM 180 C CZ . ARG A 1 22 ? -4.226 9.502 9.670 1.00 96.44 22 A 1 ATOM 181 N NH1 . ARG A 1 22 ? -2.973 9.392 9.330 1.00 88.98 22 A 1 ATOM 182 N NH2 . ARG A 1 22 ? -4.479 9.686 10.930 1.00 90.53 22 A 1 ATOM 183 N N . LYS A 1 23 ? -9.452 12.731 6.504 1.00 98.02 23 A 1 ATOM 184 C CA . LYS A 1 23 ? -10.910 12.885 6.401 1.00 97.63 23 A 1 ATOM 185 C C . LYS A 1 23 ? -11.331 13.640 5.144 1.00 97.50 23 A 1 ATOM 186 O O . LYS A 1 23 ? -12.334 13.285 4.536 1.00 96.44 23 A 1 ATOM 187 C CB . LYS A 1 23 ? -11.461 13.589 7.644 1.00 97.11 23 A 1 ATOM 188 C CG . LYS A 1 23 ? -11.442 12.659 8.869 1.00 93.75 23 A 1 ATOM 189 C CD . LYS A 1 23 ? -11.871 13.375 10.148 1.00 91.05 23 A 1 ATOM 190 C CE . LYS A 1 23 ? -13.372 13.702 10.091 1.00 83.02 23 A 1 ATOM 191 N NZ . LYS A 1 23 ? -13.889 14.049 11.430 1.00 77.49 23 A 1 ATOM 192 N N . ASP A 1 24 ? -10.555 14.647 4.748 1.00 97.86 24 A 1 ATOM 193 C CA . ASP A 1 24 ? -10.878 15.493 3.597 1.00 97.57 24 A 1 ATOM 194 C C . ASP A 1 24 ? -10.442 14.884 2.255 1.00 97.52 24 A 1 ATOM 195 O O . ASP A 1 24 ? -11.080 15.141 1.229 1.00 96.05 24 A 1 ATOM 196 C CB . ASP A 1 24 ? -10.223 16.872 3.783 1.00 97.03 24 A 1 ATOM 197 C CG . ASP A 1 24 ? -10.901 17.780 4.819 1.00 96.45 24 A 1 ATOM 198 O OD1 . ASP A 1 24 ? -11.910 17.396 5.450 1.00 94.00 24 A 1 ATOM 199 O OD2 . ASP A 1 24 ? -10.449 18.946 4.939 1.00 93.73 24 A 1 ATOM 200 N N . LEU A 1 25 ? -9.351 14.107 2.233 1.00 97.83 25 A 1 ATOM 201 C CA . LEU A 1 25 ? -8.651 13.748 0.990 1.00 97.65 25 A 1 ATOM 202 C C . LEU A 1 25 ? -8.445 12.249 0.761 1.00 97.32 25 A 1 ATOM 203 O O . LEU A 1 25 ? -8.303 11.825 -0.389 1.00 95.71 25 A 1 ATOM 204 C CB . LEU A 1 25 ? -7.275 14.429 0.987 1.00 97.53 25 A 1 ATOM 205 C CG . LEU A 1 25 ? -7.285 15.961 1.125 1.00 97.33 25 A 1 ATOM 206 C CD1 . LEU A 1 25 ? -5.844 16.439 1.272 1.00 96.35 25 A 1 ATOM 207 C CD2 . LEU A 1 25 ? -7.909 16.636 -0.097 1.00 96.03 25 A 1 ATOM 208 N N . SER A 1 26 ? -8.349 11.452 1.821 1.00 97.22 26 A 1 ATOM 209 C CA . SER A 1 26 ? -8.101 10.021 1.671 1.00 96.30 26 A 1 ATOM 210 C C . SER A 1 26 ? -9.372 9.304 1.235 1.00 94.61 26 A 1 ATOM 211 O O . SER A 1 26 ? -10.484 9.695 1.576 1.00 90.61 26 A 1 ATOM 212 C CB . SER A 1 26 ? -7.558 9.378 2.951 1.00 95.90 26 A 1 ATOM 213 O OG . SER A 1 26 ? -6.359 10.002 3.362 1.00 92.61 26 A 1 ATOM 214 N N . ASN A 1 27 ? -9.205 8.198 0.533 1.00 94.26 27 A 1 ATOM 215 C CA . ASN A 1 27 ? -10.323 7.311 0.219 1.00 91.90 27 A 1 ATOM 216 C C . ASN A 1 27 ? -10.957 6.784 1.516 1.00 91.68 27 A 1 ATOM 217 O O . ASN A 1 27 ? -10.266 6.545 2.502 1.00 88.30 27 A 1 ATOM 218 C CB . ASN A 1 27 ? -9.830 6.157 -0.669 1.00 88.68 27 A 1 ATOM 219 C CG . ASN A 1 27 ? -9.181 6.651 -1.947 1.00 81.42 27 A 1 ATOM 220 O OD1 . ASN A 1 27 ? -8.070 7.144 -1.953 1.00 74.19 27 A 1 ATOM 221 N ND2 . ASN A 1 27 ? -9.853 6.539 -3.070 1.00 73.94 27 A 1 ATOM 222 N N . GLN A 1 28 ? -12.272 6.533 1.474 1.00 90.41 28 A 1 ATOM 223 C CA . GLN A 1 28 ? -13.070 6.122 2.643 1.00 88.78 28 A 1 ATOM 224 C C . GLN A 1 28 ? -12.528 4.887 3.387 1.00 90.46 28 A 1 ATOM 225 O O . GLN A 1 28 ? -12.696 4.767 4.590 1.00 86.30 28 A 1 ATOM 226 C CB . GLN A 1 28 ? -14.522 5.883 2.187 1.00 84.65 28 A 1 ATOM 227 C CG . GLN A 1 28 ? -14.647 4.685 1.222 1.00 76.46 28 A 1 ATOM 228 C CD . GLN A 1 28 ? -16.054 4.483 0.668 1.00 70.32 28 A 1 ATOM 229 O OE1 . GLN A 1 28 ? -16.944 5.303 0.808 1.00 63.68 28 A 1 ATOM 230 N NE2 . GLN A 1 28 ? -16.283 3.373 -0.000 1.00 61.81 28 A 1 ATOM 231 N N . ASP A 1 29 ? -11.838 3.984 2.683 1.00 94.06 29 A 1 ATOM 232 C CA . ASP A 1 29 ? -11.284 2.766 3.282 1.00 94.93 29 A 1 ATOM 233 C C . ASP A 1 29 ? -9.933 2.999 3.989 1.00 96.02 29 A 1 ATOM 234 O O . ASP A 1 29 ? -9.502 2.172 4.795 1.00 94.99 29 A 1 ATOM 235 C CB . ASP A 1 29 ? -11.135 1.697 2.192 1.00 93.53 29 A 1 ATOM 236 C CG . ASP A 1 29 ? -12.458 1.297 1.538 1.00 91.72 29 A 1 ATOM 237 O OD1 . ASP A 1 29 ? -13.483 1.218 2.258 1.00 87.98 29 A 1 ATOM 238 O OD2 . ASP A 1 29 ? -12.439 1.048 0.313 1.00 87.47 29 A 1 ATOM 239 N N . ILE A 1 30 ? -9.241 4.110 3.694 1.00 96.99 30 A 1 ATOM 240 C CA . ILE A 1 30 ? -7.899 4.424 4.214 1.00 97.04 30 A 1 ATOM 241 C C . ILE A 1 30 ? -7.941 4.931 5.660 1.00 96.81 30 A 1 ATOM 242 O O . ILE A 1 30 ? -6.986 4.719 6.419 1.00 95.26 30 A 1 ATOM 243 C CB . ILE A 1 30 ? -7.194 5.424 3.264 1.00 96.73 30 A 1 ATOM 244 C CG1 . ILE A 1 30 ? -6.761 4.678 1.981 1.00 95.15 30 A 1 ATOM 245 C CG2 . ILE A 1 30 ? -5.986 6.123 3.920 1.00 94.67 30 A 1 ATOM 246 C CD1 . ILE A 1 30 ? -6.146 5.559 0.894 1.00 92.68 30 A 1 ATOM 247 N N . CYS A 1 31 ? -9.017 5.606 6.050 1.00 96.60 31 A 1 ATOM 248 C CA . CYS A 1 31 ? -9.183 6.129 7.400 1.00 96.25 31 A 1 ATOM 249 C C . CYS A 1 31 ? -10.517 5.701 8.017 1.00 95.82 31 A 1 ATOM 250 O O . CYS A 1 31 ? -11.471 5.346 7.323 1.00 94.45 31 A 1 ATOM 251 C CB . CYS A 1 31 ? -8.972 7.652 7.405 1.00 94.91 31 A 1 ATOM 252 S SG . CYS A 1 31 ? -10.278 8.519 6.476 1.00 94.51 31 A 1 ATOM 253 N N . LEU A 1 32 ? -10.565 5.740 9.349 1.00 95.68 32 A 1 ATOM 254 C CA . LEU A 1 32 ? -11.790 5.563 10.121 1.00 95.16 32 A 1 ATOM 255 C C . LEU A 1 32 ? -12.594 6.876 10.151 1.00 95.37 32 A 1 ATOM 256 O O . LEU A 1 32 ? -12.120 7.918 9.709 1.00 93.76 32 A 1 ATOM 257 C CB . LEU A 1 32 ? -11.423 5.064 11.531 1.00 94.06 32 A 1 ATOM 258 C CG . LEU A 1 32 ? -10.543 3.798 11.577 1.00 93.07 32 A 1 ATOM 259 C CD1 . LEU A 1 32 ? -10.275 3.406 13.030 1.00 88.89 32 A 1 ATOM 260 C CD2 . LEU A 1 32 ? -11.198 2.604 10.874 1.00 87.92 32 A 1 ATOM 261 N N . GLU A 1 33 ? -13.807 6.845 10.716 1.00 94.05 33 A 1 ATOM 262 C CA . GLU A 1 33 ? -14.690 8.024 10.768 1.00 94.10 33 A 1 ATOM 263 C C . GLU A 1 33 ? -14.066 9.234 11.486 1.00 95.31 33 A 1 ATOM 264 O O . GLU A 1 33 ? -14.298 10.384 11.107 1.00 94.10 33 A 1 ATOM 265 C CB . GLU A 1 33 ? -15.996 7.660 11.482 1.00 92.42 33 A 1 ATOM 266 C CG . GLU A 1 33 ? -16.856 6.663 10.692 1.00 81.40 33 A 1 ATOM 267 C CD . GLU A 1 33 ? -18.219 6.416 11.352 1.00 72.86 33 A 1 ATOM 268 O OE1 . GLU A 1 33 ? -19.085 5.836 10.663 1.00 64.87 33 A 1 ATOM 269 O OE2 . GLU A 1 33 ? -18.391 6.815 12.526 1.00 65.49 33 A 1 ATOM 270 N N . ASP A 1 34 ? -13.241 8.994 12.507 1.00 94.86 34 A 1 ATOM 271 C CA . ASP A 1 34 ? -12.521 10.041 13.239 1.00 95.22 34 A 1 ATOM 272 C C . ASP A 1 34 ? -11.257 10.543 12.506 1.00 96.50 34 A 1 ATOM 273 O O . ASP A 1 34 ? -10.579 11.457 12.982 1.00 95.45 34 A 1 ATOM 274 C CB . ASP A 1 34 ? -12.205 9.558 14.670 1.00 93.24 34 A 1 ATOM 275 C CG . ASP A 1 34 ? -10.986 8.640 14.743 1.00 90.35 34 A 1 ATOM 276 O OD1 . ASP A 1 34 ? -10.796 7.846 13.802 1.00 86.01 34 A 1 ATOM 277 O OD2 . ASP A 1 34 ? -10.187 8.796 15.701 1.00 85.45 34 A 1 ATOM 278 N N . GLY A 1 35 ? -10.930 9.964 11.351 1.00 95.62 35 A 1 ATOM 279 C CA . GLY A 1 35 ? -9.722 10.231 10.575 1.00 96.56 35 A 1 ATOM 280 C C . GLY A 1 35 ? -8.500 9.422 11.013 1.00 97.38 35 A 1 ATOM 281 O O . GLY A 1 35 ? -7.428 9.596 10.430 1.00 96.58 35 A 1 ATOM 282 N N . ALA A 1 36 ? -8.602 8.536 12.011 1.00 96.93 36 A 1 ATOM 283 C CA . ALA A 1 36 ? -7.517 7.619 12.346 1.00 96.52 36 A 1 ATOM 284 C C . ALA A 1 36 ? -7.194 6.702 11.157 1.00 96.75 36 A 1 ATOM 285 O O . ALA A 1 36 ? -8.058 6.372 10.347 1.00 95.85 36 A 1 ATOM 286 C CB . ALA A 1 36 ? -7.868 6.811 13.601 1.00 95.47 36 A 1 ATOM 287 N N . LEU A 1 37 ? -5.933 6.289 11.044 1.00 96.70 37 A 1 ATOM 288 C CA . LEU A 1 37 ? -5.502 5.424 9.946 1.00 96.98 37 A 1 ATOM 289 C C . LEU A 1 37 ? -6.140 4.030 10.069 1.00 96.96 37 A 1 ATOM 290 O O . LEU A 1 37 ? -6.041 3.376 11.105 1.00 95.76 37 A 1 ATOM 291 C CB . LEU A 1 37 ? -3.967 5.356 9.957 1.00 96.10 37 A 1 ATOM 292 C CG . LEU A 1 37 ? -3.379 4.704 8.689 1.00 93.66 37 A 1 ATOM 293 C CD1 . LEU A 1 37 ? -3.466 5.644 7.486 1.00 91.54 37 A 1 ATOM 294 C CD2 . LEU A 1 37 ? -1.910 4.374 8.925 1.00 91.05 37 A 1 ATOM 295 N N . ASN A 1 38 ? -6.750 3.550 8.996 1.00 96.49 38 A 1 ATOM 296 C CA . ASN A 1 38 ? -7.303 2.200 8.939 1.00 96.40 38 A 1 ATOM 297 C C . ASN A 1 38 ? -6.194 1.183 8.622 1.00 96.75 38 A 1 ATOM 298 O O . ASN A 1 38 ? -5.938 0.829 7.468 1.00 96.20 38 A 1 ATOM 299 C CB . ASN A 1 38 ? -8.464 2.155 7.936 1.00 95.62 38 A 1 ATOM 300 C CG . ASN A 1 38 ? -9.099 0.778 7.856 1.00 95.32 38 A 1 ATOM 301 O OD1 . ASN A 1 38 ? -8.814 -0.126 8.632 1.00 92.53 38 A 1 ATOM 302 N ND2 . ASN A 1 38 ? -9.976 0.575 6.897 1.00 92.09 38 A 1 ATOM 303 N N . HIS A 1 39 ? -5.532 0.677 9.651 1.00 96.39 39 A 1 ATOM 304 C CA . HIS A 1 39 ? -4.453 -0.301 9.490 1.00 96.38 39 A 1 ATOM 305 C C . HIS A 1 39 ? -4.890 -1.577 8.750 1.00 96.27 39 A 1 ATOM 306 O O . HIS A 1 39 ? -4.079 -2.169 8.036 1.00 95.01 39 A 1 ATOM 307 C CB . HIS A 1 39 ? -3.863 -0.641 10.859 1.00 96.07 39 A 1 ATOM 308 C CG . HIS A 1 39 ? -2.948 0.435 11.376 1.00 96.48 39 A 1 ATOM 309 N ND1 . HIS A 1 39 ? -1.629 0.621 10.993 1.00 90.77 39 A 1 ATOM 310 C CD2 . HIS A 1 39 ? -3.259 1.413 12.286 1.00 91.13 39 A 1 ATOM 311 C CE1 . HIS A 1 39 ? -1.161 1.686 11.664 1.00 92.18 39 A 1 ATOM 312 N NE2 . HIS A 1 39 ? -2.124 2.188 12.453 1.00 92.59 39 A 1 ATOM 313 N N . SER A 1 40 ? -6.152 -1.984 8.856 1.00 96.13 40 A 1 ATOM 314 C CA . SER A 1 40 ? -6.654 -3.192 8.185 1.00 95.32 40 A 1 ATOM 315 C C . SER A 1 40 ? -6.620 -3.080 6.653 1.00 95.81 40 A 1 ATOM 316 O O . SER A 1 40 ? -6.303 -4.055 5.972 1.00 94.66 40 A 1 ATOM 317 C CB . SER A 1 40 ? -8.058 -3.548 8.688 1.00 93.44 40 A 1 ATOM 318 O OG . SER A 1 40 ? -9.052 -2.693 8.171 1.00 82.55 40 A 1 ATOM 319 N N . TYR A 1 41 ? -6.825 -1.877 6.119 1.00 96.00 41 A 1 ATOM 320 C CA . TYR A 1 41 ? -6.674 -1.603 4.687 1.00 96.45 41 A 1 ATOM 321 C C . TYR A 1 41 ? -5.236 -1.860 4.207 1.00 96.62 41 A 1 ATOM 322 O O . TYR A 1 41 ? -5.007 -2.456 3.153 1.00 95.63 41 A 1 ATOM 323 C CB . TYR A 1 41 ? -7.096 -0.154 4.412 1.00 96.45 41 A 1 ATOM 324 C CG . TYR A 1 41 ? -6.893 0.279 2.977 1.00 96.94 41 A 1 ATOM 325 C CD1 . TYR A 1 41 ? -5.705 0.924 2.580 1.00 96.24 41 A 1 ATOM 326 C CD2 . TYR A 1 41 ? -7.897 0.032 2.018 1.00 96.44 41 A 1 ATOM 327 C CE1 . TYR A 1 41 ? -5.520 1.320 1.247 1.00 95.98 41 A 1 ATOM 328 C CE2 . TYR A 1 41 ? -7.721 0.429 0.683 1.00 95.90 41 A 1 ATOM 329 C CZ . TYR A 1 41 ? -6.531 1.072 0.301 1.00 96.17 41 A 1 ATOM 330 O OH . TYR A 1 41 ? -6.358 1.463 -1.003 1.00 95.10 41 A 1 ATOM 331 N N . PHE A 1 42 ? -4.246 -1.471 5.006 1.00 96.78 42 A 1 ATOM 332 C CA . PHE A 1 42 ? -2.832 -1.624 4.658 1.00 96.56 42 A 1 ATOM 333 C C . PHE A 1 42 ? -2.264 -3.019 4.958 1.00 95.90 42 A 1 ATOM 334 O O . PHE A 1 42 ? -1.248 -3.393 4.370 1.00 93.90 42 A 1 ATOM 335 C CB . PHE A 1 42 ? -2.021 -0.517 5.330 1.00 96.67 42 A 1 ATOM 336 C CG . PHE A 1 42 ? -2.366 0.856 4.797 1.00 97.08 42 A 1 ATOM 337 C CD1 . PHE A 1 42 ? -1.906 1.264 3.530 1.00 96.28 42 A 1 ATOM 338 C CD2 . PHE A 1 42 ? -3.180 1.719 5.548 1.00 96.37 42 A 1 ATOM 339 C CE1 . PHE A 1 42 ? -2.246 2.520 3.017 1.00 95.81 42 A 1 ATOM 340 C CE2 . PHE A 1 42 ? -3.525 2.983 5.040 1.00 95.86 42 A 1 ATOM 341 C CZ . PHE A 1 42 ? -3.059 3.379 3.774 1.00 96.18 42 A 1 ATOM 342 N N . LEU A 1 43 ? -2.916 -3.802 5.796 1.00 95.93 43 A 1 ATOM 343 C CA . LEU A 1 43 ? -2.601 -5.223 6.001 1.00 94.96 43 A 1 ATOM 344 C C . LEU A 1 43 ? -3.069 -6.095 4.829 1.00 94.15 43 A 1 ATOM 345 O O . LEU A 1 43 ? -2.511 -7.164 4.589 1.00 91.79 43 A 1 ATOM 346 C CB . LEU A 1 43 ? -3.244 -5.697 7.313 1.00 94.53 43 A 1 ATOM 347 C CG . LEU A 1 43 ? -2.561 -5.139 8.575 1.00 94.08 43 A 1 ATOM 348 C CD1 . LEU A 1 43 ? -3.411 -5.468 9.799 1.00 92.49 43 A 1 ATOM 349 C CD2 . LEU A 1 43 ? -1.162 -5.734 8.774 1.00 92.30 43 A 1 ATOM 350 N N . THR A 1 44 ? -4.061 -5.627 4.075 1.00 94.02 44 A 1 ATOM 351 C CA . THR A 1 44 ? -4.598 -6.344 2.915 1.00 92.99 44 A 1 ATOM 352 C C . THR A 1 44 ? -3.944 -5.844 1.625 1.00 93.14 44 A 1 ATOM 353 O O . THR A 1 44 ? -3.649 -4.664 1.475 1.00 91.01 44 A 1 ATOM 354 C CB . THR A 1 44 ? -6.124 -6.201 2.861 1.00 90.75 44 A 1 ATOM 355 O OG1 . THR A 1 44 ? -6.698 -6.490 4.114 1.00 80.69 44 A 1 ATOM 356 C CG2 . THR A 1 44 ? -6.736 -7.195 1.879 1.00 79.76 44 A 1 ATOM 357 N N . LYS A 1 45 ? -3.721 -6.737 0.657 1.00 91.06 45 A 1 ATOM 358 C CA . LYS A 1 45 ? -3.189 -6.328 -0.649 1.00 89.83 45 A 1 ATOM 359 C C . LYS A 1 45 ? -4.149 -5.355 -1.343 1.00 90.32 45 A 1 ATOM 360 O O . LYS A 1 45 ? -5.367 -5.458 -1.201 1.00 88.05 45 A 1 ATOM 361 C CB . LYS A 1 45 ? -2.922 -7.547 -1.536 1.00 86.97 45 A 1 ATOM 362 C CG . LYS A 1 45 ? -1.767 -8.408 -1.005 1.00 77.43 45 A 1 ATOM 363 C CD . LYS A 1 45 ? -1.543 -9.609 -1.927 1.00 72.57 45 A 1 ATOM 364 C CE . LYS A 1 45 ? -0.433 -10.505 -1.372 1.00 63.48 45 A 1 ATOM 365 N NZ . LYS A 1 45 ? -0.296 -11.750 -2.166 1.00 55.79 45 A 1 ATOM 366 N N . LYS A 1 46 ? -3.599 -4.458 -2.149 1.00 88.64 46 A 1 ATOM 367 C CA . LYS A 1 46 ? -4.400 -3.538 -2.959 1.00 87.23 46 A 1 ATOM 368 C C . LYS A 1 46 ? -5.443 -4.304 -3.779 1.00 87.62 46 A 1 ATOM 369 O O . LYS A 1 46 ? -5.122 -5.308 -4.410 1.00 81.35 46 A 1 ATOM 370 C CB . LYS A 1 46 ? -3.472 -2.713 -3.872 1.00 83.26 46 A 1 ATOM 371 C CG . LYS A 1 46 ? -4.270 -1.628 -4.600 1.00 77.66 46 A 1 ATOM 372 C CD . LYS A 1 46 ? -3.467 -0.936 -5.690 1.00 71.51 46 A 1 ATOM 373 C CE . LYS A 1 46 ? -4.440 0.002 -6.416 1.00 65.29 46 A 1 ATOM 374 N NZ . LYS A 1 46 ? -3.883 0.510 -7.679 1.00 57.47 46 A 1 ATOM 375 N N . GLY A 1 47 ? -6.681 -3.819 -3.768 1.00 86.30 47 A 1 ATOM 376 C CA . GLY A 1 47 ? -7.808 -4.439 -4.474 1.00 85.30 47 A 1 ATOM 377 C C . GLY A 1 47 ? -8.405 -5.678 -3.800 1.00 87.37 47 A 1 ATOM 378 O O . GLY A 1 47 ? -9.384 -6.212 -4.306 1.00 83.72 47 A 1 ATOM 379 N N . GLN A 1 48 ? -7.854 -6.124 -2.668 1.00 89.35 48 A 1 ATOM 380 C CA . GLN A 1 48 ? -8.350 -7.279 -1.906 1.00 89.90 48 A 1 ATOM 381 C C . GLN A 1 48 ? -8.939 -6.888 -0.540 1.00 92.17 48 A 1 ATOM 382 O O . GLN A 1 48 ? -9.317 -7.763 0.236 1.00 90.30 48 A 1 ATOM 383 C CB . GLN A 1 48 ? -7.232 -8.325 -1.738 1.00 87.09 48 A 1 ATOM 384 C CG . GLN A 1 48 ? -6.736 -8.873 -3.084 1.00 82.22 48 A 1 ATOM 385 C CD . GLN A 1 48 ? -5.729 -10.012 -2.940 1.00 76.05 48 A 1 ATOM 386 O OE1 . GLN A 1 48 ? -5.052 -10.204 -1.939 1.00 70.04 48 A 1 ATOM 387 N NE2 . GLN A 1 48 ? -5.575 -10.814 -3.971 1.00 66.92 48 A 1 ATOM 388 N N . TYR A 1 49 ? -9.012 -5.597 -0.238 1.00 92.14 49 A 1 ATOM 389 C CA . TYR A 1 49 ? -9.608 -5.132 1.012 1.00 94.02 49 A 1 ATOM 390 C C . TYR A 1 49 ? -11.117 -5.410 1.016 1.00 95.25 49 A 1 ATOM 391 O O . TYR A 1 49 ? -11.846 -4.987 0.115 1.00 94.65 49 A 1 ATOM 392 C CB . TYR A 1 49 ? -9.311 -3.645 1.228 1.00 93.68 49 A 1 ATOM 393 C CG . TYR A 1 49 ? -9.925 -3.105 2.503 1.00 94.52 49 A 1 ATOM 394 C CD1 . TYR A 1 49 ? -10.977 -2.167 2.452 1.00 93.16 49 A 1 ATOM 395 C CD2 . TYR A 1 49 ? -9.471 -3.559 3.755 1.00 93.28 49 A 1 ATOM 396 C CE1 . TYR A 1 49 ? -11.566 -1.688 3.631 1.00 93.00 49 A 1 ATOM 397 C CE2 . TYR A 1 49 ? -10.062 -3.091 4.944 1.00 92.87 49 A 1 ATOM 398 C CZ . TYR A 1 49 ? -11.108 -2.154 4.873 1.00 93.49 49 A 1 ATOM 399 O OH . TYR A 1 49 ? -11.688 -1.696 6.030 1.00 92.05 49 A 1 ATOM 400 N N . TRP A 1 50 ? -11.566 -6.130 2.041 1.00 95.12 50 A 1 ATOM 401 C CA . TRP A 1 50 ? -12.979 -6.440 2.233 1.00 95.97 50 A 1 ATOM 402 C C . TRP A 1 50 ? -13.652 -5.301 2.988 1.00 96.09 50 A 1 ATOM 403 O O . TRP A 1 50 ? -13.485 -5.164 4.204 1.00 94.95 50 A 1 ATOM 404 C CB . TRP A 1 50 ? -13.120 -7.771 2.956 1.00 96.19 50 A 1 ATOM 405 C CG . TRP A 1 50 ? -14.529 -8.275 2.982 1.00 96.71 50 A 1 ATOM 406 C CD1 . TRP A 1 50 ? -15.389 -8.203 4.022 1.00 95.91 50 A 1 ATOM 407 C CD2 . TRP A 1 50 ? -15.252 -8.929 1.892 1.00 96.89 50 A 1 ATOM 408 N NE1 . TRP A 1 50 ? -16.597 -8.794 3.668 1.00 96.27 50 A 1 ATOM 409 C CE2 . TRP A 1 50 ? -16.552 -9.249 2.372 1.00 96.83 50 A 1 ATOM 410 C CE3 . TRP A 1 50 ? -14.921 -9.286 0.568 1.00 97.08 50 A 1 ATOM 411 C CZ2 . TRP A 1 50 ? -17.503 -9.911 1.556 1.00 97.03 50 A 1 ATOM 412 C CZ3 . TRP A 1 50 ? -15.870 -9.940 -0.240 1.00 96.70 50 A 1 ATOM 413 C CH2 . TRP A 1 50 ? -17.146 -10.246 0.249 1.00 96.77 50 A 1 ATOM 414 N N . THR A 1 51 ? -14.409 -4.484 2.261 1.00 95.60 51 A 1 ATOM 415 C CA . THR A 1 51 ? -15.064 -3.298 2.823 1.00 95.63 51 A 1 ATOM 416 C C . THR A 1 51 ? -16.288 -3.671 3.672 1.00 96.05 51 A 1 ATOM 417 O O . THR A 1 51 ? -16.885 -4.736 3.466 1.00 95.94 51 A 1 ATOM 418 C CB . THR A 1 51 ? -15.474 -2.306 1.723 1.00 95.05 51 A 1 ATOM 419 O OG1 . THR A 1 51 ? -16.531 -2.817 0.950 1.00 92.02 51 A 1 ATOM 420 C CG2 . THR A 1 51 ? -14.332 -1.961 0.770 1.00 91.73 51 A 1 ATOM 421 N N . PRO A 1 52 ? -16.747 -2.787 4.570 1.00 95.15 52 A 1 ATOM 422 C CA . PRO A 1 52 ? -18.037 -2.961 5.249 1.00 95.09 52 A 1 ATOM 423 C C . PRO A 1 52 ? -19.215 -3.117 4.275 1.00 96.53 52 A 1 ATOM 424 O O . PRO A 1 52 ? -20.130 -3.897 4.535 1.00 96.40 52 A 1 ATOM 425 C CB . PRO A 1 52 ? -18.198 -1.713 6.127 1.00 93.35 52 A 1 ATOM 426 C CG . PRO A 1 52 ? -16.757 -1.276 6.395 1.00 90.41 52 A 1 ATOM 427 C CD . PRO A 1 52 ? -16.053 -1.609 5.080 1.00 93.04 52 A 1 ATOM 428 N N . LEU A 1 53 ? -19.164 -2.441 3.124 1.00 94.97 53 A 1 ATOM 429 C CA . LEU A 1 53 ? -20.166 -2.587 2.063 1.00 95.81 53 A 1 ATOM 430 C C . LEU A 1 53 ? -20.147 -3.996 1.457 1.00 97.29 53 A 1 ATOM 431 O O . LEU A 1 53 ? -21.202 -4.593 1.283 1.00 97.41 53 A 1 ATOM 432 C CB . LEU A 1 53 ? -19.936 -1.528 0.969 1.00 94.73 53 A 1 ATOM 433 C CG . LEU A 1 53 ? -20.226 -0.079 1.406 1.00 88.02 53 A 1 ATOM 434 C CD1 . LEU A 1 53 ? -19.811 0.879 0.287 1.00 83.14 53 A 1 ATOM 435 C CD2 . LEU A 1 53 ? -21.712 0.143 1.703 1.00 82.91 53 A 1 ATOM 436 N N . ASN A 1 54 ? -18.963 -4.558 1.213 1.00 97.16 54 A 1 ATOM 437 C CA . ASN A 1 54 ? -18.831 -5.936 0.736 1.00 97.64 54 A 1 ATOM 438 C C . ASN A 1 54 ? -19.375 -6.936 1.764 1.00 98.23 54 A 1 ATOM 439 O O . ASN A 1 54 ? -20.020 -7.913 1.395 1.00 98.30 54 A 1 ATOM 440 C CB . ASN A 1 54 ? -17.356 -6.246 0.447 1.00 97.26 54 A 1 ATOM 441 C CG . ASN A 1 54 ? -16.759 -5.498 -0.733 1.00 96.40 54 A 1 ATOM 442 O OD1 . ASN A 1 54 ? -17.411 -4.830 -1.505 1.00 90.05 54 A 1 ATOM 443 N ND2 . ASN A 1 54 ? -15.457 -5.604 -0.906 1.00 88.38 54 A 1 ATOM 444 N N . GLN A 1 55 ? -19.135 -6.690 3.051 1.00 97.56 55 A 1 ATOM 445 C CA . GLN A 1 55 ? -19.674 -7.534 4.119 1.00 97.93 55 A 1 ATOM 446 C C . GLN A 1 55 ? -21.205 -7.536 4.096 1.00 98.42 55 A 1 ATOM 447 O O . GLN A 1 55 ? -21.808 -8.609 4.087 1.00 98.40 55 A 1 ATOM 448 C CB . GLN A 1 55 ? -19.129 -7.055 5.471 1.00 97.31 55 A 1 ATOM 449 C CG . GLN A 1 55 ? -19.574 -7.941 6.648 1.00 95.70 55 A 1 ATOM 450 C CD . GLN A 1 55 ? -18.957 -9.340 6.646 1.00 96.39 55 A 1 ATOM 451 O OE1 . GLN A 1 55 ? -18.042 -9.669 5.907 1.00 91.82 55 A 1 ATOM 452 N NE2 . GLN A 1 55 ? -19.425 -10.209 7.510 1.00 90.56 55 A 1 ATOM 453 N N . LYS A 1 56 ? -21.826 -6.355 4.022 1.00 97.94 56 A 1 ATOM 454 C CA . LYS A 1 56 ? -23.285 -6.225 3.928 1.00 98.26 56 A 1 ATOM 455 C C . LYS A 1 56 ? -23.852 -6.843 2.651 1.00 98.59 56 A 1 ATOM 456 O O . LYS A 1 56 ? -24.867 -7.530 2.712 1.00 98.48 56 A 1 ATOM 457 C CB . LYS A 1 56 ? -23.684 -4.745 4.053 1.00 97.87 56 A 1 ATOM 458 C CG . LYS A 1 56 ? -23.603 -4.203 5.495 1.00 89.07 56 A 1 ATOM 459 C CD . LYS A 1 56 ? -24.654 -4.906 6.367 1.00 80.80 56 A 1 ATOM 460 C CE . LYS A 1 56 ? -24.758 -4.400 7.795 1.00 73.34 56 A 1 ATOM 461 N NZ . LYS A 1 56 ? -25.777 -5.211 8.526 1.00 61.85 56 A 1 ATOM 462 N N . ALA A 1 57 ? -23.185 -6.667 1.527 1.00 98.61 57 A 1 ATOM 463 C CA . ALA A 1 57 ? -23.572 -7.280 0.260 1.00 98.63 57 A 1 ATOM 464 C C . ALA A 1 57 ? -23.570 -8.816 0.349 1.00 98.75 57 A 1 ATOM 465 O O . ALA A 1 57 ? -24.537 -9.459 -0.051 1.00 98.64 57 A 1 ATOM 466 C CB . ALA A 1 57 ? -22.632 -6.760 -0.832 1.00 98.38 57 A 1 ATOM 467 N N . LEU A 1 58 ? -22.534 -9.412 0.954 1.00 98.81 58 A 1 ATOM 468 C CA . LEU A 1 58 ? -22.486 -10.863 1.150 1.00 98.84 58 A 1 ATOM 469 C C . LEU A 1 58 ? -23.603 -11.350 2.084 1.00 98.87 58 A 1 ATOM 470 O O . LEU A 1 58 ? -24.233 -12.363 1.793 1.00 98.78 58 A 1 ATOM 471 C CB . LEU A 1 58 ? -21.096 -11.257 1.664 1.00 98.74 58 A 1 ATOM 472 C CG . LEU A 1 58 ? -20.935 -12.762 1.937 1.00 98.47 58 A 1 ATOM 473 C CD1 . LEU A 1 58 ? -21.235 -13.636 0.719 1.00 98.11 58 A 1 ATOM 474 C CD2 . LEU A 1 58 ? -19.495 -13.045 2.374 1.00 98.10 58 A 1 ATOM 475 N N . GLN A 1 59 ? -23.863 -10.638 3.177 1.00 98.83 59 A 1 ATOM 476 C CA . GLN A 1 59 ? -24.928 -11.002 4.120 1.00 98.83 59 A 1 ATOM 477 C C . GLN A 1 59 ? -26.311 -10.968 3.453 1.00 98.84 59 A 1 ATOM 478 O O . GLN A 1 59 ? -27.049 -11.947 3.572 1.00 98.67 59 A 1 ATOM 479 C CB . GLN A 1 59 ? -24.871 -10.083 5.348 1.00 98.71 59 A 1 ATOM 480 C CG . GLN A 1 59 ? -23.662 -10.390 6.236 1.00 98.24 59 A 1 ATOM 481 C CD . GLN A 1 59 ? -23.675 -9.536 7.500 1.00 97.45 59 A 1 ATOM 482 O OE1 . GLN A 1 59 ? -23.184 -8.423 7.541 1.00 91.85 59 A 1 ATOM 483 N NE2 . GLN A 1 59 ? -24.246 -10.032 8.574 1.00 89.96 59 A 1 ATOM 484 N N . ARG A 1 60 ? -26.621 -9.934 2.672 1.00 98.78 60 A 1 ATOM 485 C CA . ARG A 1 60 ? -27.853 -9.872 1.867 1.00 98.69 60 A 1 ATOM 486 C C . ARG A 1 60 ? -27.915 -10.982 0.823 1.00 98.76 60 A 1 ATOM 487 O O . ARG A 1 60 ? -28.947 -11.620 0.673 1.00 98.47 60 A 1 ATOM 488 C CB . ARG A 1 60 ? -27.970 -8.530 1.147 1.00 98.13 60 A 1 ATOM 489 C CG . ARG A 1 60 ? -28.284 -7.355 2.078 1.00 90.69 60 A 1 ATOM 490 C CD . ARG A 1 60 ? -28.640 -6.120 1.263 1.00 90.90 60 A 1 ATOM 491 N NE . ARG A 1 60 ? -27.605 -5.787 0.274 1.00 83.74 60 A 1 ATOM 492 C CZ . ARG A 1 60 ? -26.755 -4.780 0.277 1.00 80.01 60 A 1 ATOM 493 N NH1 . ARG A 1 60 ? -26.780 -3.856 1.204 1.00 69.96 60 A 1 ATOM 494 N NH2 . ARG A 1 60 ? -25.871 -4.698 -0.672 1.00 71.82 60 A 1 ATOM 495 N N . GLY A 1 61 ? -26.812 -11.242 0.138 1.00 98.75 61 A 1 ATOM 496 C CA . GLY A 1 61 ? -26.746 -12.316 -0.850 1.00 98.73 61 A 1 ATOM 497 C C . GLY A 1 61 ? -27.057 -13.690 -0.253 1.00 98.79 61 A 1 ATOM 498 O O . GLY A 1 61 ? -27.774 -14.482 -0.860 1.00 98.63 61 A 1 ATOM 499 N N . ILE A 1 62 ? -26.573 -13.975 0.962 1.00 98.85 62 A 1 ATOM 500 C CA . ILE A 1 62 ? -26.899 -15.213 1.692 1.00 98.84 62 A 1 ATOM 501 C C . ILE A 1 62 ? -28.398 -15.285 2.007 1.00 98.84 62 A 1 ATOM 502 O O . ILE A 1 62 ? -28.998 -16.348 1.841 1.00 98.63 62 A 1 ATOM 503 C CB . ILE A 1 62 ? -26.044 -15.324 2.974 1.00 98.70 62 A 1 ATOM 504 C CG1 . ILE A 1 62 ? -24.564 -15.589 2.614 1.00 97.89 62 A 1 ATOM 505 C CG2 . ILE A 1 62 ? -26.551 -16.441 3.911 1.00 97.93 62 A 1 ATOM 506 C CD1 . ILE A 1 62 ? -23.604 -15.273 3.769 1.00 96.65 62 A 1 ATOM 507 N N . GLU A 1 63 ? -28.998 -14.171 2.425 1.00 98.82 63 A 1 ATOM 508 C CA . GLU A 1 63 ? -30.434 -14.108 2.723 1.00 98.75 63 A 1 ATOM 509 C C . GLU A 1 63 ? -31.306 -14.298 1.469 1.00 98.71 63 A 1 ATOM 510 O O . GLU A 1 63 ? -32.295 -15.036 1.483 1.00 98.22 63 A 1 ATOM 511 C CB . GLU A 1 63 ? -30.715 -12.766 3.415 1.00 98.44 63 A 1 ATOM 512 C CG . GLU A 1 63 ? -32.183 -12.599 3.816 1.00 96.04 63 A 1 ATOM 513 C CD . GLU A 1 63 ? -32.427 -11.365 4.697 1.00 95.31 63 A 1 ATOM 514 O OE1 . GLU A 1 63 ? -33.592 -11.182 5.115 1.00 89.40 63 A 1 ATOM 515 O OE2 . GLU A 1 63 ? -31.463 -10.625 4.992 1.00 90.82 63 A 1 ATOM 516 N N . LEU A 1 64 ? -30.912 -13.685 0.344 1.00 98.70 64 A 1 ATOM 517 C CA . LEU A 1 64 ? -31.684 -13.692 -0.900 1.00 98.59 64 A 1 ATOM 518 C C . LEU A 1 64 ? -31.560 -15.000 -1.685 1.00 98.65 64 A 1 ATOM 519 O O . LEU A 1 64 ? -32.560 -15.507 -2.206 1.00 98.13 64 A 1 ATOM 520 C CB . LEU A 1 64 ? -31.243 -12.500 -1.766 1.00 98.21 64 A 1 ATOM 521 C CG . LEU A 1 64 ? -31.641 -11.119 -1.207 1.00 96.03 64 A 1 ATOM 522 C CD1 . LEU A 1 64 ? -31.003 -10.030 -2.069 1.00 92.03 64 A 1 ATOM 523 C CD2 . LEU A 1 64 ? -33.157 -10.915 -1.209 1.00 91.63 64 A 1 ATOM 524 N N . PHE A 1 65 ? -30.349 -15.559 -1.772 1.00 98.70 65 A 1 ATOM 525 C CA . PHE A 1 65 ? -30.034 -16.689 -2.658 1.00 98.66 65 A 1 ATOM 526 C C . PHE A 1 65 ? -29.699 -17.979 -1.913 1.00 98.65 65 A 1 ATOM 527 O O . PHE A 1 65 ? -29.886 -19.067 -2.459 1.00 97.84 65 A 1 ATOM 528 C CB . PHE A 1 65 ? -28.919 -16.283 -3.623 1.00 98.48 65 A 1 ATOM 529 C CG . PHE A 1 65 ? -29.275 -15.084 -4.475 1.00 98.43 65 A 1 ATOM 530 C CD1 . PHE A 1 65 ? -30.142 -15.232 -5.576 1.00 97.45 65 A 1 ATOM 531 C CD2 . PHE A 1 65 ? -28.785 -13.807 -4.148 1.00 97.58 65 A 1 ATOM 532 C CE1 . PHE A 1 65 ? -30.519 -14.123 -6.338 1.00 96.86 65 A 1 ATOM 533 C CE2 . PHE A 1 65 ? -29.161 -12.689 -4.908 1.00 97.02 65 A 1 ATOM 534 C CZ . PHE A 1 65 ? -30.032 -12.849 -6.001 1.00 97.25 65 A 1 ATOM 535 N N . GLY A 1 66 ? -29.271 -17.890 -0.670 1.00 98.44 66 A 1 ATOM 536 C CA . GLY A 1 66 ? -28.876 -19.026 0.155 1.00 98.45 66 A 1 ATOM 537 C C . GLY A 1 66 ? -27.375 -19.313 0.132 1.00 98.57 66 A 1 ATOM 538 O O . GLY A 1 66 ? -26.654 -19.033 -0.827 1.00 97.92 66 A 1 ATOM 539 N N . VAL A 1 67 ? -26.895 -19.920 1.216 1.00 98.61 67 A 1 ATOM 540 C CA . VAL A 1 67 ? -25.497 -20.338 1.374 1.00 98.58 67 A 1 ATOM 541 C C . VAL A 1 67 ? -25.118 -21.325 0.265 1.00 98.48 67 A 1 ATOM 542 O O . VAL A 1 67 ? -25.858 -22.261 -0.031 1.00 97.74 67 A 1 ATOM 543 C CB . VAL A 1 67 ? -25.269 -20.967 2.760 1.00 98.22 67 A 1 ATOM 544 C CG1 . VAL A 1 67 ? -23.827 -21.442 2.950 1.00 97.28 67 A 1 ATOM 545 C CG2 . VAL A 1 67 ? -25.572 -19.970 3.888 1.00 97.38 67 A 1 ATOM 546 N N . GLY A 1 68 ? -23.941 -21.112 -0.343 1.00 97.77 68 A 1 ATOM 547 C CA . GLY A 1 68 ? -23.420 -21.969 -1.418 1.00 97.40 68 A 1 ATOM 548 C C . GLY A 1 68 ? -23.817 -21.531 -2.828 1.00 97.73 68 A 1 ATOM 549 O O . GLY A 1 68 ? -23.132 -21.900 -3.783 1.00 96.40 68 A 1 ATOM 550 N N . ASN A 1 69 ? -24.836 -20.684 -2.977 1.00 98.27 69 A 1 ATOM 551 C CA . ASN A 1 69 ? -25.265 -20.135 -4.270 1.00 98.40 69 A 1 ATOM 552 C C . ASN A 1 69 ? -24.383 -18.944 -4.696 1.00 98.51 69 A 1 ATOM 553 O O . ASN A 1 69 ? -24.833 -17.833 -4.970 1.00 97.91 69 A 1 ATOM 554 C CB . ASN A 1 69 ? -26.770 -19.838 -4.219 1.00 98.19 69 A 1 ATOM 555 C CG . ASN A 1 69 ? -27.590 -21.111 -4.086 1.00 97.26 69 A 1 ATOM 556 O OD1 . ASN A 1 69 ? -27.286 -22.153 -4.647 1.00 89.01 69 A 1 ATOM 557 N ND2 . ASN A 1 69 ? -28.661 -21.075 -3.332 1.00 88.00 69 A 1 ATOM 558 N N . TRP A 1 70 ? -23.069 -19.187 -4.734 1.00 98.35 70 A 1 ATOM 559 C CA . TRP A 1 70 ? -22.060 -18.142 -4.914 1.00 98.22 70 A 1 ATOM 560 C C . TRP A 1 70 ? -22.132 -17.435 -6.262 1.00 98.34 70 A 1 ATOM 561 O O . TRP A 1 70 ? -21.751 -16.270 -6.353 1.00 97.93 70 A 1 ATOM 562 C CB . TRP A 1 70 ? -20.663 -18.742 -4.738 1.00 97.66 70 A 1 ATOM 563 C CG . TRP A 1 70 ? -20.457 -19.534 -3.486 1.00 97.56 70 A 1 ATOM 564 C CD1 . TRP A 1 70 ? -19.946 -20.781 -3.421 1.00 96.61 70 A 1 ATOM 565 C CD2 . TRP A 1 70 ? -20.778 -19.158 -2.113 1.00 97.42 70 A 1 ATOM 566 N NE1 . TRP A 1 70 ? -19.924 -21.212 -2.106 1.00 96.18 70 A 1 ATOM 567 C CE2 . TRP A 1 70 ? -20.437 -20.249 -1.269 1.00 96.76 70 A 1 ATOM 568 C CE3 . TRP A 1 70 ? -21.335 -18.008 -1.506 1.00 96.68 70 A 1 ATOM 569 C CZ2 . TRP A 1 70 ? -20.653 -20.213 0.124 1.00 95.67 70 A 1 ATOM 570 C CZ3 . TRP A 1 70 ? -21.550 -17.972 -0.115 1.00 95.63 70 A 1 ATOM 571 C CH2 . TRP A 1 70 ? -21.215 -19.068 0.685 1.00 95.42 70 A 1 ATOM 572 N N . LYS A 1 71 ? -22.572 -18.116 -7.326 1.00 98.25 71 A 1 ATOM 573 C CA . LYS A 1 71 ? -22.677 -17.506 -8.657 1.00 98.08 71 A 1 ATOM 574 C C . LYS A 1 71 ? -23.770 -16.444 -8.687 1.00 98.29 71 A 1 ATOM 575 O O . LYS A 1 71 ? -23.529 -15.352 -9.185 1.00 97.75 71 A 1 ATOM 576 C CB . LYS A 1 71 ? -22.940 -18.568 -9.725 1.00 97.34 71 A 1 ATOM 577 C CG . LYS A 1 71 ? -21.711 -19.447 -9.990 1.00 86.51 71 A 1 ATOM 578 C CD . LYS A 1 71 ? -22.042 -20.430 -11.115 1.00 83.30 71 A 1 ATOM 579 C CE . LYS A 1 71 ? -20.847 -21.324 -11.435 1.00 70.47 71 A 1 ATOM 580 N NZ . LYS A 1 71 ? -21.190 -22.296 -12.500 1.00 60.91 71 A 1 ATOM 581 N N . GLU A 1 72 ? -24.923 -16.761 -8.121 1.00 98.37 72 A 1 ATOM 582 C CA . GLU A 1 72 ? -26.075 -15.873 -7.994 1.00 98.38 72 A 1 ATOM 583 C C . GLU A 1 72 ? -25.727 -14.676 -7.099 1.00 98.51 72 A 1 ATOM 584 O O . GLU A 1 72 ? -25.861 -13.533 -7.531 1.00 98.01 72 A 1 ATOM 585 C CB . GLU A 1 72 ? -27.271 -16.666 -7.435 1.00 97.93 72 A 1 ATOM 586 C CG . GLU A 1 72 ? -27.811 -17.784 -8.348 1.00 93.08 72 A 1 ATOM 587 C CD . GLU A 1 72 ? -27.024 -19.111 -8.368 1.00 87.01 72 A 1 ATOM 588 O OE1 . GLU A 1 72 ? -27.476 -20.034 -9.081 1.00 76.48 72 A 1 ATOM 589 O OE2 . GLU A 1 72 ? -25.952 -19.229 -7.724 1.00 76.60 72 A 1 ATOM 590 N N . ILE A 1 73 ? -25.157 -14.934 -5.919 1.00 98.64 73 A 1 ATOM 591 C CA . ILE A 1 73 ? -24.694 -13.884 -4.998 1.00 98.68 73 A 1 ATOM 592 C C . ILE A 1 73 ? -23.661 -12.976 -5.677 1.00 98.65 73 A 1 ATOM 593 O O . ILE A 1 73 ? -23.747 -11.753 -5.602 1.00 98.38 73 A 1 ATOM 594 C CB . ILE A 1 73 ? -24.113 -14.508 -3.707 1.00 98.62 73 A 1 ATOM 595 C CG1 . ILE A 1 73 ? -25.217 -15.252 -2.919 1.00 98.32 73 A 1 ATOM 596 C CG2 . ILE A 1 73 ? -23.449 -13.437 -2.818 1.00 98.28 73 A 1 ATOM 597 C CD1 . ILE A 1 73 ? -24.705 -16.091 -1.740 1.00 97.58 73 A 1 ATOM 598 N N . ASN A 1 74 ? -22.678 -13.562 -6.364 1.00 98.64 74 A 1 ATOM 599 C CA . ASN A 1 74 ? -21.636 -12.785 -7.032 1.00 98.52 74 A 1 ATOM 600 C C . ASN A 1 74 ? -22.204 -11.909 -8.157 1.00 98.44 74 A 1 ATOM 601 O O . ASN A 1 74 ? -21.779 -10.762 -8.317 1.00 97.87 74 A 1 ATOM 602 C CB . ASN A 1 74 ? -20.563 -13.753 -7.559 1.00 98.10 74 A 1 ATOM 603 C CG . ASN A 1 74 ? -19.324 -13.048 -8.095 1.00 97.80 74 A 1 ATOM 604 O OD1 . ASN A 1 74 ? -19.059 -11.881 -7.890 1.00 95.17 74 A 1 ATOM 605 N ND2 . ASN A 1 74 ? -18.482 -13.768 -8.803 1.00 94.38 74 A 1 ATOM 606 N N . TYR A 1 75 ? -23.152 -12.437 -8.939 1.00 98.43 75 A 1 ATOM 607 C CA . TYR A 1 75 ? -23.763 -11.695 -10.035 1.00 98.25 75 A 1 ATOM 608 C C . TYR A 1 75 ? -24.618 -10.528 -9.531 1.00 98.32 75 A 1 ATOM 609 O O . TYR A 1 75 ? -24.458 -9.411 -10.020 1.00 97.28 75 A 1 ATOM 610 C CB . TYR A 1 75 ? -24.574 -12.657 -10.906 1.00 97.57 75 A 1 ATOM 611 C CG . TYR A 1 75 ? -25.152 -11.987 -12.131 1.00 89.53 75 A 1 ATOM 612 C CD1 . TYR A 1 75 ? -26.481 -11.524 -12.131 1.00 82.45 75 A 1 ATOM 613 C CD2 . TYR A 1 75 ? -24.349 -11.781 -13.271 1.00 81.52 75 A 1 ATOM 614 C CE1 . TYR A 1 75 ? -27.008 -10.873 -13.254 1.00 75.30 75 A 1 ATOM 615 C CE2 . TYR A 1 75 ? -24.864 -11.129 -14.400 1.00 73.72 75 A 1 ATOM 616 C CZ . TYR A 1 75 ? -26.195 -10.677 -14.385 1.00 72.26 75 A 1 ATOM 617 O OH . TYR A 1 75 ? -26.707 -10.035 -15.486 1.00 72.35 75 A 1 ATOM 618 N N . ASP A 1 76 ? -25.456 -10.775 -8.532 1.00 98.13 76 A 1 ATOM 619 C CA . ASP A 1 76 ? -26.401 -9.786 -8.003 1.00 97.94 76 A 1 ATOM 620 C C . ASP A 1 76 ? -25.707 -8.729 -7.131 1.00 98.03 76 A 1 ATOM 621 O O . ASP A 1 76 ? -25.762 -7.532 -7.411 1.00 96.84 76 A 1 ATOM 622 C CB . ASP A 1 76 ? -27.493 -10.539 -7.240 1.00 97.36 76 A 1 ATOM 623 C CG . ASP A 1 76 ? -28.685 -9.644 -6.926 1.00 92.76 76 A 1 ATOM 624 O OD1 . ASP A 1 76 ? -29.427 -9.339 -7.890 1.00 84.52 76 A 1 ATOM 625 O OD2 . ASP A 1 76 ? -28.870 -9.314 -5.739 1.00 84.01 76 A 1 ATOM 626 N N . GLU A 1 77 ? -24.962 -9.158 -6.107 1.00 98.16 77 A 1 ATOM 627 C CA . GLU A 1 77 ? -24.400 -8.265 -5.088 1.00 98.08 77 A 1 ATOM 628 C C . GLU A 1 77 ? -23.005 -7.717 -5.429 1.00 97.96 77 A 1 ATOM 629 O O . GLU A 1 77 ? -22.592 -6.685 -4.898 1.00 96.37 77 A 1 ATOM 630 C CB . GLU A 1 77 ? -24.369 -8.994 -3.741 1.00 97.67 77 A 1 ATOM 631 C CG . GLU A 1 77 ? -25.766 -9.302 -3.173 1.00 95.60 77 A 1 ATOM 632 C CD . GLU A 1 77 ? -26.501 -8.056 -2.645 1.00 94.92 77 A 1 ATOM 633 O OE1 . GLU A 1 77 ? -27.712 -8.150 -2.391 1.00 87.02 77 A 1 ATOM 634 O OE2 . GLU A 1 77 ? -25.859 -7.009 -2.364 1.00 89.44 77 A 1 ATOM 635 N N . PHE A 1 78 ? -22.246 -8.398 -6.310 1.00 98.03 78 A 1 ATOM 636 C CA . PHE A 1 78 ? -20.856 -8.027 -6.622 1.00 97.88 78 A 1 ATOM 637 C C . PHE A 1 78 ? -20.602 -7.772 -8.112 1.00 97.47 78 A 1 ATOM 638 O O . PHE A 1 78 ? -19.445 -7.615 -8.529 1.00 95.07 78 A 1 ATOM 639 C CB . PHE A 1 78 ? -19.887 -9.067 -6.046 1.00 97.78 78 A 1 ATOM 640 C CG . PHE A 1 78 ? -19.960 -9.228 -4.546 1.00 98.16 78 A 1 ATOM 641 C CD1 . PHE A 1 78 ? -19.155 -8.436 -3.702 1.00 97.69 78 A 1 ATOM 642 C CD2 . PHE A 1 78 ? -20.847 -10.154 -3.969 1.00 97.78 78 A 1 ATOM 643 C CE1 . PHE A 1 78 ? -19.228 -8.574 -2.312 1.00 97.45 78 A 1 ATOM 644 C CE2 . PHE A 1 78 ? -20.930 -10.296 -2.575 1.00 97.56 78 A 1 ATOM 645 C CZ . PHE A 1 78 ? -20.119 -9.507 -1.746 1.00 97.85 78 A 1 ATOM 646 N N . SER A 1 79 ? -21.638 -7.725 -8.938 1.00 97.86 79 A 1 ATOM 647 C CA . SER A 1 79 ? -21.530 -7.561 -10.399 1.00 97.46 79 A 1 ATOM 648 C C . SER A 1 79 ? -20.601 -8.597 -11.062 1.00 97.60 79 A 1 ATOM 649 O O . SER A 1 79 ? -19.882 -8.283 -12.014 1.00 95.13 79 A 1 ATOM 650 C CB . SER A 1 79 ? -21.118 -6.127 -10.763 1.00 96.34 79 A 1 ATOM 651 O OG . SER A 1 79 ? -21.945 -5.153 -10.168 1.00 90.01 79 A 1 ATOM 652 N N . GLY A 1 80 ? -20.546 -9.806 -10.520 1.00 97.32 80 A 1 ATOM 653 C CA . GLY A 1 80 ? -19.697 -10.902 -10.997 1.00 97.15 80 A 1 ATOM 654 C C . GLY A 1 80 ? -18.194 -10.743 -10.733 1.00 97.10 80 A 1 ATOM 655 O O . GLY A 1 80 ? -17.401 -11.539 -11.245 1.00 95.03 80 A 1 ATOM 656 N N . LYS A 1 81 ? -17.771 -9.734 -9.965 1.00 96.65 81 A 1 ATOM 657 C CA . LYS A 1 81 ? -16.345 -9.391 -9.765 1.00 95.40 81 A 1 ATOM 658 C C . LYS A 1 81 ? -15.717 -10.038 -8.530 1.00 95.33 81 A 1 ATOM 659 O O . LYS A 1 81 ? -14.492 -10.013 -8.399 1.00 92.94 81 A 1 ATOM 660 C CB . LYS A 1 81 ? -16.183 -7.869 -9.701 1.00 93.90 81 A 1 ATOM 661 C CG . LYS A 1 81 ? -16.575 -7.185 -11.018 1.00 89.92 81 A 1 ATOM 662 C CD . LYS A 1 81 ? -16.408 -5.668 -10.890 1.00 81.78 81 A 1 ATOM 663 C CE . LYS A 1 81 ? -16.871 -4.996 -12.182 1.00 74.40 81 A 1 ATOM 664 N NZ . LYS A 1 81 ? -16.871 -3.521 -12.062 1.00 64.84 81 A 1 ATOM 665 N N . ALA A 1 82 ? -16.511 -10.579 -7.618 1.00 95.90 82 A 1 ATOM 666 C CA . ALA A 1 82 ? -15.993 -11.197 -6.404 1.00 95.95 82 A 1 ATOM 667 C C . ALA A 1 82 ? -15.312 -12.543 -6.702 1.00 95.79 82 A 1 ATOM 668 O O . ALA A 1 82 ? -15.661 -13.271 -7.633 1.00 94.40 82 A 1 ATOM 669 C CB . ALA A 1 82 ? -17.110 -11.333 -5.366 1.00 95.64 82 A 1 ATOM 670 N N . ASN A 1 83 ? -14.343 -12.896 -5.849 1.00 95.80 83 A 1 ATOM 671 C CA . ASN A 1 83 ? -13.770 -14.234 -5.845 1.00 95.31 83 A 1 ATOM 672 C C . ASN A 1 83 ? -14.714 -15.177 -5.078 1.00 95.99 83 A 1 ATOM 673 O O . ASN A 1 83 ? -14.879 -15.035 -3.869 1.00 95.22 83 A 1 ATOM 674 C CB . ASN A 1 83 ? -12.360 -14.156 -5.240 1.00 93.35 83 A 1 ATOM 675 C CG . ASN A 1 83 ? -11.649 -15.497 -5.208 1.00 90.44 83 A 1 ATOM 676 O OD1 . ASN A 1 83 ? -12.209 -16.560 -5.403 1.00 82.61 83 A 1 ATOM 677 N ND2 . ASN A 1 83 ? -10.361 -15.482 -4.943 1.00 80.74 83 A 1 ATOM 678 N N . ILE A 1 84 ? -15.286 -16.166 -5.765 1.00 94.45 84 A 1 ATOM 679 C CA . ILE A 1 84 ? -16.223 -17.139 -5.172 1.00 94.77 84 A 1 ATOM 680 C C . ILE A 1 84 ? -15.614 -17.864 -3.960 1.00 95.52 84 A 1 ATOM 681 O O . ILE A 1 84 ? -16.295 -18.084 -2.965 1.00 94.18 84 A 1 ATOM 682 C CB . ILE A 1 84 ? -16.694 -18.138 -6.255 1.00 92.35 84 A 1 ATOM 683 C CG1 . ILE A 1 84 ? -17.582 -17.405 -7.289 1.00 84.67 84 A 1 ATOM 684 C CG2 . ILE A 1 84 ? -17.437 -19.328 -5.639 1.00 81.15 84 A 1 ATOM 685 C CD1 . ILE A 1 84 ? -17.992 -18.265 -8.494 1.00 77.57 84 A 1 ATOM 686 N N . VAL A 1 85 ? -14.320 -18.190 -4.011 1.00 94.58 85 A 1 ATOM 687 C CA . VAL A 1 85 ? -13.622 -18.816 -2.874 1.00 94.01 85 A 1 ATOM 688 C C . VAL A 1 85 ? -13.587 -17.868 -1.676 1.00 95.00 85 A 1 ATOM 689 O O . VAL A 1 85 ? -13.769 -18.301 -0.542 1.00 94.59 85 A 1 ATOM 690 C CB . VAL A 1 85 ? -12.194 -19.244 -3.259 1.00 92.36 85 A 1 ATOM 691 C CG1 . VAL A 1 85 ? -11.450 -19.899 -2.092 1.00 87.55 85 A 1 ATOM 692 C CG2 . VAL A 1 85 ? -12.213 -20.246 -4.423 1.00 87.33 85 A 1 ATOM 693 N N . GLU A 1 86 ? -13.395 -16.571 -1.908 1.00 95.29 86 A 1 ATOM 694 C CA . GLU A 1 86 ? -13.451 -15.586 -0.832 1.00 95.68 86 A 1 ATOM 695 C C . GLU A 1 86 ? -14.860 -15.482 -0.241 1.00 96.43 86 A 1 ATOM 696 O O . GLU A 1 86 ? -14.985 -15.460 0.979 1.00 96.25 86 A 1 ATOM 697 C CB . GLU A 1 86 ? -12.912 -14.228 -1.296 1.00 94.92 86 A 1 ATOM 698 C CG . GLU A 1 86 ? -12.901 -13.226 -0.133 1.00 93.77 86 A 1 ATOM 699 C CD . GLU A 1 86 ? -12.107 -11.945 -0.388 1.00 93.57 86 A 1 ATOM 700 O OE1 . GLU A 1 86 ? -11.832 -11.257 0.630 1.00 89.30 86 A 1 ATOM 701 O OE2 . GLU A 1 86 ? -11.743 -11.661 -1.549 1.00 90.48 86 A 1 ATOM 702 N N . LEU A 1 87 ? -15.915 -15.507 -1.065 1.00 96.76 87 A 1 ATOM 703 C CA . LEU A 1 87 ? -17.302 -15.499 -0.577 1.00 97.53 87 A 1 ATOM 704 C C . LEU A 1 87 ? -17.572 -16.678 0.366 1.00 97.59 87 A 1 ATOM 705 O O . LEU A 1 87 ? -18.139 -16.487 1.442 1.00 97.46 87 A 1 ATOM 706 C CB . LEU A 1 87 ? -18.306 -15.514 -1.745 1.00 97.83 87 A 1 ATOM 707 C CG . LEU A 1 87 ? -18.228 -14.330 -2.725 1.00 97.31 87 A 1 ATOM 708 C CD1 . LEU A 1 87 ? -19.331 -14.461 -3.769 1.00 96.84 87 A 1 ATOM 709 C CD2 . LEU A 1 87 ? -18.374 -12.977 -2.030 1.00 96.43 87 A 1 ATOM 710 N N . GLU A 1 88 ? -17.096 -17.873 0.020 1.00 96.91 88 A 1 ATOM 711 C CA . GLU A 1 88 ? -17.216 -19.054 0.879 1.00 96.49 88 A 1 ATOM 712 C C . GLU A 1 88 ? -16.454 -18.878 2.203 1.00 96.99 88 A 1 ATOM 713 O O . GLU A 1 88 ? -17.002 -19.110 3.285 1.00 96.49 88 A 1 ATOM 714 C CB . GLU A 1 88 ? -16.717 -20.290 0.121 1.00 95.08 88 A 1 ATOM 715 C CG . GLU A 1 88 ? -17.049 -21.574 0.893 1.00 89.17 88 A 1 ATOM 716 C CD . GLU A 1 88 ? -16.458 -22.844 0.275 1.00 84.04 88 A 1 ATOM 717 O OE1 . GLU A 1 88 ? -16.436 -23.855 1.017 1.00 76.45 88 A 1 ATOM 718 O OE2 . GLU A 1 88 ? -16.003 -22.806 -0.886 1.00 76.65 88 A 1 ATOM 719 N N . LEU A 1 89 ? -15.200 -18.415 2.147 1.00 96.74 89 A 1 ATOM 720 C CA . LEU A 1 89 ? -14.380 -18.192 3.341 1.00 96.68 89 A 1 ATOM 721 C C . LEU A 1 89 ? -14.977 -17.112 4.254 1.00 97.21 89 A 1 ATOM 722 O O . LEU A 1 89 ? -15.013 -17.285 5.474 1.00 97.05 89 A 1 ATOM 723 C CB . LEU A 1 89 ? -12.953 -17.810 2.918 1.00 95.88 89 A 1 ATOM 724 C CG . LEU A 1 89 ? -12.150 -18.940 2.250 1.00 93.97 89 A 1 ATOM 725 C CD1 . LEU A 1 89 ? -10.814 -18.386 1.761 1.00 91.09 89 A 1 ATOM 726 C CD2 . LEU A 1 89 ? -11.871 -20.093 3.211 1.00 90.46 89 A 1 ATOM 727 N N . ARG A 1 90 ? -15.478 -16.021 3.677 1.00 97.73 90 A 1 ATOM 728 C CA . ARG A 1 90 ? -16.161 -14.947 4.413 1.00 97.82 90 A 1 ATOM 729 C C . ARG A 1 90 ? -17.451 -15.455 5.051 1.00 98.19 90 A 1 ATOM 730 O O . ARG A 1 90 ? -17.720 -15.129 6.201 1.00 97.98 90 A 1 ATOM 731 C CB . ARG A 1 90 ? -16.444 -13.768 3.476 1.00 97.30 90 A 1 ATOM 732 C CG . ARG A 1 90 ? -15.190 -13.046 2.955 1.00 95.35 90 A 1 ATOM 733 C CD . ARG A 1 90 ? -14.482 -12.214 4.013 1.00 93.78 90 A 1 ATOM 734 N NE . ARG A 1 90 ? -13.291 -11.586 3.415 1.00 92.19 90 A 1 ATOM 735 C CZ . ARG A 1 90 ? -12.383 -10.861 4.027 1.00 92.88 90 A 1 ATOM 736 N NH1 . ARG A 1 90 ? -12.469 -10.560 5.295 1.00 85.98 90 A 1 ATOM 737 N NH2 . ARG A 1 90 ? -11.350 -10.435 3.358 1.00 89.02 90 A 1 ATOM 738 N N . THR A 1 91 ? -18.194 -16.323 4.370 1.00 98.20 91 A 1 ATOM 739 C CA . THR A 1 91 ? -19.403 -16.954 4.924 1.00 98.46 91 A 1 ATOM 740 C C . THR A 1 91 ? -19.078 -17.876 6.094 1.00 98.46 91 A 1 ATOM 741 O O . THR A 1 91 ? -19.784 -17.851 7.100 1.00 98.27 91 A 1 ATOM 742 C CB . THR A 1 91 ? -20.182 -17.698 3.839 1.00 98.47 91 A 1 ATOM 743 O OG1 . THR A 1 91 ? -20.518 -16.778 2.827 1.00 97.08 91 A 1 ATOM 744 C CG2 . THR A 1 91 ? -21.486 -18.283 4.367 1.00 96.98 91 A 1 ATOM 745 N N . CYS A 1 92 ? -17.960 -18.610 6.051 1.00 98.24 92 A 1 ATOM 746 C CA . CYS A 1 92 ? -17.482 -19.349 7.223 1.00 98.03 92 A 1 ATOM 747 C C . CYS A 1 92 ? -17.271 -18.427 8.436 1.00 98.22 92 A 1 ATOM 748 O O . CYS A 1 92 ? -17.632 -18.783 9.556 1.00 97.95 92 A 1 ATOM 749 C CB . CYS A 1 92 ? -16.168 -20.078 6.897 1.00 97.42 92 A 1 ATOM 750 S SG . CYS A 1 92 ? -16.396 -21.385 5.658 1.00 96.17 92 A 1 ATOM 751 N N . MET A 1 93 ? -16.715 -17.231 8.229 1.00 98.06 93 A 1 ATOM 752 C CA . MET A 1 93 ? -16.536 -16.244 9.302 1.00 97.88 93 A 1 ATOM 753 C C . MET A 1 93 ? -17.864 -15.642 9.779 1.00 98.08 93 A 1 ATOM 754 O O . MET A 1 93 ? -18.029 -15.413 10.977 1.00 97.65 93 A 1 ATOM 755 C CB . MET A 1 93 ? -15.611 -15.119 8.841 1.00 97.19 93 A 1 ATOM 756 C CG . MET A 1 93 ? -14.177 -15.586 8.559 1.00 94.52 93 A 1 ATOM 757 S SD . MET A 1 93 ? -13.121 -14.268 7.890 1.00 90.25 93 A 1 ATOM 758 C CE . MET A 1 93 ? -13.201 -13.058 9.236 1.00 76.12 93 A 1 ATOM 759 N N . ILE A 1 94 ? -18.809 -15.400 8.863 1.00 98.42 94 A 1 ATOM 760 C CA . ILE A 1 94 ? -20.156 -14.896 9.181 1.00 98.51 94 A 1 ATOM 761 C C . ILE A 1 94 ? -20.896 -15.884 10.082 1.00 98.56 94 A 1 ATOM 762 O O . ILE A 1 94 ? -21.485 -15.471 11.080 1.00 98.38 94 A 1 ATOM 763 C CB . ILE A 1 94 ? -20.940 -14.586 7.885 1.00 98.48 94 A 1 ATOM 764 C CG1 . ILE A 1 94 ? -20.383 -13.303 7.231 1.00 98.10 94 A 1 ATOM 765 C CG2 . ILE A 1 94 ? -22.450 -14.421 8.148 1.00 97.97 94 A 1 ATOM 766 C CD1 . ILE A 1 94 ? -20.852 -13.092 5.787 1.00 97.30 94 A 1 ATOM 767 N N . LEU A 1 95 ? -20.808 -17.177 9.784 1.00 98.46 95 A 1 ATOM 768 C CA . LEU A 1 95 ? -21.491 -18.248 10.521 1.00 98.56 95 A 1 ATOM 769 C C . LEU A 1 95 ? -20.656 -18.839 11.671 1.00 98.51 95 A 1 ATOM 770 O O . LEU A 1 95 ? -21.136 -19.688 12.421 1.00 98.19 95 A 1 ATOM 771 C CB . LEU A 1 95 ? -21.950 -19.327 9.521 1.00 98.59 95 A 1 ATOM 772 C CG . LEU A 1 95 ? -22.899 -18.826 8.410 1.00 98.33 95 A 1 ATOM 773 C CD1 . LEU A 1 95 ? -23.295 -19.994 7.514 1.00 97.97 95 A 1 ATOM 774 C CD2 . LEU A 1 95 ? -24.178 -18.195 8.968 1.00 97.78 95 A 1 ATOM 775 N N . GLY A 1 96 ? -19.391 -18.414 11.825 1.00 98.08 96 A 1 ATOM 776 C CA . GLY A 1 96 ? -18.520 -18.839 12.926 1.00 97.99 96 A 1 ATOM 777 C C . GLY A 1 96 ? -18.103 -20.316 12.883 1.00 98.05 96 A 1 ATOM 778 O O . GLY A 1 96 ? -17.804 -20.897 13.925 1.00 97.10 96 A 1 ATOM 779 N N . ILE A 1 97 ? -18.070 -20.932 11.699 1.00 97.80 97 A 1 ATOM 780 C CA . ILE A 1 97 ? -17.738 -22.351 11.512 1.00 97.58 97 A 1 ATOM 781 C C . ILE A 1 97 ? -16.847 -22.557 10.282 1.00 97.22 97 A 1 ATOM 782 O O . ILE A 1 97 ? -16.978 -21.867 9.276 1.00 96.45 97 A 1 ATOM 783 C CB . ILE A 1 97 ? -19.035 -23.191 11.473 1.00 97.25 97 A 1 ATOM 784 C CG1 . ILE A 1 97 ? -18.729 -24.694 11.615 1.00 95.79 97 A 1 ATOM 785 C CG2 . ILE A 1 97 ? -19.867 -22.899 10.211 1.00 94.57 97 A 1 ATOM 786 C CD1 . ILE A 1 97 ? -19.983 -25.549 11.867 1.00 94.16 97 A 1 ATOM 787 N N . ASN A 1 98 ? -15.907 -23.508 10.350 1.00 96.14 98 A 1 ATOM 788 C CA . ASN A 1 98 ? -14.962 -23.764 9.258 1.00 94.97 98 A 1 ATOM 789 C C . ASN A 1 98 ? -15.549 -24.586 8.101 1.00 94.69 98 A 1 ATOM 790 O O . ASN A 1 98 ? -14.979 -24.582 7.013 1.00 92.92 98 A 1 ATOM 791 C CB . ASN A 1 98 ? -13.687 -24.419 9.818 1.00 93.37 98 A 1 ATOM 792 C CG . ASN A 1 98 ? -13.879 -25.859 10.266 1.00 93.21 98 A 1 ATOM 793 O OD1 . ASN A 1 98 ? -14.952 -26.301 10.618 1.00 87.65 98 A 1 ATOM 794 N ND2 . ASN A 1 98 ? -12.818 -26.634 10.279 1.00 87.40 98 A 1 ATOM 795 N N . ASP A 1 99 ? -16.658 -25.291 8.325 1.00 94.67 99 A 1 ATOM 796 C CA . ASP A 1 99 ? -17.378 -26.059 7.311 1.00 94.55 99 A 1 ATOM 797 C C . ASP A 1 99 ? -18.849 -25.646 7.320 1.00 95.56 99 A 1 ATOM 798 O O . ASP A 1 99 ? -19.565 -25.874 8.294 1.00 94.85 99 A 1 ATOM 799 C CB . ASP A 1 99 ? -17.194 -27.559 7.570 1.00 92.64 99 A 1 ATOM 800 C CG . ASP A 1 99 ? -17.902 -28.440 6.536 1.00 90.89 99 A 1 ATOM 801 O OD1 . ASP A 1 99 ? -18.489 -27.894 5.574 1.00 86.84 99 A 1 ATOM 802 O OD2 . ASP A 1 99 ? -17.876 -29.670 6.738 1.00 84.35 99 A 1 ATOM 803 N N . ILE A 1 100 ? -19.283 -25.021 6.231 1.00 95.54 100 A 1 ATOM 804 C CA . ILE A 1 100 ? -20.634 -24.471 6.066 1.00 96.19 100 A 1 ATOM 805 C C . ILE A 1 100 ? -21.535 -25.367 5.216 1.00 96.60 100 A 1 ATOM 806 O O . ILE A 1 100 ? -22.642 -24.963 4.877 1.00 95.99 100 A 1 ATOM 807 C CB . ILE A 1 100 ? -20.577 -23.026 5.534 1.00 95.95 100 A 1 ATOM 808 C CG1 . ILE A 1 100 ? -19.766 -22.937 4.220 1.00 94.50 100 A 1 ATOM 809 C CG2 . ILE A 1 100 ? -20.016 -22.104 6.630 1.00 92.92 100 A 1 ATOM 810 C CD1 . ILE A 1 100 ? -19.876 -21.576 3.538 1.00 93.86 100 A 1 ATOM 811 N N . THR A 1 101 ? -21.100 -26.580 4.895 1.00 95.70 101 A 1 ATOM 812 C CA . THR A 1 101 ? -21.840 -27.516 4.030 1.00 94.99 101 A 1 ATOM 813 C C . THR A 1 101 ? -23.247 -27.794 4.561 1.00 95.96 101 A 1 ATOM 814 O O . THR A 1 101 ? -24.202 -27.875 3.794 1.00 95.04 101 A 1 ATOM 815 C CB . THR A 1 101 ? -21.069 -28.838 3.888 1.00 92.42 101 A 1 ATOM 816 O OG1 . THR A 1 101 ? -19.742 -28.587 3.489 1.00 83.96 101 A 1 ATOM 817 C CG2 . THR A 1 101 ? -21.675 -29.764 2.839 1.00 81.58 101 A 1 ATOM 818 N N . GLU A 1 102 ? -23.418 -27.858 5.892 1.00 95.90 102 A 1 ATOM 819 C CA . GLU A 1 102 ? -24.729 -28.063 6.528 1.00 96.09 102 A 1 ATOM 820 C C . GLU A 1 102 ? -25.725 -26.908 6.320 1.00 97.23 102 A 1 ATOM 821 O O . GLU A 1 102 ? -26.927 -27.090 6.535 1.00 96.44 102 A 1 ATOM 822 C CB . GLU A 1 102 ? -24.532 -28.350 8.021 1.00 93.57 102 A 1 ATOM 823 C CG . GLU A 1 102 ? -24.114 -27.125 8.860 1.00 83.30 102 A 1 ATOM 824 C CD . GLU A 1 102 ? -23.849 -27.560 10.307 1.00 81.00 102 A 1 ATOM 825 O OE1 . GLU A 1 102 ? -22.668 -27.566 10.724 1.00 73.78 102 A 1 ATOM 826 O OE2 . GLU A 1 102 ? -24.791 -28.010 10.986 1.00 77.07 102 A 1 ATOM 827 N N . TYR A 1 103 ? -25.239 -25.737 5.896 1.00 97.36 103 A 1 ATOM 828 C CA . TYR A 1 103 ? -26.049 -24.551 5.610 1.00 98.03 103 A 1 ATOM 829 C C . TYR A 1 103 ? -26.354 -24.379 4.117 1.00 98.32 103 A 1 ATOM 830 O O . TYR A 1 103 ? -27.131 -23.496 3.766 1.00 97.86 103 A 1 ATOM 831 C CB . TYR A 1 103 ? -25.364 -23.302 6.186 1.00 98.04 103 A 1 ATOM 832 C CG . TYR A 1 103 ? -25.075 -23.389 7.669 1.00 98.18 103 A 1 ATOM 833 C CD1 . TYR A 1 103 ? -26.085 -23.118 8.613 1.00 97.33 103 A 1 ATOM 834 C CD2 . TYR A 1 103 ? -23.796 -23.773 8.118 1.00 97.45 103 A 1 ATOM 835 C CE1 . TYR A 1 103 ? -25.830 -23.239 9.988 1.00 96.99 103 A 1 ATOM 836 C CE2 . TYR A 1 103 ? -23.529 -23.902 9.493 1.00 97.17 103 A 1 ATOM 837 C CZ . TYR A 1 103 ? -24.552 -23.639 10.426 1.00 97.51 103 A 1 ATOM 838 O OH . TYR A 1 103 ? -24.301 -23.789 11.766 1.00 96.67 103 A 1 ATOM 839 N N . TYR A 1 104 ? -25.772 -25.195 3.238 1.00 97.56 104 A 1 ATOM 840 C CA . TYR A 1 104 ? -25.965 -25.051 1.796 1.00 97.53 104 A 1 ATOM 841 C C . TYR A 1 104 ? -27.450 -25.097 1.407 1.00 97.84 104 A 1 ATOM 842 O O . TYR A 1 104 ? -28.233 -25.896 1.922 1.00 96.39 104 A 1 ATOM 843 C CB . TYR A 1 104 ? -25.145 -26.089 1.019 1.00 96.20 104 A 1 ATOM 844 C CG . TYR A 1 104 ? -23.650 -25.838 0.891 1.00 93.84 104 A 1 ATOM 845 C CD1 . TYR A 1 104 ? -23.004 -24.746 1.506 1.00 87.03 104 A 1 ATOM 846 C CD2 . TYR A 1 104 ? -22.879 -26.718 0.097 1.00 86.66 104 A 1 ATOM 847 C CE1 . TYR A 1 104 ? -21.626 -24.527 1.338 1.00 84.74 104 A 1 ATOM 848 C CE2 . TYR A 1 104 ? -21.501 -26.509 -0.079 1.00 84.54 104 A 1 ATOM 849 C CZ . TYR A 1 104 ? -20.877 -25.414 0.545 1.00 85.15 104 A 1 ATOM 850 O OH . TYR A 1 104 ? -19.530 -25.208 0.368 1.00 82.60 104 A 1 ATOM 851 N N . GLY A 1 105 ? -27.826 -24.182 0.511 1.00 97.56 105 A 1 ATOM 852 C CA . GLY A 1 105 ? -29.204 -23.980 0.067 1.00 97.61 105 A 1 ATOM 853 C C . GLY A 1 105 ? -30.100 -23.229 1.057 1.00 98.10 105 A 1 ATOM 854 O O . GLY A 1 105 ? -31.196 -22.823 0.671 1.00 96.59 105 A 1 ATOM 855 N N . LYS A 1 106 ? -29.668 -23.009 2.300 1.00 98.26 106 A 1 ATOM 856 C CA . LYS A 1 106 ? -30.457 -22.265 3.284 1.00 98.33 106 A 1 ATOM 857 C C . LYS A 1 106 ? -30.306 -20.765 3.058 1.00 98.52 106 A 1 ATOM 858 O O . LYS A 1 106 ? -29.188 -20.250 3.028 1.00 98.02 106 A 1 ATOM 859 C CB . LYS A 1 106 ? -30.070 -22.641 4.719 1.00 97.87 106 A 1 ATOM 860 C CG . LYS A 1 106 ? -30.285 -24.130 5.019 1.00 94.98 106 A 1 ATOM 861 C CD . LYS A 1 106 ? -29.927 -24.431 6.481 1.00 90.68 106 A 1 ATOM 862 C CE . LYS A 1 106 ? -30.070 -25.926 6.760 1.00 83.68 106 A 1 ATOM 863 N NZ . LYS A 1 106 ? -29.512 -26.281 8.091 1.00 73.49 106 A 1 ATOM 864 N N . LYS A 1 107 ? -31.441 -20.082 2.951 1.00 98.62 107 A 1 ATOM 865 C CA . LYS A 1 107 ? -31.525 -18.621 3.022 1.00 98.69 107 A 1 ATOM 866 C C . LYS A 1 107 ? -31.603 -18.236 4.492 1.00 98.69 107 A 1 ATOM 867 O O . LYS A 1 107 ? -32.445 -18.782 5.206 1.00 98.08 107 A 1 ATOM 868 C CB . LYS A 1 107 ? -32.744 -18.114 2.249 1.00 98.45 107 A 1 ATOM 869 C CG . LYS A 1 107 ? -32.679 -18.483 0.766 1.00 97.87 107 A 1 ATOM 870 C CD . LYS A 1 107 ? -33.862 -17.862 0.024 1.00 96.95 107 A 1 ATOM 871 C CE . LYS A 1 107 ? -33.804 -18.235 -1.456 1.00 94.07 107 A 1 ATOM 872 N NZ . LYS A 1 107 ? -34.701 -17.359 -2.250 1.00 91.20 107 A 1 ATOM 873 N N . ILE A 1 108 ? -30.699 -17.382 4.940 1.00 98.70 108 A 1 ATOM 874 C CA . ILE A 1 108 ? -30.530 -17.049 6.357 1.00 98.75 108 A 1 ATOM 875 C C . ILE A 1 108 ? -30.491 -15.528 6.461 1.00 98.79 108 A 1 ATOM 876 O O . ILE A 1 108 ? -29.609 -14.912 5.855 1.00 98.57 108 A 1 ATOM 877 C CB . ILE A 1 108 ? -29.247 -17.687 6.935 1.00 98.59 108 A 1 ATOM 878 C CG1 . ILE A 1 108 ? -29.124 -19.197 6.616 1.00 97.65 108 A 1 ATOM 879 C CG2 . ILE A 1 108 ? -29.217 -17.473 8.454 1.00 97.46 108 A 1 ATOM 880 C CD1 . ILE A 1 108 ? -27.799 -19.833 7.068 1.00 97.06 108 A 1 ATOM 881 N N . SER A 1 109 ? -31.407 -14.941 7.224 1.00 98.80 109 A 1 ATOM 882 C CA . SER A 1 109 ? -31.436 -13.494 7.439 1.00 98.76 109 A 1 ATOM 883 C C . SER A 1 109 ? -30.171 -12.999 8.143 1.00 98.82 109 A 1 ATOM 884 O O . SER A 1 109 ? -29.466 -13.771 8.805 1.00 98.62 109 A 1 ATOM 885 C CB . SER A 1 109 ? -32.681 -13.100 8.242 1.00 98.36 109 A 1 ATOM 886 O OG . SER A 1 109 ? -32.618 -13.636 9.551 1.00 96.08 109 A 1 ATOM 887 N N . GLU A 1 110 ? -29.871 -11.704 8.051 1.00 98.56 110 A 1 ATOM 888 C CA . GLU A 1 110 ? -28.703 -11.124 8.735 1.00 98.31 110 A 1 ATOM 889 C C . GLU A 1 110 ? -28.742 -11.373 10.256 1.00 98.46 110 A 1 ATOM 890 O O . GLU A 1 110 ? -27.710 -11.669 10.861 1.00 97.98 110 A 1 ATOM 891 C CB . GLU A 1 110 ? -28.595 -9.606 8.475 1.00 97.14 110 A 1 ATOM 892 C CG . GLU A 1 110 ? -28.201 -9.220 7.038 1.00 87.86 110 A 1 ATOM 893 C CD . GLU A 1 110 ? -27.779 -7.742 6.885 1.00 83.67 110 A 1 ATOM 894 O OE1 . GLU A 1 110 ? -27.698 -7.248 5.739 1.00 75.65 110 A 1 ATOM 895 O OE2 . GLU A 1 110 ? -27.422 -7.061 7.881 1.00 78.07 110 A 1 ATOM 896 N N . GLU A 1 111 ? -29.919 -11.306 10.870 1.00 98.53 111 A 1 ATOM 897 C CA . GLU A 1 111 ? -30.106 -11.559 12.300 1.00 98.47 111 A 1 ATOM 898 C C . GLU A 1 111 ? -29.855 -13.035 12.647 1.00 98.60 111 A 1 ATOM 899 O O . GLU A 1 111 ? -29.082 -13.348 13.557 1.00 98.11 111 A 1 ATOM 900 C CB . GLU A 1 111 ? -31.513 -11.102 12.699 1.00 97.86 111 A 1 ATOM 901 C CG . GLU A 1 111 ? -31.729 -11.135 14.223 1.00 83.50 111 A 1 ATOM 902 C CD . GLU A 1 111 ? -33.080 -10.545 14.658 1.00 75.57 111 A 1 ATOM 903 O OE1 . GLU A 1 111 ? -33.244 -10.336 15.881 1.00 68.65 111 A 1 ATOM 904 O OE2 . GLU A 1 111 ? -33.939 -10.279 13.789 1.00 70.35 111 A 1 ATOM 905 N N . GLU A 1 112 ? -30.406 -13.962 11.867 1.00 98.68 112 A 1 ATOM 906 C CA . GLU A 1 112 ? -30.168 -15.399 12.040 1.00 98.62 112 A 1 ATOM 907 C C . GLU A 1 112 ? -28.700 -15.773 11.803 1.00 98.71 112 A 1 ATOM 908 O O . GLU A 1 112 ? -28.164 -16.622 12.515 1.00 98.44 112 A 1 ATOM 909 C CB . GLU A 1 112 ? -31.039 -16.203 11.072 1.00 98.17 112 A 1 ATOM 910 C CG . GLU A 1 112 ? -32.530 -16.212 11.437 1.00 82.62 112 A 1 ATOM 911 C CD . GLU A 1 112 ? -33.365 -16.819 10.299 1.00 74.66 112 A 1 ATOM 912 O OE1 . GLU A 1 112 ? -34.294 -17.596 10.601 1.00 67.99 112 A 1 ATOM 913 O OE2 . GLU A 1 112 ? -33.060 -16.517 9.120 1.00 71.14 112 A 1 ATOM 914 N N . GLN A 1 113 ? -28.017 -15.133 10.846 1.00 98.83 113 A 1 ATOM 915 C CA . GLN A 1 113 ? -26.583 -15.326 10.615 1.00 98.80 113 A 1 ATOM 916 C C . GLN A 1 113 ? -25.781 -15.005 11.883 1.00 98.78 113 A 1 ATOM 917 O O . GLN A 1 113 ? -24.872 -15.759 12.255 1.00 98.57 113 A 1 ATOM 918 C CB . GLN A 1 113 ? -26.094 -14.432 9.464 1.00 98.66 113 A 1 ATOM 919 C CG . GLN A 1 113 ? -26.577 -14.858 8.066 1.00 98.46 113 A 1 ATOM 920 C CD . GLN A 1 113 ? -26.269 -13.787 7.019 1.00 98.57 113 A 1 ATOM 921 O OE1 . GLN A 1 113 ? -25.230 -13.138 7.046 1.00 94.09 113 A 1 ATOM 922 N NE2 . GLN A 1 113 ? -27.142 -13.554 6.067 1.00 95.17 113 A 1 ATOM 923 N N . GLU A 1 114 ? -26.123 -13.922 12.566 1.00 98.52 114 A 1 ATOM 924 C CA . GLU A 1 114 ? -25.444 -13.508 13.790 1.00 98.27 114 A 1 ATOM 925 C C . GLU A 1 114 ? -25.731 -14.459 14.967 1.00 98.43 114 A 1 ATOM 926 O O . GLU A 1 114 ? -24.813 -14.821 15.710 1.00 97.95 114 A 1 ATOM 927 C CB . GLU A 1 114 ? -25.793 -12.045 14.093 1.00 97.32 114 A 1 ATOM 928 C CG . GLU A 1 114 ? -24.911 -11.513 15.231 1.00 81.92 114 A 1 ATOM 929 C CD . GLU A 1 114 ? -24.633 -10.007 15.185 1.00 69.57 114 A 1 ATOM 930 O OE1 . GLU A 1 114 ? -23.786 -9.595 16.015 1.00 63.53 114 A 1 ATOM 931 O OE2 . GLU A 1 114 ? -25.202 -9.285 14.342 1.00 63.58 114 A 1 ATOM 932 N N . GLU A 1 115 ? -26.961 -14.959 15.089 1.00 98.62 115 A 1 ATOM 933 C CA . GLU A 1 115 ? -27.325 -15.968 16.092 1.00 98.62 115 A 1 ATOM 934 C C . GLU A 1 115 ? -26.627 -17.313 15.843 1.00 98.67 115 A 1 ATOM 935 O O . GLU A 1 115 ? -26.063 -17.912 16.767 1.00 98.31 115 A 1 ATOM 936 C CB . GLU A 1 115 ? -28.850 -16.126 16.142 1.00 98.34 115 A 1 ATOM 937 C CG . GLU A 1 115 ? -29.545 -14.941 16.844 1.00 88.81 115 A 1 ATOM 938 C CD . GLU A 1 115 ? -28.980 -14.723 18.262 1.00 75.27 115 A 1 ATOM 939 O OE1 . GLU A 1 115 ? -28.561 -13.585 18.595 1.00 67.90 115 A 1 ATOM 940 O OE2 . GLU A 1 115 ? -28.855 -15.717 19.008 1.00 69.46 115 A 1 ATOM 941 N N . ILE A 1 116 ? -26.548 -17.761 14.590 1.00 98.70 116 A 1 ATOM 942 C CA . ILE A 1 116 ? -25.788 -18.962 14.213 1.00 98.66 116 A 1 ATOM 943 C C . ILE A 1 116 ? -24.314 -18.798 14.580 1.00 98.62 116 A 1 ATOM 944 O O . ILE A 1 116 ? -23.718 -19.711 15.160 1.00 98.35 116 A 1 ATOM 945 C CB . ILE A 1 116 ? -25.973 -19.273 12.713 1.00 98.57 116 A 1 ATOM 946 C CG1 . ILE A 1 116 ? -27.408 -19.798 12.462 1.00 98.03 116 A 1 ATOM 947 C CG2 . ILE A 1 116 ? -24.947 -20.316 12.227 1.00 97.97 116 A 1 ATOM 948 C CD1 . ILE A 1 116 ? -27.802 -19.819 10.983 1.00 96.77 116 A 1 ATOM 949 N N . LYS A 1 117 ? -23.715 -17.638 14.300 1.00 98.69 117 A 1 ATOM 950 C CA . LYS A 1 117 ? -22.326 -17.347 14.673 1.00 98.57 117 A 1 ATOM 951 C C . LYS A 1 117 ? -22.116 -17.454 16.181 1.00 98.57 117 A 1 ATOM 952 O O . LYS A 1 117 ? -21.184 -18.140 16.618 1.00 98.28 117 A 1 ATOM 953 C CB . LYS A 1 117 ? -21.936 -15.957 14.158 1.00 98.21 117 A 1 ATOM 954 C CG . LYS A 1 117 ? -20.468 -15.620 14.452 1.00 97.32 117 A 1 ATOM 955 C CD . LYS A 1 117 ? -20.140 -14.251 13.863 1.00 95.23 117 A 1 ATOM 956 C CE . LYS A 1 117 ? -18.666 -13.900 14.052 1.00 90.43 117 A 1 ATOM 957 N NZ . LYS A 1 117 ? -18.331 -12.677 13.284 1.00 84.89 117 A 1 ATOM 958 N N . LYS A 1 118 ? -22.968 -16.820 16.984 1.00 98.41 118 A 1 ATOM 959 C CA . LYS A 1 118 ? -22.901 -16.887 18.451 1.00 98.33 118 A 1 ATOM 960 C C . LYS A 1 118 ? -23.025 -18.330 18.945 1.00 98.37 118 A 1 ATOM 961 O O . LYS A 1 118 ? -22.210 -18.763 19.767 1.00 97.99 118 A 1 ATOM 962 C CB . LYS A 1 118 ? -24.010 -16.019 19.070 1.00 97.98 118 A 1 ATOM 963 C CG . LYS A 1 118 ? -23.779 -14.502 18.923 1.00 91.16 118 A 1 ATOM 964 C CD . LYS A 1 118 ? -25.044 -13.761 19.382 1.00 89.14 118 A 1 ATOM 965 C CE . LYS A 1 118 ? -25.047 -12.279 18.997 1.00 79.65 118 A 1 ATOM 966 N NZ . LYS A 1 118 ? -26.426 -11.721 19.045 1.00 71.56 118 A 1 ATOM 967 N N . SER A 1 119 ? -23.972 -19.089 18.402 1.00 98.48 119 A 1 ATOM 968 C CA . SER A 1 119 ? -24.189 -20.502 18.733 1.00 98.40 119 A 1 ATOM 969 C C . SER A 1 119 ? -22.964 -21.365 18.408 1.00 98.43 119 A 1 ATOM 970 O O . SER A 1 119 ? -22.466 -22.091 19.272 1.00 97.92 119 A 1 ATOM 971 C CB . SER A 1 119 ? -25.427 -21.007 17.989 1.00 97.96 119 A 1 ATOM 972 O OG . SER A 1 119 ? -25.698 -22.345 18.358 1.00 84.40 119 A 1 ATOM 973 N N . ASN A 1 120 ? -22.405 -21.226 17.210 1.00 98.50 120 A 1 ATOM 974 C CA . ASN A 1 120 ? -21.213 -21.965 16.787 1.00 98.43 120 A 1 ATOM 975 C C . ASN A 1 120 ? -19.982 -21.624 17.639 1.00 98.34 120 A 1 ATOM 976 O O . ASN A 1 120 ? -19.259 -22.527 18.064 1.00 97.88 120 A 1 ATOM 977 C CB . ASN A 1 120 ? -20.964 -21.706 15.291 1.00 98.28 120 A 1 ATOM 978 C CG . ASN A 1 120 ? -21.860 -22.549 14.395 1.00 98.25 120 A 1 ATOM 979 O OD1 . ASN A 1 120 ? -22.223 -23.667 14.718 1.00 95.65 120 A 1 ATOM 980 N ND2 . ASN A 1 120 ? -22.188 -22.054 13.219 1.00 95.43 120 A 1 ATOM 981 N N . ILE A 1 121 ? -19.762 -20.349 17.963 1.00 98.13 121 A 1 ATOM 982 C CA . ILE A 1 121 ? -18.672 -19.931 18.858 1.00 97.91 121 A 1 ATOM 983 C C . ILE A 1 121 ? -18.859 -20.519 20.265 1.00 98.00 121 A 1 ATOM 984 O O . ILE A 1 121 ? -17.902 -21.029 20.856 1.00 97.50 121 A 1 ATOM 985 C CB . ILE A 1 121 ? -18.553 -18.389 18.884 1.00 97.30 121 A 1 ATOM 986 C CG1 . ILE A 1 121 ? -18.008 -17.884 17.524 1.00 95.71 121 A 1 ATOM 987 C CG2 . ILE A 1 121 ? -17.642 -17.904 20.028 1.00 95.62 121 A 1 ATOM 988 C CD1 . ILE A 1 121 ? -18.046 -16.359 17.359 1.00 90.94 121 A 1 ATOM 989 N N . ALA A 1 122 ? -20.075 -20.486 20.811 1.00 98.21 122 A 1 ATOM 990 C CA . ALA A 1 122 ? -20.380 -21.066 22.118 1.00 98.25 122 A 1 ATOM 991 C C . ALA A 1 122 ? -20.136 -22.582 22.136 1.00 98.25 122 A 1 ATOM 992 O O . ALA A 1 122 ? -19.487 -23.097 23.051 1.00 97.65 122 A 1 ATOM 993 C CB . ALA A 1 122 ? -21.822 -20.717 22.491 1.00 98.03 122 A 1 ATOM 994 N N . LYS A 1 123 ? -20.570 -23.282 21.089 1.00 97.88 123 A 1 ATOM 995 C CA . LYS A 1 123 ? -20.322 -24.713 20.910 1.00 97.46 123 A 1 ATOM 996 C C . LYS A 1 123 ? -18.826 -25.014 20.817 1.00 97.59 123 A 1 ATOM 997 O O . LYS A 1 123 ? -18.339 -25.893 21.520 1.00 96.66 123 A 1 ATOM 998 C CB . LYS A 1 123 ? -21.091 -25.196 19.673 1.00 96.06 123 A 1 ATOM 999 C CG . LYS A 1 123 ? -21.014 -26.721 19.520 1.00 86.24 123 A 1 ATOM 1000 C CD . LYS A 1 123 ? -21.861 -27.169 18.327 1.00 85.42 123 A 1 ATOM 1001 C CE . LYS A 1 123 ? -21.780 -28.688 18.182 1.00 75.76 123 A 1 ATOM 1002 N NZ . LYS A 1 123 ? -22.587 -29.163 17.032 1.00 69.25 123 A 1 ATOM 1003 N N . GLY A 1 124 ? -18.087 -24.246 20.026 1.00 97.69 124 A 1 ATOM 1004 C CA . GLY A 1 124 ? -16.637 -24.378 19.891 1.00 97.46 124 A 1 ATOM 1005 C C . GLY A 1 124 ? -15.889 -24.187 21.208 1.00 97.59 124 A 1 ATOM 1006 O O . GLY A 1 124 ? -14.988 -24.969 21.514 1.00 96.86 124 A 1 ATOM 1007 N N . LYS A 1 125 ? -16.294 -23.220 22.032 1.00 97.72 125 A 1 ATOM 1008 C CA . LYS A 1 125 ? -15.757 -23.030 23.390 1.00 97.54 125 A 1 ATOM 1009 C C . LYS A 1 125 ? -16.053 -24.232 24.285 1.00 97.54 125 A 1 ATOM 1010 O O . LYS A 1 125 ? -15.142 -24.746 24.924 1.00 96.51 125 A 1 ATOM 1011 C CB . LYS A 1 125 ? -16.319 -21.748 24.028 1.00 96.95 125 A 1 ATOM 1012 C CG . LYS A 1 125 ? -15.689 -20.476 23.450 1.00 88.75 125 A 1 ATOM 1013 C CD . LYS A 1 125 ? -16.323 -19.228 24.077 1.00 87.67 125 A 1 ATOM 1014 C CE . LYS A 1 125 ? -15.691 -17.959 23.495 1.00 79.57 125 A 1 ATOM 1015 N NZ . LYS A 1 125 ? -16.290 -16.722 24.065 1.00 71.47 125 A 1 ATOM 1016 N N . LYS A 1 126 ? -17.301 -24.699 24.301 1.00 97.59 126 A 1 ATOM 1017 C CA . LYS A 1 126 ? -17.743 -25.826 25.141 1.00 97.56 126 A 1 ATOM 1018 C C . LYS A 1 126 ? -17.035 -27.134 24.786 1.00 97.49 126 A 1 ATOM 1019 O O . LYS A 1 126 ? -16.700 -27.912 25.675 1.00 96.12 126 A 1 ATOM 1020 C CB . LYS A 1 126 ? -19.267 -25.959 25.024 1.00 96.94 126 A 1 ATOM 1021 C CG . LYS A 1 126 ? -19.837 -27.004 26.001 1.00 87.80 126 A 1 ATOM 1022 C CD . LYS A 1 126 ? -21.363 -27.095 25.865 1.00 84.23 126 A 1 ATOM 1023 C CE . LYS A 1 126 ? -21.905 -28.151 26.834 1.00 72.67 126 A 1 ATOM 1024 N NZ . LYS A 1 126 ? -23.380 -28.302 26.723 1.00 63.74 126 A 1 ATOM 1025 N N . GLU A 1 127 ? -16.798 -27.378 23.501 1.00 97.37 127 A 1 ATOM 1026 C CA . GLU A 1 127 ? -16.137 -28.587 22.991 1.00 96.82 127 A 1 ATOM 1027 C C . GLU A 1 127 ? -14.605 -28.468 22.894 1.00 96.73 127 A 1 ATOM 1028 O O . GLU A 1 127 ? -13.947 -29.406 22.443 1.00 94.72 127 A 1 ATOM 1029 C CB . GLU A 1 127 ? -16.723 -28.961 21.624 1.00 95.45 127 A 1 ATOM 1030 C CG . GLU A 1 127 ? -18.193 -29.405 21.693 1.00 92.53 127 A 1 ATOM 1031 C CD . GLU A 1 127 ? -18.716 -29.875 20.327 1.00 92.61 127 A 1 ATOM 1032 O OE1 . GLU A 1 127 ? -19.948 -29.820 20.118 1.00 86.59 127 A 1 ATOM 1033 O OE2 . GLU A 1 127 ? -17.900 -30.310 19.474 1.00 88.95 127 A 1 ATOM 1034 N N . ASN A 1 128 ? -14.031 -27.333 23.286 1.00 96.92 128 A 1 ATOM 1035 C CA . ASN A 1 128 ? -12.608 -27.018 23.136 1.00 96.85 128 A 1 ATOM 1036 C C . ASN A 1 128 ? -12.113 -27.123 21.671 1.00 96.84 128 A 1 ATOM 1037 O O . ASN A 1 128 ? -10.988 -27.538 21.398 1.00 94.60 128 A 1 ATOM 1038 C CB . ASN A 1 128 ? -11.809 -27.831 24.173 1.00 96.04 128 A 1 ATOM 1039 C CG . ASN A 1 128 ? -10.628 -27.070 24.744 1.00 87.74 128 A 1 ATOM 1040 O OD1 . ASN A 1 128 ? -10.529 -25.860 24.684 1.00 78.82 128 A 1 ATOM 1041 N ND2 . ASN A 1 128 ? -9.707 -27.775 25.368 1.00 76.61 128 A 1 ATOM 1042 N N . LYS A 1 129 ? -12.970 -26.741 20.728 1.00 96.92 129 A 1 ATOM 1043 C CA . LYS A 1 129 ? -12.748 -26.772 19.269 1.00 96.88 129 A 1 ATOM 1044 C C . LYS A 1 129 ? -12.898 -25.384 18.639 1.00 97.10 129 A 1 ATOM 1045 O O . LYS A 1 129 ? -13.320 -25.258 17.494 1.00 95.61 129 A 1 ATOM 1046 C CB . LYS A 1 129 ? -13.694 -27.785 18.616 1.00 95.76 129 A 1 ATOM 1047 C CG . LYS A 1 129 ? -13.406 -29.243 18.984 1.00 93.16 129 A 1 ATOM 1048 C CD . LYS A 1 129 ? -14.472 -30.107 18.303 1.00 88.48 129 A 1 ATOM 1049 C CE . LYS A 1 129 ? -14.454 -31.549 18.799 1.00 82.43 129 A 1 ATOM 1050 N NZ . LYS A 1 129 ? -15.762 -32.186 18.489 1.00 73.31 129 A 1 ATOM 1051 N N . LEU A 1 130 ? -12.590 -24.332 19.389 1.00 96.52 130 A 1 ATOM 1052 C CA . LEU A 1 130 ? -12.603 -22.964 18.879 1.00 96.53 130 A 1 ATOM 1053 C C . LEU A 1 130 ? -11.181 -22.537 18.522 1.00 96.19 130 A 1 ATOM 1054 O O . LEU A 1 130 ? -10.279 -22.616 19.352 1.00 94.46 130 A 1 ATOM 1055 C CB . LEU A 1 130 ? -13.245 -22.031 19.912 1.00 95.67 130 A 1 ATOM 1056 C CG . LEU A 1 130 ? -13.584 -20.643 19.322 1.00 94.26 130 A 1 ATOM 1057 C CD1 . LEU A 1 130 ? -14.828 -20.708 18.436 1.00 91.77 130 A 1 ATOM 1058 C CD2 . LEU A 1 130 ? -13.851 -19.645 20.442 1.00 91.73 130 A 1 ATOM 1059 N N . LYS A 1 131 ? -10.989 -22.052 17.291 1.00 96.57 131 A 1 ATOM 1060 C CA . LYS A 1 131 ? -9.724 -21.473 16.843 1.00 96.17 131 A 1 ATOM 1061 C C . LYS A 1 131 ? -10.017 -20.247 15.994 1.00 96.55 131 A 1 ATOM 1062 O O . LYS A 1 131 ? -10.870 -20.310 15.116 1.00 95.51 131 A 1 ATOM 1063 C CB . LYS A 1 131 ? -8.926 -22.531 16.073 1.00 94.47 131 A 1 ATOM 1064 C CG . LYS A 1 131 ? -7.525 -22.038 15.709 1.00 87.32 131 A 1 ATOM 1065 C CD . LYS A 1 131 ? -6.785 -23.102 14.900 1.00 83.09 131 A 1 ATOM 1066 C CE . LYS A 1 131 ? -5.424 -22.557 14.480 1.00 74.61 131 A 1 ATOM 1067 N NZ . LYS A 1 131 ? -4.731 -23.498 13.571 1.00 66.19 131 A 1 ATOM 1068 N N . ASP A 1 132 ? -9.335 -19.136 16.262 1.00 96.39 132 A 1 ATOM 1069 C CA . ASP A 1 132 ? -9.498 -17.876 15.527 1.00 96.43 132 A 1 ATOM 1070 C C . ASP A 1 132 ? -10.971 -17.391 15.454 1.00 96.55 132 A 1 ATOM 1071 O O . ASP A 1 132 ? -11.416 -16.867 14.440 1.00 94.74 132 A 1 ATOM 1072 C CB . ASP A 1 132 ? -8.790 -17.980 14.156 1.00 95.88 132 A 1 ATOM 1073 C CG . ASP A 1 132 ? -7.324 -18.413 14.287 1.00 95.07 132 A 1 ATOM 1074 O OD1 . ASP A 1 132 ? -6.602 -17.805 15.108 1.00 91.04 132 A 1 ATOM 1075 O OD2 . ASP A 1 132 ? -6.916 -19.388 13.611 1.00 91.63 132 A 1 ATOM 1076 N N . ASN A 1 133 ? -11.737 -17.591 16.531 1.00 95.94 133 A 1 ATOM 1077 C CA . ASN A 1 133 ? -13.193 -17.370 16.617 1.00 95.80 133 A 1 ATOM 1078 C C . ASN A 1 133 ? -14.046 -18.204 15.636 1.00 96.77 133 A 1 ATOM 1079 O O . ASN A 1 133 ? -15.198 -17.864 15.375 1.00 94.77 133 A 1 ATOM 1080 C CB . ASN A 1 133 ? -13.525 -15.866 16.574 1.00 93.60 133 A 1 ATOM 1081 C CG . ASN A 1 133 ? -13.089 -15.122 17.821 1.00 89.70 133 A 1 ATOM 1082 O OD1 . ASN A 1 133 ? -13.105 -15.644 18.922 1.00 79.76 133 A 1 ATOM 1083 N ND2 . ASN A 1 133 ? -12.730 -13.865 17.682 1.00 78.52 133 A 1 ATOM 1084 N N . ILE A 1 134 ? -13.515 -19.318 15.154 1.00 96.72 134 A 1 ATOM 1085 C CA . ILE A 1 134 ? -14.192 -20.258 14.258 1.00 96.96 134 A 1 ATOM 1086 C C . ILE A 1 134 ? -14.316 -21.618 14.948 1.00 97.17 134 A 1 ATOM 1087 O O . ILE A 1 134 ? -13.323 -22.186 15.414 1.00 96.32 134 A 1 ATOM 1088 C CB . ILE A 1 134 ? -13.430 -20.357 12.917 1.00 95.98 134 A 1 ATOM 1089 C CG1 . ILE A 1 134 ? -13.266 -18.994 12.197 1.00 92.97 134 A 1 ATOM 1090 C CG2 . ILE A 1 134 ? -14.078 -21.374 11.972 1.00 93.56 134 A 1 ATOM 1091 C CD1 . ILE A 1 134 ? -14.571 -18.324 11.749 1.00 87.75 134 A 1 ATOM 1092 N N . TYR A 1 135 ? -15.533 -22.170 14.981 1.00 97.38 135 A 1 ATOM 1093 C CA . TYR A 1 135 ? -15.766 -23.545 15.413 1.00 97.38 135 A 1 ATOM 1094 C C . TYR A 1 135 ? -15.132 -24.521 14.416 1.00 97.10 135 A 1 ATOM 1095 O O . TYR A 1 135 ? -15.440 -24.508 13.224 1.00 96.26 135 A 1 ATOM 1096 C CB . TYR A 1 135 ? -17.264 -23.791 15.588 1.00 97.12 135 A 1 ATOM 1097 C CG . TYR A 1 135 ? -17.618 -25.230 15.921 1.00 97.12 135 A 1 ATOM 1098 C CD1 . TYR A 1 135 ? -18.448 -25.975 15.059 1.00 95.06 135 A 1 ATOM 1099 C CD2 . TYR A 1 135 ? -17.114 -25.840 17.086 1.00 95.28 135 A 1 ATOM 1100 C CE1 . TYR A 1 135 ? -18.776 -27.305 15.364 1.00 94.84 135 A 1 ATOM 1101 C CE2 . TYR A 1 135 ? -17.434 -27.173 17.391 1.00 94.52 135 A 1 ATOM 1102 C CZ . TYR A 1 135 ? -18.270 -27.902 16.531 1.00 94.91 135 A 1 ATOM 1103 O OH . TYR A 1 135 ? -18.597 -29.198 16.833 1.00 93.07 135 A 1 ATOM 1104 N N . GLN A 1 136 ? -14.235 -25.365 14.904 1.00 96.12 136 A 1 ATOM 1105 C CA . GLN A 1 136 ? -13.511 -26.342 14.102 1.00 95.15 136 A 1 ATOM 1106 C C . GLN A 1 136 ? -14.326 -27.635 13.998 1.00 94.74 136 A 1 ATOM 1107 O O . GLN A 1 136 ? -14.107 -28.594 14.745 1.00 92.11 136 A 1 ATOM 1108 C CB . GLN A 1 136 ? -12.114 -26.586 14.685 1.00 93.57 136 A 1 ATOM 1109 C CG . GLN A 1 136 ? -11.262 -25.316 14.821 1.00 89.88 136 A 1 ATOM 1110 C CD . GLN A 1 136 ? -10.992 -24.638 13.477 1.00 89.22 136 A 1 ATOM 1111 O OE1 . GLN A 1 136 ? -10.379 -25.196 12.587 1.00 80.32 136 A 1 ATOM 1112 N NE2 . GLN A 1 136 ? -11.433 -23.415 13.306 1.00 79.28 136 A 1 ATOM 1113 N N . LYS A 1 137 ? -15.270 -27.650 13.064 1.00 91.14 137 A 1 ATOM 1114 C CA . LYS A 1 137 ? -15.951 -28.889 12.688 1.00 88.02 137 A 1 ATOM 1115 C C . LYS A 1 137 ? -14.974 -29.740 11.880 1.00 84.54 137 A 1 ATOM 1116 O O . LYS A 1 137 ? -14.367 -29.257 10.924 1.00 75.73 137 A 1 ATOM 1117 C CB . LYS A 1 137 ? -17.243 -28.561 11.933 1.00 83.65 137 A 1 ATOM 1118 C CG . LYS A 1 137 ? -18.159 -29.780 11.746 1.00 76.98 137 A 1 ATOM 1119 C CD . LYS A 1 137 ? -19.458 -29.331 11.061 1.00 72.75 137 A 1 ATOM 1120 C CE . LYS A 1 137 ? -20.430 -30.483 10.802 1.00 65.36 137 A 1 ATOM 1121 N NZ . LYS A 1 137 ? -21.626 -29.991 10.075 1.00 59.28 137 A 1 ATOM 1122 N N . LEU A 1 138 ? -14.796 -31.005 12.288 1.00 81.40 138 A 1 ATOM 1123 C CA . LEU A 1 138 ? -14.049 -31.971 11.490 1.00 76.62 138 A 1 ATOM 1124 C C . LEU A 1 138 ? -14.829 -32.183 10.194 1.00 74.68 138 A 1 ATOM 1125 O O . LEU A 1 138 ? -15.972 -32.636 10.245 1.00 65.64 138 A 1 ATOM 1126 C CB . LEU A 1 138 ? -13.870 -33.286 12.267 1.00 69.61 138 A 1 ATOM 1127 C CG . LEU A 1 138 ? -12.861 -33.188 13.422 1.00 61.58 138 A 1 ATOM 1128 C CD1 . LEU A 1 138 ? -12.993 -34.406 14.341 1.00 56.72 138 A 1 ATOM 1129 C CD2 . LEU A 1 138 ? -11.413 -33.130 12.922 1.00 55.90 138 A 1 ATOM 1130 N N . GLN A 1 139 ? -14.220 -31.836 9.056 1.00 71.99 139 A 1 ATOM 1131 C CA . GLN A 1 139 ? -14.754 -32.275 7.772 1.00 66.49 139 A 1 ATOM 1132 C C . GLN A 1 139 ? -14.740 -33.803 7.791 1.00 64.10 139 A 1 ATOM 1133 O O . GLN A 1 139 ? -13.686 -34.417 7.965 1.00 56.79 139 A 1 ATOM 1134 C CB . GLN A 1 139 ? -13.936 -31.707 6.603 1.00 59.16 139 A 1 ATOM 1135 C CG . GLN A 1 139 ? -14.272 -30.227 6.351 1.00 53.04 139 A 1 ATOM 1136 C CD . GLN A 1 139 ? -13.524 -29.638 5.157 1.00 49.09 139 A 1 ATOM 1137 O OE1 . GLN A 1 139 ? -12.373 -29.931 4.895 1.00 45.61 139 A 1 ATOM 1138 N NE2 . GLN A 1 139 ? -14.145 -28.757 4.403 1.00 44.03 139 A 1 ATOM 1139 N N . GLN A 1 140 ? -15.919 -34.407 7.667 1.00 54.32 140 A 1 ATOM 1140 C CA . GLN A 1 140 ? -15.963 -35.798 7.252 1.00 51.69 140 A 1 ATOM 1141 C C . GLN A 1 140 ? -15.377 -35.805 5.843 1.00 50.34 140 A 1 ATOM 1142 O O . GLN A 1 140 ? -16.007 -35.310 4.912 1.00 45.51 140 A 1 ATOM 1143 C CB . GLN A 1 140 ? -17.398 -36.343 7.289 1.00 47.02 140 A 1 ATOM 1144 C CG . GLN A 1 140 ? -17.869 -36.617 8.728 1.00 41.90 140 A 1 ATOM 1145 C CD . GLN A 1 140 ? -19.278 -37.223 8.797 1.00 38.47 140 A 1 ATOM 1146 O OE1 . GLN A 1 140 ? -20.060 -37.185 7.867 1.00 36.30 140 A 1 ATOM 1147 N NE2 . GLN A 1 140 ? -19.659 -37.791 9.918 1.00 34.88 140 A 1 ATOM 1148 N N . MET A 1 141 ? -14.147 -36.319 5.712 1.00 48.54 141 A 1 ATOM 1149 C CA . MET A 1 141 ? -13.668 -36.761 4.408 1.00 46.31 141 A 1 ATOM 1150 C C . MET A 1 141 ? -14.626 -37.868 3.976 1.00 45.20 141 A 1 ATOM 1151 O O . MET A 1 141 ? -14.571 -38.972 4.521 1.00 42.05 141 A 1 ATOM 1152 C CB . MET A 1 141 ? -12.224 -37.273 4.483 1.00 43.56 141 A 1 ATOM 1153 C CG . MET A 1 141 ? -11.211 -36.161 4.780 1.00 40.51 141 A 1 ATOM 1154 S SD . MET A 1 141 ? -9.460 -36.644 4.570 1.00 38.67 141 A 1 ATOM 1155 C CE . MET A 1 141 ? -9.294 -37.948 5.817 1.00 36.43 141 A 1 ATOM 1156 N N . GLN A 1 142 ? -15.580 -37.510 3.113 1.00 36.67 142 A 1 ATOM 1157 C CA . GLN A 1 142 ? -16.346 -38.506 2.375 1.00 35.04 142 A 1 ATOM 1158 C C . GLN A 1 142 ? -15.454 -39.144 1.300 1.00 32.48 142 A 1 ATOM 1159 O O . GLN A 1 142 ? -14.601 -38.429 0.732 1.00 29.37 142 A 1 ATOM 1160 C CB . GLN A 1 142 ? -17.609 -37.896 1.756 1.00 32.97 142 A 1 ATOM 1161 C CG . GLN A 1 142 ? -18.679 -37.597 2.823 1.00 31.01 142 A 1 ATOM 1162 C CD . GLN A 1 142 ? -20.042 -37.225 2.218 1.00 28.69 142 A 1 ATOM 1163 O OE1 . GLN A 1 142 ? -20.230 -37.061 1.019 1.00 28.09 142 A 1 ATOM 1164 N NE2 . GLN A 1 142 ? -21.065 -37.092 3.026 1.00 27.45 142 A 1 ATOM 1165 O OXT . GLN A 1 142 ? -15.664 -40.351 1.063 1.00 27.37 142 A 1 ATOM 1166 N N . ASP B 2 1 ? -3.819 -29.516 -23.970 1.00 54.45 1 B 1 ATOM 1167 C CA . ASP B 2 1 ? -3.233 -30.876 -24.027 1.00 60.22 1 B 1 ATOM 1168 C C . ASP B 2 1 ? -2.213 -31.126 -22.927 1.00 63.54 1 B 1 ATOM 1169 O O . ASP B 2 1 ? -2.506 -31.902 -22.026 1.00 60.19 1 B 1 ATOM 1170 C CB . ASP B 2 1 ? -2.730 -31.202 -25.435 1.00 56.20 1 B 1 ATOM 1171 C CG . ASP B 2 1 ? -3.892 -31.096 -26.418 1.00 51.34 1 B 1 ATOM 1172 O OD1 . ASP B 2 1 ? -5.029 -30.953 -25.898 1.00 48.35 1 B 1 ATOM 1173 O OD2 . ASP B 2 1 ? -3.641 -31.012 -27.625 1.00 46.42 1 B 1 ATOM 1174 N N . ASP B 2 2 ? -1.110 -30.410 -22.887 1.00 66.23 2 B 1 ATOM 1175 C CA . ASP B 2 2 ? 0.039 -30.624 -21.975 1.00 69.87 2 B 1 ATOM 1176 C C . ASP B 2 2 ? -0.304 -30.673 -20.465 1.00 71.57 2 B 1 ATOM 1177 O O . ASP B 2 2 ? 0.414 -31.263 -19.655 1.00 67.26 2 B 1 ATOM 1178 C CB . ASP B 2 2 ? 1.035 -29.481 -22.248 1.00 64.46 2 B 1 ATOM 1179 C CG . ASP B 2 2 ? 2.490 -29.924 -22.369 1.00 58.06 2 B 1 ATOM 1180 O OD1 . ASP B 2 2 ? 2.724 -31.075 -22.777 1.00 54.22 2 B 1 ATOM 1181 O OD2 . ASP B 2 2 ? 3.361 -29.091 -22.028 1.00 53.11 2 B 1 ATOM 1182 N N . TYR B 2 3 ? -1.423 -30.065 -20.050 1.00 77.84 3 B 1 ATOM 1183 C CA . TYR B 2 3 ? -1.865 -30.114 -18.649 1.00 78.27 3 B 1 ATOM 1184 C C . TYR B 2 3 ? -2.465 -31.476 -18.268 1.00 79.22 3 B 1 ATOM 1185 O O . TYR B 2 3 ? -2.288 -31.932 -17.138 1.00 76.41 3 B 1 ATOM 1186 C CB . TYR B 2 3 ? -2.863 -28.978 -18.382 1.00 73.85 3 B 1 ATOM 1187 C CG . TYR B 2 3 ? -2.700 -28.364 -17.012 1.00 66.96 3 B 1 ATOM 1188 C CD1 . TYR B 2 3 ? -3.365 -28.895 -15.890 1.00 62.02 3 B 1 ATOM 1189 C CD2 . TYR B 2 3 ? -1.848 -27.248 -16.849 1.00 60.69 3 B 1 ATOM 1190 C CE1 . TYR B 2 3 ? -3.191 -28.318 -14.623 1.00 55.90 3 B 1 ATOM 1191 C CE2 . TYR B 2 3 ? -1.671 -26.664 -15.587 1.00 56.13 3 B 1 ATOM 1192 C CZ . TYR B 2 3 ? -2.345 -27.201 -14.473 1.00 54.01 3 B 1 ATOM 1193 O OH . TYR B 2 3 ? -2.175 -26.629 -13.235 1.00 51.67 3 B 1 ATOM 1194 N N . LEU B 2 4 ? -3.149 -32.136 -19.209 1.00 82.35 4 B 1 ATOM 1195 C CA . LEU B 2 4 ? -3.729 -33.473 -19.020 1.00 82.70 4 B 1 ATOM 1196 C C . LEU B 2 4 ? -2.644 -34.547 -18.907 1.00 82.84 4 B 1 ATOM 1197 O O . LEU B 2 4 ? -2.774 -35.455 -18.089 1.00 78.88 4 B 1 ATOM 1198 C CB . LEU B 2 4 ? -4.692 -33.790 -20.178 1.00 80.18 4 B 1 ATOM 1199 C CG . LEU B 2 4 ? -6.045 -33.060 -20.078 1.00 74.79 4 B 1 ATOM 1200 C CD1 . LEU B 2 4 ? -6.771 -33.122 -21.421 1.00 71.15 4 B 1 ATOM 1201 C CD2 . LEU B 2 4 ? -6.948 -33.709 -19.026 1.00 70.70 4 B 1 ATOM 1202 N N . ASP B 2 5 ? -1.541 -34.401 -19.643 1.00 80.42 5 B 1 ATOM 1203 C CA . ASP B 2 5 ? -0.418 -35.351 -19.590 1.00 80.89 5 B 1 ATOM 1204 C C . ASP B 2 5 ? 0.330 -35.344 -18.250 1.00 81.38 5 B 1 ATOM 1205 O O . ASP B 2 5 ? 0.994 -36.325 -17.896 1.00 78.26 5 B 1 ATOM 1206 C CB . ASP B 2 5 ? 0.551 -35.075 -20.745 1.00 77.87 5 B 1 ATOM 1207 C CG . ASP B 2 5 ? 0.145 -35.788 -22.033 1.00 70.81 5 B 1 ATOM 1208 O OD1 . ASP B 2 5 ? -0.415 -36.908 -21.928 1.00 65.78 5 B 1 ATOM 1209 O OD2 . ASP B 2 5 ? 0.454 -35.238 -23.107 1.00 63.69 5 B 1 ATOM 1210 N N . ARG B 2 6 ? 0.193 -34.271 -17.466 1.00 81.15 6 B 1 ATOM 1211 C CA . ARG B 2 6 ? 0.762 -34.172 -16.109 1.00 81.14 6 B 1 ATOM 1212 C C . ARG B 2 6 ? -0.138 -34.778 -15.031 1.00 82.67 6 B 1 ATOM 1213 O O . ARG B 2 6 ? 0.299 -34.893 -13.883 1.00 79.51 6 B 1 ATOM 1214 C CB . ARG B 2 6 ? 1.095 -32.714 -15.779 1.00 77.63 6 B 1 ATOM 1215 C CG . ARG B 2 6 ? 2.182 -32.163 -16.697 1.00 70.95 6 B 1 ATOM 1216 C CD . ARG B 2 6 ? 2.496 -30.722 -16.309 1.00 66.45 6 B 1 ATOM 1217 N NE . ARG B 2 6 ? 3.332 -30.075 -17.322 1.00 60.06 6 B 1 ATOM 1218 C CZ . ARG B 2 6 ? 4.027 -28.957 -17.194 1.00 54.44 6 B 1 ATOM 1219 N NH1 . ARG B 2 6 ? 4.080 -28.307 -16.060 1.00 50.47 6 B 1 ATOM 1220 N NH2 . ARG B 2 6 ? 4.664 -28.482 -18.227 1.00 48.07 6 B 1 ATOM 1221 N N . LEU B 2 7 ? -1.373 -35.119 -15.357 1.00 86.37 7 B 1 ATOM 1222 C CA . LEU B 2 7 ? -2.264 -35.761 -14.400 1.00 86.35 7 B 1 ATOM 1223 C C . LEU B 2 7 ? -1.842 -37.223 -14.191 1.00 86.52 7 B 1 ATOM 1224 O O . LEU B 2 7 ? -1.482 -37.916 -15.145 1.00 84.40 7 B 1 ATOM 1225 C CB . LEU B 2 7 ? -3.728 -35.649 -14.849 1.00 84.29 7 B 1 ATOM 1226 C CG . LEU B 2 7 ? -4.305 -34.226 -14.728 1.00 79.16 7 B 1 ATOM 1227 C CD1 . LEU B 2 7 ? -5.663 -34.163 -15.428 1.00 75.59 7 B 1 ATOM 1228 C CD2 . LEU B 2 7 ? -4.514 -33.811 -13.269 1.00 74.73 7 B 1 ATOM 1229 N N . PRO B 2 8 ? -1.923 -37.711 -12.944 1.00 83.18 8 B 1 ATOM 1230 C CA . PRO B 2 8 ? -1.681 -39.125 -12.676 1.00 82.91 8 B 1 ATOM 1231 C C . PRO B 2 8 ? -2.601 -39.997 -13.541 1.00 84.77 8 B 1 ATOM 1232 O O . PRO B 2 8 ? -3.826 -39.870 -13.491 1.00 82.65 8 B 1 ATOM 1233 C CB . PRO B 2 8 ? -1.954 -39.315 -11.181 1.00 78.73 8 B 1 ATOM 1234 C CG . PRO B 2 8 ? -1.798 -37.920 -10.587 1.00 77.69 8 B 1 ATOM 1235 C CD . PRO B 2 8 ? -2.245 -36.999 -11.718 1.00 80.62 8 B 1 ATOM 1236 N N . LYS B 2 9 ? -2.025 -40.927 -14.299 1.00 83.24 9 B 1 ATOM 1237 C CA . LYS B 2 9 ? -2.794 -41.821 -15.191 1.00 83.11 9 B 1 ATOM 1238 C C . LYS B 2 9 ? -3.485 -42.968 -14.442 1.00 85.05 9 B 1 ATOM 1239 O O . LYS B 2 9 ? -4.332 -43.658 -15.001 1.00 80.73 9 B 1 ATOM 1240 C CB . LYS B 2 9 ? -1.901 -42.329 -16.342 1.00 78.66 9 B 1 ATOM 1241 C CG . LYS B 2 9 ? -1.424 -41.178 -17.248 1.00 74.26 9 B 1 ATOM 1242 C CD . LYS B 2 9 ? -0.716 -41.656 -18.529 1.00 66.92 9 B 1 ATOM 1243 C CE . LYS B 2 9 ? -0.348 -40.410 -19.358 1.00 63.06 9 B 1 ATOM 1244 N NZ . LYS B 2 9 ? 0.247 -40.697 -20.688 1.00 55.64 9 B 1 ATOM 1245 N N . SER B 2 10 ? -3.133 -43.180 -13.169 1.00 86.08 10 B 1 ATOM 1246 C CA . SER B 2 10 ? -3.749 -44.216 -12.339 1.00 86.78 10 B 1 ATOM 1247 C C . SER B 2 10 ? -4.819 -43.630 -11.414 1.00 88.41 10 B 1 ATOM 1248 O O . SER B 2 10 ? -4.656 -42.535 -10.872 1.00 86.90 10 B 1 ATOM 1249 C CB . SER B 2 10 ? -2.691 -45.001 -11.556 1.00 83.92 10 B 1 ATOM 1250 O OG . SER B 2 10 ? -2.192 -44.269 -10.454 1.00 77.57 10 B 1 ATOM 1251 N N . LYS B 2 11 ? -5.892 -44.404 -11.153 1.00 88.28 11 B 1 ATOM 1252 C CA . LYS B 2 11 ? -6.958 -44.024 -10.205 1.00 88.80 11 B 1 ATOM 1253 C C . LYS B 2 11 ? -6.391 -43.699 -8.815 1.00 89.71 11 B 1 ATOM 1254 O O . LYS B 2 11 ? -6.798 -42.717 -8.198 1.00 88.94 11 B 1 ATOM 1255 C CB . LYS B 2 11 ? -8.010 -45.147 -10.149 1.00 87.59 11 B 1 ATOM 1256 C CG . LYS B 2 11 ? -9.268 -44.745 -9.357 1.00 80.82 11 B 1 ATOM 1257 C CD . LYS B 2 11 ? -10.327 -45.859 -9.379 1.00 76.06 11 B 1 ATOM 1258 C CE . LYS B 2 11 ? -11.580 -45.413 -8.612 1.00 68.00 11 B 1 ATOM 1259 N NZ . LYS B 2 11 ? -12.649 -46.448 -8.606 1.00 60.34 11 B 1 ATOM 1260 N N . LYS B 2 12 ? -5.405 -44.482 -8.355 1.00 89.61 12 B 1 ATOM 1261 C CA . LYS B 2 12 ? -4.721 -44.270 -7.070 1.00 90.16 12 B 1 ATOM 1262 C C . LYS B 2 12 ? -3.906 -42.969 -7.058 1.00 91.30 12 B 1 ATOM 1263 O O . LYS B 2 12 ? -3.918 -42.246 -6.065 1.00 88.81 12 B 1 ATOM 1264 C CB . LYS B 2 12 ? -3.849 -45.500 -6.759 1.00 88.77 12 B 1 ATOM 1265 C CG . LYS B 2 12 ? -3.332 -45.489 -5.311 1.00 79.10 12 B 1 ATOM 1266 C CD . LYS B 2 12 ? -2.528 -46.760 -5.000 1.00 73.30 12 B 1 ATOM 1267 C CE . LYS B 2 12 ? -2.084 -46.759 -3.535 1.00 64.63 12 B 1 ATOM 1268 N NZ . LYS B 2 12 ? -1.307 -47.975 -3.174 1.00 56.57 12 B 1 ATOM 1269 N N . GLY B 2 13 ? -3.236 -42.651 -8.156 1.00 91.25 13 B 1 ATOM 1270 C CA . GLY B 2 13 ? -2.499 -41.393 -8.303 1.00 91.00 13 B 1 ATOM 1271 C C . GLY B 2 13 ? -3.426 -40.169 -8.332 1.00 92.54 13 B 1 ATOM 1272 O O . GLY B 2 13 ? -3.134 -39.173 -7.677 1.00 91.38 13 B 1 ATOM 1273 N N . LEU B 2 14 ? -4.572 -40.275 -9.010 1.00 93.10 14 B 1 ATOM 1274 C CA . LEU B 2 14 ? -5.620 -39.243 -9.003 1.00 93.06 14 B 1 ATOM 1275 C C . LEU B 2 14 ? -6.195 -39.012 -7.600 1.00 93.51 14 B 1 ATOM 1276 O O . LEU B 2 14 ? -6.340 -37.866 -7.187 1.00 93.68 14 B 1 ATOM 1277 C CB . LEU B 2 14 ? -6.727 -39.645 -9.996 1.00 92.16 14 B 1 ATOM 1278 C CG . LEU B 2 14 ? -6.511 -39.033 -11.391 1.00 85.38 14 B 1 ATOM 1279 C CD1 . LEU B 2 14 ? -7.095 -39.934 -12.479 1.00 80.31 14 B 1 ATOM 1280 C CD2 . LEU B 2 14 ? -7.179 -37.663 -11.489 1.00 81.49 14 B 1 ATOM 1281 N N . GLN B 2 15 ? -6.468 -40.072 -6.844 1.00 92.70 15 B 1 ATOM 1282 C CA . GLN B 2 15 ? -6.921 -39.976 -5.450 1.00 91.88 15 B 1 ATOM 1283 C C . GLN B 2 15 ? -5.869 -39.315 -4.551 1.00 92.35 15 B 1 ATOM 1284 O O . GLN B 2 15 ? -6.219 -38.461 -3.735 1.00 91.80 15 B 1 ATOM 1285 C CB . GLN B 2 15 ? -7.273 -41.369 -4.919 1.00 90.92 15 B 1 ATOM 1286 C CG . GLN B 2 15 ? -8.634 -41.853 -5.443 1.00 84.03 15 B 1 ATOM 1287 C CD . GLN B 2 15 ? -8.963 -43.279 -4.979 1.00 79.05 15 B 1 ATOM 1288 O OE1 . GLN B 2 15 ? -8.112 -44.131 -4.776 1.00 73.58 15 B 1 ATOM 1289 N NE2 . GLN B 2 15 ? -10.229 -43.597 -4.818 1.00 69.58 15 B 1 ATOM 1290 N N . GLY B 2 16 ? -4.593 -39.661 -4.720 1.00 91.61 16 B 1 ATOM 1291 C CA . GLY B 2 16 ? -3.497 -39.020 -3.985 1.00 91.21 16 B 1 ATOM 1292 C C . GLY B 2 16 ? -3.393 -37.522 -4.287 1.00 92.47 16 B 1 ATOM 1293 O O . GLY B 2 16 ? -3.301 -36.712 -3.365 1.00 90.92 16 B 1 ATOM 1294 N N . LEU B 2 17 ? -3.504 -37.149 -5.561 1.00 94.18 17 B 1 ATOM 1295 C CA . LEU B 2 17 ? -3.512 -35.744 -5.973 1.00 93.65 17 B 1 ATOM 1296 C C . LEU B 2 17 ? -4.707 -34.982 -5.373 1.00 94.11 17 B 1 ATOM 1297 O O . LEU B 2 17 ? -4.528 -33.864 -4.891 1.00 93.74 17 B 1 ATOM 1298 C CB . LEU B 2 17 ? -3.508 -35.669 -7.509 1.00 92.89 17 B 1 ATOM 1299 C CG . LEU B 2 17 ? -3.465 -34.228 -8.061 1.00 87.71 17 B 1 ATOM 1300 C CD1 . LEU B 2 17 ? -2.146 -33.526 -7.724 1.00 81.24 17 B 1 ATOM 1301 C CD2 . LEU B 2 17 ? -3.620 -34.248 -9.580 1.00 82.88 17 B 1 ATOM 1302 N N . LEU B 2 18 ? -5.903 -35.573 -5.373 1.00 93.27 18 B 1 ATOM 1303 C CA . LEU B 2 18 ? -7.095 -34.992 -4.745 1.00 92.45 18 B 1 ATOM 1304 C C . LEU B 2 18 ? -6.874 -34.741 -3.251 1.00 92.47 18 B 1 ATOM 1305 O O . LEU B 2 18 ? -7.090 -33.621 -2.793 1.00 92.94 18 B 1 ATOM 1306 C CB . LEU B 2 18 ? -8.311 -35.906 -4.984 1.00 92.01 18 B 1 ATOM 1307 C CG . LEU B 2 18 ? -9.021 -35.611 -6.320 1.00 81.30 18 B 1 ATOM 1308 C CD1 . LEU B 2 18 ? -9.863 -36.815 -6.750 1.00 76.33 18 B 1 ATOM 1309 C CD2 . LEU B 2 18 ? -9.945 -34.399 -6.199 1.00 78.66 18 B 1 ATOM 1310 N N . GLN B 2 19 ? -6.352 -35.723 -2.518 1.00 93.49 19 B 1 ATOM 1311 C CA . GLN B 2 19 ? -6.045 -35.572 -1.089 1.00 92.44 19 B 1 ATOM 1312 C C . GLN B 2 19 ? -5.013 -34.469 -0.823 1.00 92.53 19 B 1 ATOM 1313 O O . GLN B 2 19 ? -5.137 -33.713 0.147 1.00 91.66 19 B 1 ATOM 1314 C CB . GLN B 2 19 ? -5.515 -36.895 -0.532 1.00 91.40 19 B 1 ATOM 1315 C CG . GLN B 2 19 ? -6.634 -37.934 -0.359 1.00 84.07 19 B 1 ATOM 1316 C CD . GLN B 2 19 ? -6.109 -39.261 0.200 1.00 80.03 19 B 1 ATOM 1317 O OE1 . GLN B 2 19 ? -4.920 -39.509 0.349 1.00 74.36 19 B 1 ATOM 1318 N NE2 . GLN B 2 19 ? -6.995 -40.168 0.546 1.00 71.24 19 B 1 ATOM 1319 N N . ASP B 2 20 ? -3.997 -34.338 -1.673 1.00 93.43 20 B 1 ATOM 1320 C CA . ASP B 2 20 ? -3.001 -33.269 -1.538 1.00 92.54 20 B 1 ATOM 1321 C C . ASP B 2 20 ? -3.600 -31.883 -1.816 1.00 92.34 20 B 1 ATOM 1322 O O . ASP B 2 20 ? -3.262 -30.907 -1.134 1.00 91.72 20 B 1 ATOM 1323 C CB . ASP B 2 20 ? -1.812 -33.531 -2.474 1.00 92.20 20 B 1 ATOM 1324 C CG . ASP B 2 20 ? -0.803 -34.552 -1.932 1.00 83.13 20 B 1 ATOM 1325 O OD1 . ASP B 2 20 ? -0.848 -34.865 -0.715 1.00 77.40 20 B 1 ATOM 1326 O OD2 . ASP B 2 20 ? 0.082 -34.937 -2.729 1.00 77.03 20 B 1 ATOM 1327 N N . ILE B 2 21 ? -4.508 -31.783 -2.789 1.00 93.45 21 B 1 ATOM 1328 C CA . ILE B 2 21 ? -5.251 -30.553 -3.080 1.00 92.42 21 B 1 ATOM 1329 C C . ILE B 2 21 ? -6.148 -30.190 -1.892 1.00 91.76 21 B 1 ATOM 1330 O O . ILE B 2 21 ? -6.089 -29.053 -1.424 1.00 91.56 21 B 1 ATOM 1331 C CB . ILE B 2 21 ? -6.036 -30.678 -4.405 1.00 92.24 21 B 1 ATOM 1332 C CG1 . ILE B 2 21 ? -5.050 -30.695 -5.598 1.00 87.92 21 B 1 ATOM 1333 C CG2 . ILE B 2 21 ? -7.043 -29.527 -4.569 1.00 86.28 21 B 1 ATOM 1334 C CD1 . ILE B 2 21 ? -5.694 -31.129 -6.923 1.00 79.61 21 B 1 ATOM 1335 N N . GLU B 2 22 ? -6.916 -31.134 -1.351 1.00 92.62 22 B 1 ATOM 1336 C CA . GLU B 2 22 ? -7.781 -30.922 -0.181 1.00 91.11 22 B 1 ATOM 1337 C C . GLU B 2 22 ? -6.984 -30.449 1.041 1.00 91.19 22 B 1 ATOM 1338 O O . GLU B 2 22 ? -7.356 -29.466 1.687 1.00 90.22 22 B 1 ATOM 1339 C CB . GLU B 2 22 ? -8.511 -32.222 0.164 1.00 90.11 22 B 1 ATOM 1340 C CG . GLU B 2 22 ? -9.647 -32.528 -0.816 1.00 84.43 22 B 1 ATOM 1341 C CD . GLU B 2 22 ? -10.258 -33.919 -0.589 1.00 79.48 22 B 1 ATOM 1342 O OE1 . GLU B 2 22 ? -11.194 -34.252 -1.347 1.00 73.98 22 B 1 ATOM 1343 O OE2 . GLU B 2 22 ? -9.765 -34.653 0.302 1.00 77.52 22 B 1 ATOM 1344 N N . LYS B 2 23 ? -5.832 -31.079 1.322 1.00 92.54 23 B 1 ATOM 1345 C CA . LYS B 2 23 ? -4.930 -30.642 2.397 1.00 91.79 23 B 1 ATOM 1346 C C . LYS B 2 23 ? -4.432 -29.211 2.192 1.00 91.32 23 B 1 ATOM 1347 O O . LYS B 2 23 ? -4.384 -28.437 3.152 1.00 90.14 23 B 1 ATOM 1348 C CB . LYS B 2 23 ? -3.728 -31.586 2.502 1.00 91.30 23 B 1 ATOM 1349 C CG . LYS B 2 23 ? -4.085 -32.893 3.219 1.00 83.01 23 B 1 ATOM 1350 C CD . LYS B 2 23 ? -2.869 -33.817 3.188 1.00 80.50 23 B 1 ATOM 1351 C CE . LYS B 2 23 ? -3.208 -35.161 3.834 1.00 71.39 23 B 1 ATOM 1352 N NZ . LYS B 2 23 ? -2.086 -36.122 3.663 1.00 64.70 23 B 1 ATOM 1353 N N . ARG B 2 24 ? -4.072 -28.844 0.959 1.00 92.43 24 B 1 ATOM 1354 C CA . ARG B 2 24 ? -3.658 -27.471 0.634 1.00 91.25 24 B 1 ATOM 1355 C C . ARG B 2 24 ? -4.803 -26.482 0.826 1.00 91.13 24 B 1 ATOM 1356 O O . ARG B 2 24 ? -4.586 -25.449 1.450 1.00 90.13 24 B 1 ATOM 1357 C CB . ARG B 2 24 ? -3.108 -27.385 -0.792 1.00 91.17 24 B 1 ATOM 1358 C CG . ARG B 2 24 ? -1.674 -27.921 -0.875 1.00 81.26 24 B 1 ATOM 1359 C CD . ARG B 2 24 ? -1.184 -27.809 -2.314 1.00 77.63 24 B 1 ATOM 1360 N NE . ARG B 2 24 ? 0.204 -28.287 -2.446 1.00 69.29 24 B 1 ATOM 1361 C CZ . ARG B 2 24 ? 0.983 -28.138 -3.508 1.00 62.71 24 B 1 ATOM 1362 N NH1 . ARG B 2 24 ? 0.573 -27.504 -4.576 1.00 56.05 24 B 1 ATOM 1363 N NH2 . ARG B 2 24 ? 2.187 -28.630 -3.512 1.00 54.32 24 B 1 ATOM 1364 N N . ILE B 2 25 ? -6.003 -26.802 0.350 1.00 91.44 25 B 1 ATOM 1365 C CA . ILE B 2 25 ? -7.198 -25.966 0.532 1.00 89.75 25 B 1 ATOM 1366 C C . ILE B 2 25 ? -7.466 -25.750 2.024 1.00 90.67 25 B 1 ATOM 1367 O O . ILE B 2 25 ? -7.612 -24.608 2.456 1.00 90.32 25 B 1 ATOM 1368 C CB . ILE B 2 25 ? -8.414 -26.579 -0.194 1.00 88.16 25 B 1 ATOM 1369 C CG1 . ILE B 2 25 ? -8.221 -26.477 -1.726 1.00 83.90 25 B 1 ATOM 1370 C CG2 . ILE B 2 25 ? -9.718 -25.871 0.223 1.00 83.20 25 B 1 ATOM 1371 C CD1 . ILE B 2 25 ? -9.225 -27.309 -2.529 1.00 77.15 25 B 1 ATOM 1372 N N . LEU B 2 26 ? -7.445 -26.817 2.829 1.00 89.97 26 B 1 ATOM 1373 C CA . LEU B 2 26 ? -7.639 -26.727 4.278 1.00 89.92 26 B 1 ATOM 1374 C C . LEU B 2 26 ? -6.579 -25.840 4.940 1.00 92.16 26 B 1 ATOM 1375 O O . LEU B 2 26 ? -6.909 -25.008 5.788 1.00 92.03 26 B 1 ATOM 1376 C CB . LEU B 2 26 ? -7.634 -28.147 4.866 1.00 87.41 26 B 1 ATOM 1377 C CG . LEU B 2 26 ? -7.944 -28.184 6.374 1.00 78.13 26 B 1 ATOM 1378 C CD1 . LEU B 2 26 ? -9.370 -27.714 6.679 1.00 73.53 26 B 1 ATOM 1379 C CD2 . LEU B 2 26 ? -7.778 -29.611 6.899 1.00 74.41 26 B 1 ATOM 1380 N N . HIS B 2 27 ? -5.309 -25.974 4.538 1.00 92.61 27 B 1 ATOM 1381 C CA . HIS B 2 27 ? -4.224 -25.137 5.046 1.00 93.25 27 B 1 ATOM 1382 C C . HIS B 2 27 ? -4.434 -23.657 4.709 1.00 93.61 27 B 1 ATOM 1383 O O . HIS B 2 27 ? -4.352 -22.809 5.601 1.00 93.36 27 B 1 ATOM 1384 C CB . HIS B 2 27 ? -2.887 -25.651 4.508 1.00 92.88 27 B 1 ATOM 1385 C CG . HIS B 2 27 ? -1.719 -24.872 5.050 1.00 88.97 27 B 1 ATOM 1386 N ND1 . HIS B 2 27 ? -1.331 -24.826 6.375 1.00 76.69 27 B 1 ATOM 1387 C CD2 . HIS B 2 27 ? -0.857 -24.062 4.351 1.00 78.33 27 B 1 ATOM 1388 C CE1 . HIS B 2 27 ? -0.265 -24.018 6.466 1.00 77.98 27 B 1 ATOM 1389 N NE2 . HIS B 2 27 ? 0.050 -23.539 5.260 1.00 78.59 27 B 1 ATOM 1390 N N . TYR B 2 28 ? -4.778 -23.336 3.461 1.00 93.80 28 B 1 ATOM 1391 C CA . TYR B 2 28 ? -5.076 -21.958 3.056 1.00 93.70 28 B 1 ATOM 1392 C C . TYR B 2 28 ? -6.292 -21.387 3.796 1.00 94.68 28 B 1 ATOM 1393 O O . TYR B 2 28 ? -6.251 -20.237 4.228 1.00 94.47 28 B 1 ATOM 1394 C CB . TYR B 2 28 ? -5.293 -21.883 1.542 1.00 92.42 28 B 1 ATOM 1395 C CG . TYR B 2 28 ? -4.022 -21.966 0.725 1.00 83.60 28 B 1 ATOM 1396 C CD1 . TYR B 2 28 ? -3.002 -21.008 0.899 1.00 77.04 28 B 1 ATOM 1397 C CD2 . TYR B 2 28 ? -3.851 -22.988 -0.230 1.00 75.51 28 B 1 ATOM 1398 C CE1 . TYR B 2 28 ? -1.823 -21.077 0.143 1.00 70.62 28 B 1 ATOM 1399 C CE2 . TYR B 2 28 ? -2.673 -23.064 -0.994 1.00 69.48 28 B 1 ATOM 1400 C CZ . TYR B 2 28 ? -1.660 -22.109 -0.801 1.00 68.44 28 B 1 ATOM 1401 O OH . TYR B 2 28 ? -0.503 -22.181 -1.540 1.00 62.87 28 B 1 ATOM 1402 N N . LYS B 2 29 ? -7.330 -22.183 4.010 1.00 93.86 29 B 1 ATOM 1403 C CA . LYS B 2 29 ? -8.523 -21.806 4.780 1.00 94.28 29 B 1 ATOM 1404 C C . LYS B 2 29 ? -8.153 -21.432 6.221 1.00 95.22 29 B 1 ATOM 1405 O O . LYS B 2 29 ? -8.561 -20.385 6.719 1.00 95.20 29 B 1 ATOM 1406 C CB . LYS B 2 29 ? -9.534 -22.967 4.695 1.00 92.71 29 B 1 ATOM 1407 C CG . LYS B 2 29 ? -10.950 -22.595 5.158 1.00 86.90 29 B 1 ATOM 1408 C CD . LYS B 2 29 ? -11.946 -23.728 4.832 1.00 87.16 29 B 1 ATOM 1409 C CE . LYS B 2 29 ? -13.398 -23.267 5.015 1.00 80.66 29 B 1 ATOM 1410 N NZ . LYS B 2 29 ? -14.416 -24.234 4.508 1.00 76.52 29 B 1 ATOM 1411 N N . GLN B 2 30 ? -7.309 -22.242 6.877 1.00 94.93 30 B 1 ATOM 1412 C CA . GLN B 2 30 ? -6.822 -21.962 8.233 1.00 95.02 30 B 1 ATOM 1413 C C . GLN B 2 30 ? -5.955 -20.698 8.299 1.00 95.84 30 B 1 ATOM 1414 O O . GLN B 2 30 ? -6.121 -19.902 9.223 1.00 95.27 30 B 1 ATOM 1415 C CB . GLN B 2 30 ? -6.021 -23.159 8.751 1.00 93.74 30 B 1 ATOM 1416 C CG . GLN B 2 30 ? -6.925 -24.346 9.102 1.00 85.55 30 B 1 ATOM 1417 C CD . GLN B 2 30 ? -6.126 -25.576 9.537 1.00 77.34 30 B 1 ATOM 1418 O OE1 . GLN B 2 30 ? -4.903 -25.598 9.580 1.00 70.77 30 B 1 ATOM 1419 N NE2 . GLN B 2 30 ? -6.800 -26.643 9.900 1.00 66.40 30 B 1 ATOM 1420 N N . LEU B 2 31 ? -5.060 -20.497 7.333 1.00 95.51 31 B 1 ATOM 1421 C CA . LEU B 2 31 ? -4.247 -19.279 7.247 1.00 95.42 31 B 1 ATOM 1422 C C . LEU B 2 31 ? -5.119 -18.038 7.065 1.00 96.00 31 B 1 ATOM 1423 O O . LEU B 2 31 ? -4.901 -17.047 7.753 1.00 95.68 31 B 1 ATOM 1424 C CB . LEU B 2 31 ? -3.246 -19.385 6.089 1.00 94.54 31 B 1 ATOM 1425 C CG . LEU B 2 31 ? -2.049 -20.323 6.334 1.00 85.96 31 B 1 ATOM 1426 C CD1 . LEU B 2 31 ? -1.200 -20.352 5.060 1.00 82.69 31 B 1 ATOM 1427 C CD2 . LEU B 2 31 ? -1.165 -19.856 7.489 1.00 83.48 31 B 1 ATOM 1428 N N . PHE B 2 32 ? -6.132 -18.117 6.205 1.00 95.51 32 B 1 ATOM 1429 C CA . PHE B 2 32 ? -7.080 -17.026 5.988 1.00 95.81 32 B 1 ATOM 1430 C C . PHE B 2 32 ? -7.810 -16.657 7.284 1.00 96.20 32 B 1 ATOM 1431 O O . PHE B 2 32 ? -7.808 -15.494 7.672 1.00 96.16 32 B 1 ATOM 1432 C CB . PHE B 2 32 ? -8.057 -17.418 4.880 1.00 95.43 32 B 1 ATOM 1433 C CG . PHE B 2 32 ? -9.091 -16.351 4.598 1.00 95.44 32 B 1 ATOM 1434 C CD1 . PHE B 2 32 ? -10.335 -16.374 5.256 1.00 94.16 32 B 1 ATOM 1435 C CD2 . PHE B 2 32 ? -8.807 -15.322 3.683 1.00 94.19 32 B 1 ATOM 1436 C CE1 . PHE B 2 32 ? -11.289 -15.379 4.995 1.00 93.58 32 B 1 ATOM 1437 C CE2 . PHE B 2 32 ? -9.762 -14.328 3.417 1.00 93.23 32 B 1 ATOM 1438 C CZ . PHE B 2 32 ? -11.000 -14.358 4.073 1.00 93.46 32 B 1 ATOM 1439 N N . PHE B 2 33 ? -8.371 -17.625 8.006 1.00 96.61 33 B 1 ATOM 1440 C CA . PHE B 2 33 ? -9.071 -17.350 9.266 1.00 96.74 33 B 1 ATOM 1441 C C . PHE B 2 33 ? -8.149 -16.739 10.320 1.00 96.79 33 B 1 ATOM 1442 O O . PHE B 2 33 ? -8.541 -15.788 10.993 1.00 96.22 33 B 1 ATOM 1443 C CB . PHE B 2 33 ? -9.706 -18.630 9.814 1.00 96.53 33 B 1 ATOM 1444 C CG . PHE B 2 33 ? -10.779 -19.255 8.949 1.00 96.60 33 B 1 ATOM 1445 C CD1 . PHE B 2 33 ? -11.619 -18.474 8.136 1.00 94.82 33 B 1 ATOM 1446 C CD2 . PHE B 2 33 ? -10.967 -20.652 8.993 1.00 94.95 33 B 1 ATOM 1447 C CE1 . PHE B 2 33 ? -12.623 -19.074 7.363 1.00 94.33 33 B 1 ATOM 1448 C CE2 . PHE B 2 33 ? -11.971 -21.256 8.226 1.00 94.18 33 B 1 ATOM 1449 C CZ . PHE B 2 33 ? -12.798 -20.468 7.411 1.00 94.85 33 B 1 ATOM 1450 N N . LYS B 2 34 ? -6.914 -17.243 10.435 1.00 96.84 34 B 1 ATOM 1451 C CA . LYS B 2 34 ? -5.914 -16.684 11.338 1.00 96.76 34 B 1 ATOM 1452 C C . LYS B 2 34 ? -5.618 -15.222 11.003 1.00 96.56 34 B 1 ATOM 1453 O O . LYS B 2 34 ? -5.659 -14.375 11.892 1.00 96.00 34 B 1 ATOM 1454 C CB . LYS B 2 34 ? -4.646 -17.546 11.290 1.00 96.59 34 B 1 ATOM 1455 C CG . LYS B 2 34 ? -3.619 -17.032 12.303 1.00 92.46 34 B 1 ATOM 1456 C CD . LYS B 2 34 ? -2.311 -17.816 12.233 1.00 89.36 34 B 1 ATOM 1457 C CE . LYS B 2 34 ? -1.340 -17.112 13.180 1.00 80.22 34 B 1 ATOM 1458 N NZ . LYS B 2 34 ? 0.040 -17.636 13.064 1.00 72.61 34 B 1 ATOM 1459 N N . GLU B 2 35 ? -5.351 -14.920 9.735 1.00 95.88 35 B 1 ATOM 1460 C CA . GLU B 2 35 ? -5.041 -13.562 9.283 1.00 94.95 35 B 1 ATOM 1461 C C . GLU B 2 35 ? -6.216 -12.606 9.532 1.00 95.04 35 B 1 ATOM 1462 O O . GLU B 2 35 ? -6.026 -11.528 10.096 1.00 94.19 35 B 1 ATOM 1463 C CB . GLU B 2 35 ? -4.641 -13.609 7.802 1.00 93.80 35 B 1 ATOM 1464 C CG . GLU B 2 35 ? -4.198 -12.238 7.266 1.00 84.98 35 B 1 ATOM 1465 C CD . GLU B 2 35 ? -3.680 -12.288 5.819 1.00 79.18 35 B 1 ATOM 1466 O OE1 . GLU B 2 35 ? -2.972 -11.332 5.427 1.00 72.51 35 B 1 ATOM 1467 O OE2 . GLU B 2 35 ? -3.967 -13.274 5.098 1.00 75.37 35 B 1 ATOM 1468 N N . GLN B 2 36 ? -7.437 -13.016 9.200 1.00 95.51 36 B 1 ATOM 1469 C CA . GLN B 2 36 ? -8.626 -12.193 9.433 1.00 95.46 36 B 1 ATOM 1470 C C . GLN B 2 36 ? -8.889 -11.966 10.927 1.00 95.54 36 B 1 ATOM 1471 O O . GLN B 2 36 ? -9.280 -10.869 11.314 1.00 94.46 36 B 1 ATOM 1472 C CB . GLN B 2 36 ? -9.853 -12.821 8.762 1.00 94.96 36 B 1 ATOM 1473 C CG . GLN B 2 36 ? -9.768 -12.895 7.229 1.00 93.48 36 B 1 ATOM 1474 C CD . GLN B 2 36 ? -9.437 -11.560 6.570 1.00 93.16 36 B 1 ATOM 1475 O OE1 . GLN B 2 36 ? -10.111 -10.561 6.757 1.00 86.22 36 B 1 ATOM 1476 N NE2 . GLN B 2 36 ? -8.389 -11.511 5.782 1.00 85.38 36 B 1 ATOM 1477 N N . ASN B 2 37 ? -8.636 -12.951 11.775 1.00 95.71 37 B 1 ATOM 1478 C CA . ASN B 2 37 ? -8.771 -12.797 13.223 1.00 95.64 37 B 1 ATOM 1479 C C . ASN B 2 37 ? -7.707 -11.851 13.801 1.00 95.40 37 B 1 ATOM 1480 O O . ASN B 2 37 ? -8.012 -11.023 14.657 1.00 94.36 37 B 1 ATOM 1481 C CB . ASN B 2 37 ? -8.713 -14.184 13.867 1.00 95.48 37 B 1 ATOM 1482 C CG . ASN B 2 37 ? -9.019 -14.127 15.350 1.00 93.92 37 B 1 ATOM 1483 O OD1 . ASN B 2 37 ? -10.068 -13.687 15.786 1.00 85.80 37 B 1 ATOM 1484 N ND2 . ASN B 2 37 ? -8.113 -14.605 16.176 1.00 85.87 37 B 1 ATOM 1485 N N . GLU B 2 38 ? -6.462 -11.905 13.315 1.00 95.83 38 B 1 ATOM 1486 C CA . GLU B 2 38 ? -5.416 -10.948 13.692 1.00 95.44 38 B 1 ATOM 1487 C C . GLU B 2 38 ? -5.783 -9.510 13.295 1.00 95.04 38 B 1 ATOM 1488 O O . GLU B 2 38 ? -5.584 -8.588 14.086 1.00 93.53 38 B 1 ATOM 1489 C CB . GLU B 2 38 ? -4.079 -11.338 13.040 1.00 95.19 38 B 1 ATOM 1490 C CG . GLU B 2 38 ? -3.396 -12.561 13.674 1.00 93.39 38 B 1 ATOM 1491 C CD . GLU B 2 38 ? -2.086 -12.958 12.955 1.00 92.78 38 B 1 ATOM 1492 O OE1 . GLU B 2 38 ? -1.528 -14.027 13.294 1.00 86.40 38 B 1 ATOM 1493 O OE2 . GLU B 2 38 ? -1.582 -12.193 12.088 1.00 89.19 38 B 1 ATOM 1494 N N . ILE B 2 39 ? -6.339 -9.318 12.093 1.00 94.83 39 B 1 ATOM 1495 C CA . ILE B 2 39 ? -6.828 -8.015 11.621 1.00 93.84 39 B 1 ATOM 1496 C C . ILE B 2 39 ? -7.979 -7.518 12.506 1.00 93.26 39 B 1 ATOM 1497 O O . ILE B 2 39 ? -7.948 -6.376 12.962 1.00 91.51 39 B 1 ATOM 1498 C CB . ILE B 2 39 ? -7.234 -8.097 10.129 1.00 92.92 39 B 1 ATOM 1499 C CG1 . ILE B 2 39 ? -5.982 -8.292 9.238 1.00 90.85 39 B 1 ATOM 1500 C CG2 . ILE B 2 39 ? -7.999 -6.836 9.686 1.00 90.70 39 B 1 ATOM 1501 C CD1 . ILE B 2 39 ? -6.294 -8.684 7.788 1.00 87.20 39 B 1 ATOM 1502 N N . ALA B 2 40 ? -8.960 -8.370 12.792 1.00 93.40 40 B 1 ATOM 1503 C CA . ALA B 2 40 ? -10.102 -8.027 13.644 1.00 92.68 40 B 1 ATOM 1504 C C . ALA B 2 40 ? -9.686 -7.665 15.083 1.00 93.33 40 B 1 ATOM 1505 O O . ALA B 2 40 ? -10.318 -6.824 15.716 1.00 91.49 40 B 1 ATOM 1506 C CB . ALA B 2 40 ? -11.087 -9.203 13.633 1.00 91.23 40 B 1 ATOM 1507 N N . ASN B 2 41 ? -8.591 -8.237 15.574 1.00 93.72 41 B 1 ATOM 1508 C CA . ASN B 2 41 ? -8.017 -7.933 16.887 1.00 94.22 41 B 1 ATOM 1509 C C . ASN B 2 41 ? -7.114 -6.682 16.897 1.00 93.99 41 B 1 ATOM 1510 O O . ASN B 2 41 ? -6.370 -6.467 17.859 1.00 90.38 41 B 1 ATOM 1511 C CB . ASN B 2 41 ? -7.300 -9.187 17.412 1.00 93.23 41 B 1 ATOM 1512 C CG . ASN B 2 41 ? -8.259 -10.309 17.781 1.00 89.77 41 B 1 ATOM 1513 O OD1 . ASN B 2 41 ? -9.407 -10.122 18.140 1.00 80.52 41 B 1 ATOM 1514 N ND2 . ASN B 2 41 ? -7.787 -11.535 17.740 1.00 79.46 41 B 1 ATOM 1515 N N . GLY B 2 42 ? -7.159 -5.856 15.844 1.00 93.05 42 B 1 ATOM 1516 C CA . GLY B 2 42 ? -6.449 -4.573 15.808 1.00 92.83 42 B 1 ATOM 1517 C C . GLY B 2 42 ? -4.958 -4.676 15.476 1.00 93.95 42 B 1 ATOM 1518 O O . GLY B 2 42 ? -4.177 -3.809 15.873 1.00 91.57 42 B 1 ATOM 1519 N N . LYS B 2 43 ? -4.537 -5.699 14.743 1.00 95.05 43 B 1 ATOM 1520 C CA . LYS B 2 43 ? -3.164 -5.792 14.229 1.00 95.88 43 B 1 ATOM 1521 C C . LYS B 2 43 ? -2.808 -4.526 13.452 1.00 96.24 43 B 1 ATOM 1522 O O . LYS B 2 43 ? -3.497 -4.146 12.504 1.00 95.38 43 B 1 ATOM 1523 C CB . LYS B 2 43 ? -3.018 -7.047 13.363 1.00 94.70 43 B 1 ATOM 1524 C CG . LYS B 2 43 ? -1.584 -7.260 12.845 1.00 92.16 43 B 1 ATOM 1525 C CD . LYS B 2 43 ? -1.563 -8.532 12.000 1.00 89.61 43 B 1 ATOM 1526 C CE . LYS B 2 43 ? -0.163 -8.877 11.489 1.00 84.66 43 B 1 ATOM 1527 N NZ . LYS B 2 43 ? -0.206 -10.187 10.796 1.00 77.86 43 B 1 ATOM 1528 N N . ARG B 2 44 ? -1.691 -3.902 13.828 1.00 95.94 44 B 1 ATOM 1529 C CA . ARG B 2 44 ? -1.160 -2.727 13.132 1.00 95.91 44 B 1 ATOM 1530 C C . ARG B 2 44 ? -0.399 -3.136 11.869 1.00 96.15 44 B 1 ATOM 1531 O O . ARG B 2 44 ? 0.292 -4.153 11.835 1.00 94.10 44 B 1 ATOM 1532 C CB . ARG B 2 44 ? -0.283 -1.891 14.078 1.00 93.73 44 B 1 ATOM 1533 C CG . ARG B 2 44 ? -1.142 -1.132 15.096 1.00 85.03 44 B 1 ATOM 1534 C CD . ARG B 2 44 ? -0.271 -0.253 15.998 1.00 82.90 44 B 1 ATOM 1535 N NE . ARG B 2 44 ? -0.985 0.985 16.370 1.00 76.35 44 B 1 ATOM 1536 C CZ . ARG B 2 44 ? -0.425 2.147 16.619 1.00 70.94 44 B 1 ATOM 1537 N NH1 . ARG B 2 44 ? 0.856 2.291 16.808 1.00 63.27 44 B 1 ATOM 1538 N NH2 . ARG B 2 44 ? -1.144 3.217 16.644 1.00 63.57 44 B 1 ATOM 1539 N N . SER B 2 45 ? -0.538 -2.311 10.831 1.00 96.74 45 B 1 ATOM 1540 C CA . SER B 2 45 ? 0.307 -2.381 9.642 1.00 96.56 45 B 1 ATOM 1541 C C . SER B 2 45 ? 1.666 -1.719 9.901 1.00 96.93 45 B 1 ATOM 1542 O O . SER B 2 45 ? 1.903 -1.139 10.960 1.00 95.97 45 B 1 ATOM 1543 C CB . SER B 2 45 ? -0.421 -1.731 8.460 1.00 95.28 45 B 1 ATOM 1544 O OG . SER B 2 45 ? -0.439 -0.330 8.599 1.00 94.35 45 B 1 ATOM 1545 N N . MET B 2 46 ? 2.554 -1.762 8.899 1.00 96.18 46 B 1 ATOM 1546 C CA . MET B 2 46 ? 3.824 -1.025 8.910 1.00 96.06 46 B 1 ATOM 1547 C C . MET B 2 46 ? 3.674 0.444 8.491 1.00 97.10 46 B 1 ATOM 1548 O O . MET B 2 46 ? 4.670 1.153 8.408 1.00 95.81 46 B 1 ATOM 1549 C CB . MET B 2 46 ? 4.835 -1.741 7.995 1.00 94.12 46 B 1 ATOM 1550 C CG . MET B 2 46 ? 5.193 -3.153 8.471 1.00 87.15 46 B 1 ATOM 1551 S SD . MET B 2 46 ? 5.953 -3.272 10.121 1.00 77.22 46 B 1 ATOM 1552 C CE . MET B 2 46 ? 7.485 -2.339 9.870 1.00 66.67 46 B 1 ATOM 1553 N N . VAL B 2 47 ? 2.463 0.901 8.171 1.00 97.36 47 B 1 ATOM 1554 C CA . VAL B 2 47 ? 2.209 2.281 7.737 1.00 97.67 47 B 1 ATOM 1555 C C . VAL B 2 47 ? 2.193 3.197 8.962 1.00 97.87 47 B 1 ATOM 1556 O O . VAL B 2 47 ? 1.477 2.895 9.917 1.00 97.15 47 B 1 ATOM 1557 C CB . VAL B 2 47 ? 0.903 2.374 6.934 1.00 96.91 47 B 1 ATOM 1558 C CG1 . VAL B 2 47 ? 0.577 3.807 6.540 1.00 94.55 47 B 1 ATOM 1559 C CG2 . VAL B 2 47 ? 1.027 1.558 5.636 1.00 94.66 47 B 1 ATOM 1560 N N . PRO B 2 48 ? 2.958 4.313 8.954 1.00 98.14 48 B 1 ATOM 1561 C CA . PRO B 2 48 ? 3.006 5.226 10.091 1.00 98.02 48 B 1 ATOM 1562 C C . PRO B 2 48 ? 1.665 5.916 10.363 1.00 98.05 48 B 1 ATOM 1563 O O . PRO B 2 48 ? 0.963 6.322 9.439 1.00 97.37 48 B 1 ATOM 1564 C CB . PRO B 2 48 ? 4.115 6.231 9.766 1.00 97.41 48 B 1 ATOM 1565 C CG . PRO B 2 48 ? 4.989 5.508 8.746 1.00 96.05 48 B 1 ATOM 1566 C CD . PRO B 2 48 ? 3.975 4.678 7.972 1.00 97.55 48 B 1 ATOM 1567 N N . ASP B 2 49 ? 1.331 6.114 11.642 1.00 97.28 49 B 1 ATOM 1568 C CA . ASP B 2 49 ? 0.020 6.633 12.065 1.00 97.05 49 B 1 ATOM 1569 C C . ASP B 2 49 ? -0.273 8.065 11.587 1.00 97.59 49 B 1 ATOM 1570 O O . ASP B 2 49 ? -1.435 8.423 11.388 1.00 96.47 49 B 1 ATOM 1571 C CB . ASP B 2 49 ? -0.085 6.598 13.596 1.00 95.33 49 B 1 ATOM 1572 C CG . ASP B 2 49 ? -0.280 5.202 14.179 1.00 92.54 49 B 1 ATOM 1573 O OD1 . ASP B 2 49 ? -1.018 4.371 13.597 1.00 87.68 49 B 1 ATOM 1574 O OD2 . ASP B 2 49 ? 0.252 4.937 15.281 1.00 86.69 49 B 1 ATOM 1575 N N . ASN B 2 50 ? 0.763 8.886 11.389 1.00 97.50 50 B 1 ATOM 1576 C CA . ASN B 2 50 ? 0.638 10.263 10.900 1.00 97.72 50 B 1 ATOM 1577 C C . ASN B 2 50 ? 0.916 10.399 9.390 1.00 98.04 50 B 1 ATOM 1578 O O . ASN B 2 50 ? 1.078 11.516 8.892 1.00 97.25 50 B 1 ATOM 1579 C CB . ASN B 2 50 ? 1.509 11.198 11.755 1.00 97.09 50 B 1 ATOM 1580 C CG . ASN B 2 50 ? 1.003 11.391 13.174 1.00 96.03 50 B 1 ATOM 1581 O OD1 . ASN B 2 50 ? -0.098 11.020 13.555 1.00 89.45 50 B 1 ATOM 1582 N ND2 . ASN B 2 50 ? 1.800 12.023 14.007 1.00 88.25 50 B 1 ATOM 1583 N N . SER B 2 51 ? 0.963 9.301 8.645 1.00 98.33 51 B 1 ATOM 1584 C CA . SER B 2 51 ? 0.973 9.340 7.181 1.00 98.33 51 B 1 ATOM 1585 C C . SER B 2 51 ? -0.404 9.742 6.637 1.00 98.47 51 B 1 ATOM 1586 O O . SER B 2 51 ? -1.437 9.492 7.265 1.00 98.02 51 B 1 ATOM 1587 C CB . SER B 2 51 ? 1.434 8.002 6.596 1.00 97.65 51 B 1 ATOM 1588 O OG . SER B 2 51 ? 0.510 6.972 6.879 1.00 94.50 51 B 1 ATOM 1589 N N . ILE B 2 52 ? -0.433 10.358 5.459 1.00 98.50 52 B 1 ATOM 1590 C CA . ILE B 2 52 ? -1.656 10.858 4.817 1.00 98.56 52 B 1 ATOM 1591 C C . ILE B 2 52 ? -1.746 10.285 3.392 1.00 98.58 52 B 1 ATOM 1592 O O . ILE B 2 52 ? -1.365 10.945 2.424 1.00 98.30 52 B 1 ATOM 1593 C CB . ILE B 2 52 ? -1.705 12.404 4.865 1.00 98.48 52 B 1 ATOM 1594 C CG1 . ILE B 2 52 ? -1.558 12.949 6.309 1.00 97.88 52 B 1 ATOM 1595 C CG2 . ILE B 2 52 ? -3.038 12.900 4.262 1.00 97.91 52 B 1 ATOM 1596 C CD1 . ILE B 2 52 ? -1.156 14.427 6.361 1.00 95.69 52 B 1 ATOM 1597 N N . PRO B 2 53 ? -2.207 9.039 3.231 1.00 98.64 53 B 1 ATOM 1598 C CA . PRO B 2 53 ? -2.285 8.384 1.931 1.00 98.51 53 B 1 ATOM 1599 C C . PRO B 2 53 ? -3.501 8.859 1.129 1.00 98.45 53 B 1 ATOM 1600 O O . PRO B 2 53 ? -4.627 8.840 1.624 1.00 97.70 53 B 1 ATOM 1601 C CB . PRO B 2 53 ? -2.357 6.878 2.217 1.00 98.05 53 B 1 ATOM 1602 C CG . PRO B 2 53 ? -2.094 6.742 3.718 1.00 96.75 53 B 1 ATOM 1603 C CD . PRO B 2 53 ? -2.520 8.084 4.283 1.00 98.10 53 B 1 ATOM 1604 N N . ILE B 2 54 ? -3.286 9.212 -0.134 1.00 98.34 54 B 1 ATOM 1605 C CA . ILE B 2 54 ? -4.334 9.555 -1.096 1.00 98.28 54 B 1 ATOM 1606 C C . ILE B 2 54 ? -4.218 8.601 -2.288 1.00 98.11 54 B 1 ATOM 1607 O O . ILE B 2 54 ? -3.335 8.744 -3.136 1.00 97.43 54 B 1 ATOM 1608 C CB . ILE B 2 54 ? -4.243 11.041 -1.516 1.00 98.21 54 B 1 ATOM 1609 C CG1 . ILE B 2 54 ? -4.288 11.983 -0.284 1.00 97.55 54 B 1 ATOM 1610 C CG2 . ILE B 2 54 ? -5.378 11.374 -2.504 1.00 97.55 54 B 1 ATOM 1611 C CD1 . ILE B 2 54 ? -4.061 13.463 -0.624 1.00 96.07 54 B 1 ATOM 1612 N N . CYS B 2 55 ? -5.105 7.630 -2.371 1.00 97.53 55 B 1 ATOM 1613 C CA . CYS B 2 55 ? -5.154 6.714 -3.509 1.00 96.97 55 B 1 ATOM 1614 C C . CYS B 2 55 ? -5.891 7.377 -4.676 1.00 96.82 55 B 1 ATOM 1615 O O . CYS B 2 55 ? -7.125 7.402 -4.711 1.00 95.60 55 B 1 ATOM 1616 C CB . CYS B 2 55 ? -5.773 5.379 -3.084 1.00 96.07 55 B 1 ATOM 1617 S SG . CYS B 2 55 ? -5.666 4.189 -4.458 1.00 93.94 55 B 1 ATOM 1618 N N . SER B 2 56 ? -5.144 7.901 -5.640 1.00 96.58 56 B 1 ATOM 1619 C CA . SER B 2 56 ? -5.716 8.557 -6.813 1.00 96.80 56 B 1 ATOM 1620 C C . SER B 2 56 ? -4.797 8.468 -8.032 1.00 97.19 56 B 1 ATOM 1621 O O . SER B 2 56 ? -3.572 8.411 -7.924 1.00 96.23 56 B 1 ATOM 1622 C CB . SER B 2 56 ? -6.033 10.022 -6.492 1.00 96.05 56 B 1 ATOM 1623 O OG . SER B 2 56 ? -6.829 10.586 -7.520 1.00 90.86 56 B 1 ATOM 1624 N N . ASP B 2 57 ? -5.416 8.486 -9.204 1.00 96.47 57 B 1 ATOM 1625 C CA . ASP B 2 57 ? -4.747 8.831 -10.457 1.00 97.10 57 B 1 ATOM 1626 C C . ASP B 2 57 ? -4.591 10.356 -10.505 1.00 97.52 57 B 1 ATOM 1627 O O . ASP B 2 57 ? -5.584 11.084 -10.453 1.00 96.74 57 B 1 ATOM 1628 C CB . ASP B 2 57 ? -5.597 8.279 -11.610 1.00 96.54 57 B 1 ATOM 1629 C CG . ASP B 2 57 ? -5.121 8.632 -13.022 1.00 96.16 57 B 1 ATOM 1630 O OD1 . ASP B 2 57 ? -4.199 9.461 -13.179 1.00 93.34 57 B 1 ATOM 1631 O OD2 . ASP B 2 57 ? -5.751 8.104 -13.969 1.00 92.47 57 B 1 ATOM 1632 N N . VAL B 2 58 ? -3.349 10.842 -10.603 1.00 97.54 58 B 1 ATOM 1633 C CA . VAL B 2 58 ? -3.062 12.285 -10.615 1.00 97.75 58 B 1 ATOM 1634 C C . VAL B 2 58 ? -3.709 13.014 -11.793 1.00 97.88 58 B 1 ATOM 1635 O O . VAL B 2 58 ? -3.948 14.210 -11.707 1.00 97.04 58 B 1 ATOM 1636 C CB . VAL B 2 58 ? -1.552 12.593 -10.592 1.00 97.04 58 B 1 ATOM 1637 C CG1 . VAL B 2 58 ? -0.886 12.009 -9.342 1.00 93.86 58 B 1 ATOM 1638 C CG2 . VAL B 2 58 ? -0.828 12.085 -11.847 1.00 94.34 58 B 1 ATOM 1639 N N . THR B 2 59 ? -4.042 12.309 -12.870 1.00 97.58 59 B 1 ATOM 1640 C CA . THR B 2 59 ? -4.730 12.903 -14.027 1.00 97.20 59 B 1 ATOM 1641 C C . THR B 2 59 ? -6.214 13.167 -13.766 1.00 97.20 59 B 1 ATOM 1642 O O . THR B 2 59 ? -6.863 13.860 -14.546 1.00 95.57 59 B 1 ATOM 1643 C CB . THR B 2 59 ? -4.572 12.054 -15.299 1.00 96.36 59 B 1 ATOM 1644 O OG1 . THR B 2 59 ? -5.287 10.844 -15.245 1.00 90.12 59 B 1 ATOM 1645 C CG2 . THR B 2 59 ? -3.110 11.724 -15.608 1.00 88.72 59 B 1 ATOM 1646 N N . LYS B 2 60 ? -6.758 12.623 -12.666 1.00 97.03 60 B 1 ATOM 1647 C CA . LYS B 2 60 ? -8.160 12.761 -12.245 1.00 96.54 60 B 1 ATOM 1648 C C . LYS B 2 60 ? -8.307 13.399 -10.863 1.00 96.89 60 B 1 ATOM 1649 O O . LYS B 2 60 ? -9.427 13.666 -10.435 1.00 94.93 60 B 1 ATOM 1650 C CB . LYS B 2 60 ? -8.833 11.384 -12.262 1.00 95.30 60 B 1 ATOM 1651 C CG . LYS B 2 60 ? -8.808 10.738 -13.655 1.00 92.50 60 B 1 ATOM 1652 C CD . LYS B 2 60 ? -9.387 9.328 -13.583 1.00 86.38 60 B 1 ATOM 1653 C CE . LYS B 2 60 ? -9.152 8.630 -14.918 1.00 80.00 60 B 1 ATOM 1654 N NZ . LYS B 2 60 ? -9.268 7.164 -14.780 1.00 69.27 60 B 1 ATOM 1655 N N . LEU B 2 61 ? -7.198 13.614 -10.162 1.00 96.78 61 B 1 ATOM 1656 C CA . LEU B 2 61 ? -7.201 14.188 -8.821 1.00 97.30 61 B 1 ATOM 1657 C C . LEU B 2 61 ? -7.700 15.638 -8.854 1.00 97.67 61 B 1 ATOM 1658 O O . LEU B 2 61 ? -7.226 16.459 -9.637 1.00 97.05 61 B 1 ATOM 1659 C CB . LEU B 2 61 ? -5.789 14.079 -8.224 1.00 96.94 61 B 1 ATOM 1660 C CG . LEU B 2 61 ? -5.657 14.672 -6.809 1.00 96.45 61 B 1 ATOM 1661 C CD1 . LEU B 2 61 ? -6.487 13.903 -5.782 1.00 93.98 61 B 1 ATOM 1662 C CD2 . LEU B 2 61 ? -4.197 14.621 -6.370 1.00 93.78 61 B 1 ATOM 1663 N N . ASN B 2 62 ? -8.608 15.964 -7.935 1.00 97.26 62 B 1 ATOM 1664 C CA . ASN B 2 62 ? -8.986 17.346 -7.682 1.00 97.45 62 B 1 ATOM 1665 C C . ASN B 2 62 ? -7.891 18.047 -6.855 1.00 97.93 62 B 1 ATOM 1666 O O . ASN B 2 62 ? -7.920 18.053 -5.624 1.00 97.47 62 B 1 ATOM 1667 C CB . ASN B 2 62 ? -10.375 17.389 -7.019 1.00 96.53 62 B 1 ATOM 1668 C CG . ASN B 2 62 ? -10.866 18.817 -6.846 1.00 94.90 62 B 1 ATOM 1669 O OD1 . ASN B 2 62 ? -10.173 19.783 -7.100 1.00 89.72 62 B 1 ATOM 1670 N ND2 . ASN B 2 62 ? -12.092 18.988 -6.403 1.00 87.55 62 B 1 ATOM 1671 N N . PHE B 2 63 ? -6.928 18.658 -7.537 1.00 98.03 63 B 1 ATOM 1672 C CA . PHE B 2 63 ? -5.848 19.408 -6.892 1.00 98.23 63 B 1 ATOM 1673 C C . PHE B 2 63 ? -6.351 20.627 -6.104 1.00 98.33 63 B 1 ATOM 1674 O O . PHE B 2 63 ? -5.731 20.988 -5.110 1.00 97.79 63 B 1 ATOM 1675 C CB . PHE B 2 63 ? -4.819 19.837 -7.942 1.00 97.99 63 B 1 ATOM 1676 C CG . PHE B 2 63 ? -3.880 18.725 -8.358 1.00 98.15 63 B 1 ATOM 1677 C CD1 . PHE B 2 63 ? -2.762 18.420 -7.558 1.00 97.21 63 B 1 ATOM 1678 C CD2 . PHE B 2 63 ? -4.106 17.991 -9.534 1.00 97.21 63 B 1 ATOM 1679 C CE1 . PHE B 2 63 ? -1.871 17.400 -7.934 1.00 96.40 63 B 1 ATOM 1680 C CE2 . PHE B 2 63 ? -3.220 16.968 -9.914 1.00 96.40 63 B 1 ATOM 1681 C CZ . PHE B 2 63 ? -2.100 16.676 -9.114 1.00 96.91 63 B 1 ATOM 1682 N N . GLN B 2 64 ? -7.488 21.217 -6.485 1.00 98.04 64 B 1 ATOM 1683 C CA . GLN B 2 64 ? -8.057 22.327 -5.721 1.00 98.01 64 B 1 ATOM 1684 C C . GLN B 2 64 ? -8.517 21.864 -4.335 1.00 98.14 64 B 1 ATOM 1685 O O . GLN B 2 64 ? -8.231 22.531 -3.348 1.00 97.75 64 B 1 ATOM 1686 C CB . GLN B 2 64 ? -9.195 22.994 -6.509 1.00 97.57 64 B 1 ATOM 1687 C CG . GLN B 2 64 ? -9.660 24.303 -5.845 1.00 93.27 64 B 1 ATOM 1688 C CD . GLN B 2 64 ? -8.522 25.322 -5.750 1.00 94.09 64 B 1 ATOM 1689 O OE1 . GLN B 2 64 ? -7.839 25.608 -6.723 1.00 85.89 64 B 1 ATOM 1690 N NE2 . GLN B 2 64 ? -8.260 25.872 -4.588 1.00 85.15 64 B 1 ATOM 1691 N N . ALA B 2 65 ? -9.126 20.683 -4.232 1.00 98.11 65 B 1 ATOM 1692 C CA . ALA B 2 65 ? -9.488 20.109 -2.934 1.00 98.00 65 B 1 ATOM 1693 C C . ALA B 2 65 ? -8.256 19.848 -2.046 1.00 98.27 65 B 1 ATOM 1694 O O . ALA B 2 65 ? -8.312 20.078 -0.837 1.00 97.74 65 B 1 ATOM 1695 C CB . ALA B 2 65 ? -10.298 18.829 -3.163 1.00 97.46 65 B 1 ATOM 1696 N N . LEU B 2 66 ? -7.132 19.419 -2.631 1.00 98.40 66 B 1 ATOM 1697 C CA . LEU B 2 66 ? -5.856 19.275 -1.916 1.00 98.48 66 B 1 ATOM 1698 C C . LEU B 2 66 ? -5.350 20.630 -1.398 1.00 98.56 66 B 1 ATOM 1699 O O . LEU B 2 66 ? -4.975 20.732 -0.230 1.00 98.27 66 B 1 ATOM 1700 C CB . LEU B 2 66 ? -4.829 18.587 -2.837 1.00 98.25 66 B 1 ATOM 1701 C CG . LEU B 2 66 ? -3.391 18.538 -2.285 1.00 97.56 66 B 1 ATOM 1702 C CD1 . LEU B 2 66 ? -3.285 17.717 -1.002 1.00 96.55 66 B 1 ATOM 1703 C CD2 . LEU B 2 66 ? -2.460 17.913 -3.324 1.00 96.28 66 B 1 ATOM 1704 N N . ILE B 2 67 ? -5.369 21.663 -2.241 1.00 98.47 67 B 1 ATOM 1705 C CA . ILE B 2 67 ? -4.964 23.030 -1.880 1.00 98.35 67 B 1 ATOM 1706 C C . ILE B 2 67 ? -5.840 23.556 -0.738 1.00 98.40 67 B 1 ATOM 1707 O O . ILE B 2 67 ? -5.321 24.032 0.272 1.00 98.10 67 B 1 ATOM 1708 C CB . ILE B 2 67 ? -5.025 23.951 -3.124 1.00 98.00 67 B 1 ATOM 1709 C CG1 . ILE B 2 67 ? -3.914 23.573 -4.131 1.00 96.38 67 B 1 ATOM 1710 C CG2 . ILE B 2 67 ? -4.902 25.439 -2.745 1.00 96.62 67 B 1 ATOM 1711 C CD1 . ILE B 2 67 ? -4.147 24.123 -5.543 1.00 93.30 67 B 1 ATOM 1712 N N . ASP B 2 68 ? -7.152 23.428 -0.865 1.00 98.29 68 B 1 ATOM 1713 C CA . ASP B 2 68 ? -8.115 23.931 0.112 1.00 98.22 68 B 1 ATOM 1714 C C . ASP B 2 68 ? -7.956 23.236 1.473 1.00 98.24 68 B 1 ATOM 1715 O O . ASP B 2 68 ? -7.946 23.904 2.509 1.00 97.74 68 B 1 ATOM 1716 C CB . ASP B 2 68 ? -9.545 23.739 -0.415 1.00 97.95 68 B 1 ATOM 1717 C CG . ASP B 2 68 ? -9.890 24.564 -1.658 1.00 96.26 68 B 1 ATOM 1718 O OD1 . ASP B 2 68 ? -9.141 25.509 -1.997 1.00 93.44 68 B 1 ATOM 1719 O OD2 . ASP B 2 68 ? -10.935 24.256 -2.276 1.00 93.48 68 B 1 ATOM 1720 N N . ALA B 2 69 ? -7.779 21.916 1.487 1.00 98.35 69 B 1 ATOM 1721 C CA . ALA B 2 69 ? -7.537 21.157 2.712 1.00 98.32 69 B 1 ATOM 1722 C C . ALA B 2 69 ? -6.197 21.529 3.361 1.00 98.43 69 B 1 ATOM 1723 O O . ALA B 2 69 ? -6.137 21.769 4.570 1.00 98.08 69 B 1 ATOM 1724 C CB . ALA B 2 69 ? -7.610 19.662 2.387 1.00 98.04 69 B 1 ATOM 1725 N N . GLN B 2 70 ? -5.133 21.648 2.578 1.00 98.40 70 B 1 ATOM 1726 C CA . GLN B 2 70 ? -3.814 22.047 3.072 1.00 98.38 70 B 1 ATOM 1727 C C . GLN B 2 70 ? -3.850 23.447 3.700 1.00 98.33 70 B 1 ATOM 1728 O O . GLN B 2 70 ? -3.351 23.641 4.811 1.00 97.96 70 B 1 ATOM 1729 C CB . GLN B 2 70 ? -2.799 21.946 1.918 1.00 98.08 70 B 1 ATOM 1730 C CG . GLN B 2 70 ? -1.380 22.395 2.301 1.00 96.99 70 B 1 ATOM 1731 C CD . GLN B 2 70 ? -0.753 21.609 3.448 1.00 97.95 70 B 1 ATOM 1732 O OE1 . GLN B 2 70 ? -1.134 20.510 3.795 1.00 93.39 70 B 1 ATOM 1733 N NE2 . GLN B 2 70 ? 0.247 22.178 4.087 1.00 93.10 70 B 1 ATOM 1734 N N . MET B 2 71 ? -4.494 24.408 3.044 1.00 98.08 71 B 1 ATOM 1735 C CA . MET B 2 71 ? -4.658 25.757 3.591 1.00 97.80 71 B 1 ATOM 1736 C C . MET B 2 71 ? -5.534 25.760 4.849 1.00 97.73 71 B 1 ATOM 1737 O O . MET B 2 71 ? -5.202 26.437 5.822 1.00 96.91 71 B 1 ATOM 1738 C CB . MET B 2 71 ? -5.233 26.687 2.517 1.00 97.33 71 B 1 ATOM 1739 C CG . MET B 2 71 ? -4.201 27.032 1.431 1.00 93.48 71 B 1 ATOM 1740 S SD . MET B 2 71 ? -2.694 27.862 2.031 1.00 92.11 71 B 1 ATOM 1741 C CE . MET B 2 71 ? -3.381 29.415 2.653 1.00 80.35 71 B 1 ATOM 1742 N N . ARG B 2 72 ? -6.610 24.979 4.877 1.00 97.77 72 B 1 ATOM 1743 C CA . ARG B 2 72 ? -7.522 24.873 6.027 1.00 97.59 72 B 1 ATOM 1744 C C . ARG B 2 72 ? -6.841 24.297 7.267 1.00 97.48 72 B 1 ATOM 1745 O O . ARG B 2 72 ? -7.070 24.789 8.364 1.00 96.49 72 B 1 ATOM 1746 C CB . ARG B 2 72 ? -8.729 24.019 5.613 1.00 96.86 72 B 1 ATOM 1747 C CG . ARG B 2 72 ? -9.861 24.018 6.651 1.00 88.84 72 B 1 ATOM 1748 C CD . ARG B 2 72 ? -10.983 23.050 6.237 1.00 88.66 72 B 1 ATOM 1749 N NE . ARG B 2 72 ? -11.451 23.305 4.860 1.00 81.01 72 B 1 ATOM 1750 C CZ . ARG B 2 72 ? -11.670 22.398 3.917 1.00 77.11 72 B 1 ATOM 1751 N NH1 . ARG B 2 72 ? -11.591 21.125 4.146 1.00 67.30 72 B 1 ATOM 1752 N NH2 . ARG B 2 72 ? -11.971 22.772 2.706 1.00 68.63 72 B 1 ATOM 1753 N N . HIS B 2 73 ? -6.007 23.263 7.101 1.00 97.63 73 B 1 ATOM 1754 C CA . HIS B 2 73 ? -5.467 22.486 8.222 1.00 97.30 73 B 1 ATOM 1755 C C . HIS B 2 73 ? -4.034 22.858 8.622 1.00 96.82 73 B 1 ATOM 1756 O O . HIS B 2 73 ? -3.656 22.611 9.766 1.00 95.49 73 B 1 ATOM 1757 C CB . HIS B 2 73 ? -5.599 20.990 7.911 1.00 97.25 73 B 1 ATOM 1758 C CG . HIS B 2 73 ? -7.027 20.554 7.722 1.00 97.65 73 B 1 ATOM 1759 N ND1 . HIS B 2 73 ? -8.081 20.806 8.598 1.00 89.42 73 B 1 ATOM 1760 C CD2 . HIS B 2 73 ? -7.525 19.871 6.643 1.00 90.61 73 B 1 ATOM 1761 C CE1 . HIS B 2 73 ? -9.180 20.281 8.042 1.00 92.93 73 B 1 ATOM 1762 N NE2 . HIS B 2 73 ? -8.879 19.709 6.865 1.00 94.10 73 B 1 ATOM 1763 N N . ALA B 2 74 ? -3.251 23.454 7.725 1.00 97.89 74 B 1 ATOM 1764 C CA . ALA B 2 74 ? -1.880 23.900 8.006 1.00 97.34 74 B 1 ATOM 1765 C C . ALA B 2 74 ? -1.677 25.423 7.875 1.00 96.72 74 B 1 ATOM 1766 O O . ALA B 2 74 ? -0.663 25.950 8.336 1.00 94.06 74 B 1 ATOM 1767 C CB . ALA B 2 74 ? -0.909 23.120 7.108 1.00 96.70 74 B 1 ATOM 1768 N N . GLY B 2 75 ? -2.595 26.139 7.231 1.00 96.92 75 B 1 ATOM 1769 C CA . GLY B 2 75 ? -2.500 27.592 7.024 1.00 96.10 75 B 1 ATOM 1770 C C . GLY B 2 75 ? -1.418 28.038 6.037 1.00 96.05 75 B 1 ATOM 1771 O O . GLY B 2 75 ? -1.125 29.230 5.943 1.00 93.89 75 B 1 ATOM 1772 N N . LYS B 2 76 ? -0.794 27.103 5.324 1.00 96.16 76 B 1 ATOM 1773 C CA . LYS B 2 76 ? 0.247 27.354 4.320 1.00 96.05 76 B 1 ATOM 1774 C C . LYS B 2 76 ? 0.316 26.209 3.312 1.00 96.96 76 B 1 ATOM 1775 O O . LYS B 2 76 ? -0.118 25.092 3.602 1.00 96.35 76 B 1 ATOM 1776 C CB . LYS B 2 76 ? 1.614 27.576 4.998 1.00 93.26 76 B 1 ATOM 1777 C CG . LYS B 2 76 ? 2.118 26.343 5.765 1.00 89.89 76 B 1 ATOM 1778 C CD . LYS B 2 76 ? 3.561 26.518 6.243 1.00 88.74 76 B 1 ATOM 1779 C CE . LYS B 2 76 ? 4.009 25.224 6.922 1.00 84.39 76 B 1 ATOM 1780 N NZ . LYS B 2 76 ? 5.478 25.160 7.094 1.00 81.19 76 B 1 ATOM 1781 N N . MET B 2 77 ? 0.921 26.478 2.156 1.00 97.19 77 B 1 ATOM 1782 C CA . MET B 2 77 ? 1.224 25.458 1.148 1.00 97.44 77 B 1 ATOM 1783 C C . MET B 2 77 ? 2.417 24.575 1.556 1.00 97.62 77 B 1 ATOM 1784 O O . MET B 2 77 ? 3.035 24.784 2.605 1.00 96.72 77 B 1 ATOM 1785 C CB . MET B 2 77 ? 1.439 26.132 -0.213 1.00 96.79 77 B 1 ATOM 1786 C CG . MET B 2 77 ? 0.184 26.869 -0.714 1.00 93.75 77 B 1 ATOM 1787 S SD . MET B 2 77 ? -1.369 25.929 -0.635 1.00 90.72 77 B 1 ATOM 1788 C CE . MET B 2 77 ? -0.959 24.488 -1.629 1.00 78.39 77 B 1 ATOM 1789 N N . PHE B 2 78 ? 2.735 23.576 0.735 1.00 98.13 78 B 1 ATOM 1790 C CA . PHE B 2 78 ? 3.820 22.634 0.998 1.00 98.34 78 B 1 ATOM 1791 C C . PHE B 2 78 ? 5.196 23.307 0.954 1.00 98.21 78 B 1 ATOM 1792 O O . PHE B 2 78 ? 5.473 24.134 0.087 1.00 97.59 78 B 1 ATOM 1793 C CB . PHE B 2 78 ? 3.729 21.457 0.021 1.00 98.44 78 B 1 ATOM 1794 C CG . PHE B 2 78 ? 2.464 20.646 0.192 1.00 98.59 78 B 1 ATOM 1795 C CD1 . PHE B 2 78 ? 2.336 19.773 1.286 1.00 98.22 78 B 1 ATOM 1796 C CD2 . PHE B 2 78 ? 1.390 20.796 -0.703 1.00 98.10 78 B 1 ATOM 1797 C CE1 . PHE B 2 78 ? 1.153 19.049 1.484 1.00 97.90 78 B 1 ATOM 1798 C CE2 . PHE B 2 78 ? 0.201 20.074 -0.510 1.00 97.88 78 B 1 ATOM 1799 C CZ . PHE B 2 78 ? 0.082 19.202 0.585 1.00 98.16 78 B 1 ATOM 1800 N N . ASP B 2 79 ? 6.069 22.923 1.887 1.00 98.17 79 B 1 ATOM 1801 C CA . ASP B 2 79 ? 7.452 23.402 1.963 1.00 98.05 79 B 1 ATOM 1802 C C . ASP B 2 79 ? 8.377 22.587 1.050 1.00 98.29 79 B 1 ATOM 1803 O O . ASP B 2 79 ? 9.284 23.138 0.423 1.00 97.80 79 B 1 ATOM 1804 C CB . ASP B 2 79 ? 7.945 23.310 3.414 1.00 97.50 79 B 1 ATOM 1805 C CG . ASP B 2 79 ? 7.129 24.142 4.404 1.00 97.00 79 B 1 ATOM 1806 O OD1 . ASP B 2 79 ? 7.056 25.384 4.281 1.00 94.75 79 B 1 ATOM 1807 O OD2 . ASP B 2 79 ? 6.576 23.568 5.366 1.00 94.57 79 B 1 ATOM 1808 N N . VAL B 2 80 ? 8.145 21.285 0.956 1.00 98.42 80 B 1 ATOM 1809 C CA . VAL B 2 80 ? 8.881 20.400 0.047 1.00 98.57 80 B 1 ATOM 1810 C C . VAL B 2 80 ? 7.898 19.517 -0.713 1.00 98.71 80 B 1 ATOM 1811 O O . VAL B 2 80 ? 7.018 18.892 -0.120 1.00 98.52 80 B 1 ATOM 1812 C CB . VAL B 2 80 ? 9.940 19.550 0.779 1.00 98.29 80 B 1 ATOM 1813 C CG1 . VAL B 2 80 ? 10.749 18.703 -0.210 1.00 97.38 80 B 1 ATOM 1814 C CG2 . VAL B 2 80 ? 10.929 20.425 1.565 1.00 97.42 80 B 1 ATOM 1815 N N . ILE B 2 81 ? 8.064 19.450 -2.026 1.00 98.71 81 B 1 ATOM 1816 C CA . ILE B 2 81 ? 7.377 18.499 -2.899 1.00 98.78 81 B 1 ATOM 1817 C C . ILE B 2 81 ? 8.415 17.514 -3.423 1.00 98.80 81 B 1 ATOM 1818 O O . ILE B 2 81 ? 9.431 17.927 -3.968 1.00 98.59 81 B 1 ATOM 1819 C CB . ILE B 2 81 ? 6.631 19.212 -4.046 1.00 98.69 81 B 1 ATOM 1820 C CG1 . ILE B 2 81 ? 5.606 20.226 -3.478 1.00 98.13 81 B 1 ATOM 1821 C CG2 . ILE B 2 81 ? 5.941 18.175 -4.956 1.00 98.29 81 B 1 ATOM 1822 C CD1 . ILE B 2 81 ? 4.848 21.024 -4.544 1.00 97.40 81 B 1 ATOM 1823 N N . MET B 2 82 ? 8.157 16.216 -3.314 1.00 98.84 82 B 1 ATOM 1824 C CA . MET B 2 82 ? 8.972 15.184 -3.947 1.00 98.81 82 B 1 ATOM 1825 C C . MET B 2 82 ? 8.127 14.392 -4.936 1.00 98.85 82 B 1 ATOM 1826 O O . MET B 2 82 ? 6.950 14.123 -4.695 1.00 98.64 82 B 1 ATOM 1827 C CB . MET B 2 82 ? 9.629 14.293 -2.884 1.00 98.33 82 B 1 ATOM 1828 C CG . MET B 2 82 ? 10.558 13.239 -3.510 1.00 96.60 82 B 1 ATOM 1829 S SD . MET B 2 82 ? 11.631 12.366 -2.337 1.00 95.90 82 B 1 ATOM 1830 C CE . MET B 2 82 ? 10.391 11.524 -1.312 1.00 89.57 82 B 1 ATOM 1831 N N . MET B 2 83 ? 8.722 13.986 -6.056 1.00 98.61 83 B 1 ATOM 1832 C CA . MET B 2 83 ? 8.075 13.052 -6.967 1.00 98.43 83 B 1 ATOM 1833 C C . MET B 2 83 ? 9.055 12.064 -7.588 1.00 98.66 83 B 1 ATOM 1834 O O . MET B 2 83 ? 10.201 12.391 -7.894 1.00 98.16 83 B 1 ATOM 1835 C CB . MET B 2 83 ? 7.235 13.797 -8.016 1.00 95.60 83 B 1 ATOM 1836 C CG . MET B 2 83 ? 8.058 14.683 -8.952 1.00 87.95 83 B 1 ATOM 1837 S SD . MET B 2 83 ? 7.065 15.558 -10.202 1.00 90.96 83 B 1 ATOM 1838 C CE . MET B 2 83 ? 6.212 16.748 -9.146 1.00 83.56 83 B 1 ATOM 1839 N N . ASP B 2 84 ? 8.572 10.842 -7.808 1.00 98.34 84 B 1 ATOM 1840 C CA . ASP B 2 84 ? 9.278 9.780 -8.524 1.00 98.15 84 B 1 ATOM 1841 C C . ASP B 2 84 ? 8.409 9.334 -9.709 1.00 98.13 84 B 1 ATOM 1842 O O . ASP B 2 84 ? 7.663 8.355 -9.602 1.00 97.49 84 B 1 ATOM 1843 C CB . ASP B 2 84 ? 9.606 8.633 -7.555 1.00 97.51 84 B 1 ATOM 1844 C CG . ASP B 2 84 ? 10.424 7.513 -8.207 1.00 96.63 84 B 1 ATOM 1845 O OD1 . ASP B 2 84 ? 11.091 7.732 -9.244 1.00 94.85 84 B 1 ATOM 1846 O OD2 . ASP B 2 84 ? 10.527 6.413 -7.616 1.00 93.83 84 B 1 ATOM 1847 N N . PRO B 2 85 ? 8.432 10.076 -10.831 1.00 98.11 85 B 1 ATOM 1848 C CA . PRO B 2 85 ? 7.443 9.906 -11.886 1.00 97.88 85 B 1 ATOM 1849 C C . PRO B 2 85 ? 7.508 8.533 -12.564 1.00 97.44 85 B 1 ATOM 1850 O O . PRO B 2 85 ? 8.598 8.003 -12.815 1.00 96.30 85 B 1 ATOM 1851 C CB . PRO B 2 85 ? 7.683 11.046 -12.881 1.00 97.69 85 B 1 ATOM 1852 C CG . PRO B 2 85 ? 8.396 12.112 -12.052 1.00 97.02 85 B 1 ATOM 1853 C CD . PRO B 2 85 ? 9.234 11.272 -11.096 1.00 97.97 85 B 1 ATOM 1854 N N . PRO B 2 86 ? 6.356 7.982 -12.965 1.00 97.66 86 B 1 ATOM 1855 C CA . PRO B 2 86 ? 6.289 6.744 -13.730 1.00 97.06 86 B 1 ATOM 1856 C C . PRO B 2 86 ? 6.602 7.017 -15.212 1.00 96.53 86 B 1 ATOM 1857 O O . PRO B 2 86 ? 5.724 6.979 -16.080 1.00 94.93 86 B 1 ATOM 1858 C CB . PRO B 2 86 ? 4.875 6.212 -13.473 1.00 96.56 86 B 1 ATOM 1859 C CG . PRO B 2 86 ? 4.048 7.487 -13.387 1.00 96.11 86 B 1 ATOM 1860 C CD . PRO B 2 86 ? 4.995 8.463 -12.689 1.00 96.90 86 B 1 ATOM 1861 N N . TRP B 2 87 ? 7.859 7.336 -15.497 1.00 96.66 87 B 1 ATOM 1862 C CA . TRP B 2 87 ? 8.321 7.778 -16.812 1.00 96.21 87 B 1 ATOM 1863 C C . TRP B 2 87 ? 7.974 6.774 -17.916 1.00 95.44 87 B 1 ATOM 1864 O O . TRP B 2 87 ? 8.397 5.617 -17.883 1.00 93.47 87 B 1 ATOM 1865 C CB . TRP B 2 87 ? 9.831 8.002 -16.777 1.00 96.08 87 B 1 ATOM 1866 C CG . TRP B 2 87 ? 10.292 9.077 -15.840 1.00 96.44 87 B 1 ATOM 1867 C CD1 . TRP B 2 87 ? 10.988 8.876 -14.701 1.00 95.21 87 B 1 ATOM 1868 C CD2 . TRP B 2 87 ? 10.092 10.518 -15.954 1.00 96.67 87 B 1 ATOM 1869 N NE1 . TRP B 2 87 ? 11.252 10.100 -14.097 1.00 95.49 87 B 1 ATOM 1870 C CE2 . TRP B 2 87 ? 10.720 11.132 -14.836 1.00 96.29 87 B 1 ATOM 1871 C CE3 . TRP B 2 87 ? 9.452 11.353 -16.896 1.00 96.37 87 B 1 ATOM 1872 C CZ2 . TRP B 2 87 ? 10.712 12.534 -14.653 1.00 96.08 87 B 1 ATOM 1873 C CZ3 . TRP B 2 87 ? 9.441 12.748 -16.710 1.00 95.74 87 B 1 ATOM 1874 C CH2 . TRP B 2 87 ? 10.064 13.327 -15.601 1.00 95.78 87 B 1 ATOM 1875 N N . GLN B 2 88 ? 7.286 7.257 -18.944 1.00 94.56 88 B 1 ATOM 1876 C CA . GLN B 2 88 ? 7.007 6.461 -20.132 1.00 93.24 88 B 1 ATOM 1877 C C . GLN B 2 88 ? 8.254 6.394 -21.020 1.00 91.92 88 B 1 ATOM 1878 O O . GLN B 2 88 ? 8.733 7.404 -21.546 1.00 88.66 88 B 1 ATOM 1879 C CB . GLN B 2 88 ? 5.784 7.034 -20.853 1.00 91.21 88 B 1 ATOM 1880 C CG . GLN B 2 88 ? 5.273 6.069 -21.932 1.00 85.85 88 B 1 ATOM 1881 C CD . GLN B 2 88 ? 3.948 6.536 -22.538 1.00 84.89 88 B 1 ATOM 1882 O OE1 . GLN B 2 88 ? 3.593 7.705 -22.510 1.00 77.19 88 B 1 ATOM 1883 N NE2 . GLN B 2 88 ? 3.180 5.640 -23.105 1.00 74.96 88 B 1 ATOM 1884 N N . LEU B 2 89 ? 8.779 5.184 -21.202 1.00 91.07 89 B 1 ATOM 1885 C CA . LEU B 2 89 ? 9.890 4.927 -22.117 1.00 87.82 89 B 1 ATOM 1886 C C . LEU B 2 89 ? 9.344 4.682 -23.529 1.00 85.71 89 B 1 ATOM 1887 O O . LEU B 2 89 ? 8.409 3.908 -23.714 1.00 76.75 89 B 1 ATOM 1888 C CB . LEU B 2 89 ? 10.734 3.751 -21.602 1.00 83.02 89 B 1 ATOM 1889 C CG . LEU B 2 89 ? 11.471 4.039 -20.279 1.00 77.47 89 B 1 ATOM 1890 C CD1 . LEU B 2 89 ? 12.160 2.769 -19.770 1.00 72.25 89 B 1 ATOM 1891 C CD2 . LEU B 2 89 ? 12.544 5.121 -20.457 1.00 71.58 89 B 1 ATOM 1892 N N . SER B 2 90 ? 9.950 5.333 -24.524 1.00 78.70 90 B 1 ATOM 1893 C CA . SER B 2 90 ? 9.543 5.214 -25.932 1.00 75.98 90 B 1 ATOM 1894 C C . SER B 2 90 ? 9.917 3.878 -26.571 1.00 75.28 90 B 1 ATOM 1895 O O . SER B 2 90 ? 9.299 3.466 -27.546 1.00 66.42 90 B 1 ATOM 1896 C CB . SER B 2 90 ? 10.193 6.347 -26.738 1.00 69.26 90 B 1 ATOM 1897 O OG . SER B 2 90 ? 11.596 6.349 -26.534 1.00 59.98 90 B 1 ATOM 1898 N N . SER B 2 91 ? 10.945 3.208 -26.067 1.00 67.69 91 B 1 ATOM 1899 C CA . SER B 2 91 ? 11.388 1.930 -26.615 1.00 64.94 91 B 1 ATOM 1900 C C . SER B 2 91 ? 10.352 0.845 -26.319 1.00 64.82 91 B 1 ATOM 1901 O O . SER B 2 91 ? 10.166 0.463 -25.162 1.00 58.54 91 B 1 ATOM 1902 C CB . SER B 2 91 ? 12.768 1.551 -26.068 1.00 58.56 91 B 1 ATOM 1903 O OG . SER B 2 91 ? 12.767 1.555 -24.656 1.00 52.77 91 B 1 ATOM 1904 N N . SER B 2 92 ? 9.738 0.322 -27.378 1.00 59.52 92 B 1 ATOM 1905 C CA . SER B 2 92 ? 8.729 -0.749 -27.347 1.00 57.13 92 B 1 ATOM 1906 C C . SER B 2 92 ? 9.211 -2.051 -26.711 1.00 58.16 92 B 1 ATOM 1907 O O . SER B 2 92 ? 8.435 -2.757 -26.076 1.00 53.70 92 B 1 ATOM 1908 C CB . SER B 2 92 ? 8.324 -1.066 -28.789 1.00 50.72 92 B 1 ATOM 1909 O OG . SER B 2 92 ? 9.476 -1.359 -29.566 1.00 47.21 92 B 1 ATOM 1910 N N . GLN B 2 93 ? 10.473 -2.391 -26.938 1.00 56.16 93 B 1 ATOM 1911 C CA . GLN B 2 93 ? 11.083 -3.567 -26.336 1.00 55.22 93 B 1 ATOM 1912 C C . GLN B 2 93 ? 11.409 -3.228 -24.880 1.00 56.91 93 B 1 ATOM 1913 O O . GLN B 2 93 ? 12.336 -2.446 -24.645 1.00 51.60 93 B 1 ATOM 1914 C CB . GLN B 2 93 ? 12.342 -3.972 -27.123 1.00 48.11 93 B 1 ATOM 1915 C CG . GLN B 2 93 ? 12.018 -4.604 -28.492 1.00 42.97 93 B 1 ATOM 1916 C CD . GLN B 2 93 ? 11.562 -6.064 -28.414 1.00 39.13 93 B 1 ATOM 1917 O OE1 . GLN B 2 93 ? 11.799 -6.778 -27.453 1.00 36.14 93 B 1 ATOM 1918 N NE2 . GLN B 2 93 ? 10.905 -6.558 -29.439 1.00 35.84 93 B 1 ATOM 1919 N N . PRO B 2 94 ? 10.684 -3.802 -23.896 1.00 55.39 94 B 1 ATOM 1920 C CA . PRO B 2 94 ? 11.164 -3.752 -22.534 1.00 54.26 94 B 1 ATOM 1921 C C . PRO B 2 94 ? 12.580 -4.330 -22.564 1.00 55.39 94 B 1 ATOM 1922 O O . PRO B 2 94 ? 12.800 -5.451 -23.028 1.00 52.58 94 B 1 ATOM 1923 C CB . PRO B 2 94 ? 10.169 -4.572 -21.702 1.00 50.17 94 B 1 ATOM 1924 C CG . PRO B 2 94 ? 9.486 -5.487 -22.715 1.00 48.76 94 B 1 ATOM 1925 C CD . PRO B 2 94 ? 9.571 -4.723 -24.036 1.00 51.42 94 B 1 ATOM 1926 N N . SER B 2 95 ? 13.569 -3.544 -22.132 1.00 56.28 95 B 1 ATOM 1927 C CA . SER B 2 95 ? 14.905 -4.099 -21.948 1.00 55.41 95 B 1 ATOM 1928 C C . SER B 2 95 ? 14.771 -5.356 -21.091 1.00 56.53 95 B 1 ATOM 1929 O O . SER B 2 95 ? 13.867 -5.430 -20.255 1.00 52.35 95 B 1 ATOM 1930 C CB . SER B 2 95 ? 15.839 -3.063 -21.312 1.00 50.25 95 B 1 ATOM 1931 O OG . SER B 2 95 ? 15.372 -2.664 -20.045 1.00 46.54 95 B 1 ATOM 1932 N N . ARG B 2 96 ? 15.657 -6.343 -21.252 1.00 52.86 96 B 1 ATOM 1933 C CA . ARG B 2 96 ? 15.640 -7.621 -20.499 1.00 52.03 96 B 1 ATOM 1934 C C . ARG B 2 96 ? 15.594 -7.467 -18.964 1.00 54.04 96 B 1 ATOM 1935 O O . ARG B 2 96 ? 15.590 -8.466 -18.246 1.00 50.12 96 B 1 ATOM 1936 C CB . ARG B 2 96 ? 16.888 -8.457 -20.858 1.00 46.46 96 B 1 ATOM 1937 C CG . ARG B 2 96 ? 16.916 -9.030 -22.280 1.00 42.75 96 B 1 ATOM 1938 C CD . ARG B 2 96 ? 18.174 -9.894 -22.410 1.00 40.98 96 B 1 ATOM 1939 N NE . ARG B 2 96 ? 18.291 -10.518 -23.741 1.00 36.69 96 B 1 ATOM 1940 C CZ . ARG B 2 96 ? 19.276 -11.311 -24.144 1.00 33.89 96 B 1 ATOM 1941 N NH1 . ARG B 2 96 ? 20.279 -11.620 -23.367 1.00 30.94 96 B 1 ATOM 1942 N NH2 . ARG B 2 96 ? 19.270 -11.807 -25.350 1.00 29.79 96 B 1 ATOM 1943 N N . GLY B 2 97 ? 15.628 -6.241 -18.460 1.00 57.70 97 B 1 ATOM 1944 C CA . GLY B 2 97 ? 15.424 -5.928 -17.061 1.00 56.44 97 B 1 ATOM 1945 C C . GLY B 2 97 ? 14.008 -6.268 -16.595 1.00 58.52 97 B 1 ATOM 1946 O O . GLY B 2 97 ? 13.126 -6.604 -17.378 1.00 55.14 97 B 1 ATOM 1947 N N . VAL B 2 98 ? 13.816 -6.172 -15.287 1.00 60.08 98 B 1 ATOM 1948 C CA . VAL B 2 98 ? 12.534 -6.471 -14.645 1.00 60.42 98 B 1 ATOM 1949 C C . VAL B 2 98 ? 11.465 -5.548 -15.230 1.00 62.56 98 B 1 ATOM 1950 O O . VAL B 2 98 ? 11.566 -4.335 -15.080 1.00 58.28 98 B 1 ATOM 1951 C CB . VAL B 2 98 ? 12.634 -6.309 -13.120 1.00 55.16 98 B 1 ATOM 1952 C CG1 . VAL B 2 98 ? 11.366 -6.817 -12.436 1.00 48.99 98 B 1 ATOM 1953 C CG2 . VAL B 2 98 ? 13.819 -7.100 -12.536 1.00 49.85 98 B 1 ATOM 1954 N N . ALA B 2 99 ? 10.459 -6.118 -15.902 1.00 61.96 99 B 1 ATOM 1955 C CA . ALA B 2 99 ? 9.292 -5.379 -16.353 1.00 61.83 99 B 1 ATOM 1956 C C . ALA B 2 99 ? 8.654 -4.726 -15.124 1.00 63.94 99 B 1 ATOM 1957 O O . ALA B 2 99 ? 8.281 -5.413 -14.168 1.00 61.15 99 B 1 ATOM 1958 C CB . ALA B 2 99 ? 8.335 -6.326 -17.084 1.00 56.62 99 B 1 ATOM 1959 N N . ILE B 2 100 ? 8.608 -3.388 -15.109 1.00 67.92 100 B 1 ATOM 1960 C CA . ILE B 2 100 ? 7.985 -2.658 -14.016 1.00 67.43 100 B 1 ATOM 1961 C C . ILE B 2 100 ? 6.485 -2.683 -14.284 1.00 68.32 100 B 1 ATOM 1962 O O . ILE B 2 100 ? 6.024 -2.127 -15.277 1.00 64.39 100 B 1 ATOM 1963 C CB . ILE B 2 100 ? 8.565 -1.244 -13.857 1.00 63.04 100 B 1 ATOM 1964 C CG1 . ILE B 2 100 ? 10.110 -1.260 -13.745 1.00 57.82 100 B 1 ATOM 1965 C CG2 . ILE B 2 100 ? 7.959 -0.661 -12.578 1.00 57.18 100 B 1 ATOM 1966 C CD1 . ILE B 2 100 ? 10.751 0.127 -13.633 1.00 53.24 100 B 1 ATOM 1967 N N . ALA B 2 101 ? 5.755 -3.371 -13.420 1.00 69.33 101 B 1 ATOM 1968 C CA . ALA B 2 101 ? 4.329 -3.618 -13.571 1.00 69.97 101 B 1 ATOM 1969 C C . ALA B 2 101 ? 3.489 -2.491 -12.941 1.00 74.66 101 B 1 ATOM 1970 O O . ALA B 2 101 ? 2.658 -2.752 -12.075 1.00 69.83 101 B 1 ATOM 1971 C CB . ALA B 2 101 ? 4.015 -5.014 -13.009 1.00 62.14 101 B 1 ATOM 1972 N N . TYR B 2 102 ? 3.739 -1.237 -13.334 1.00 78.96 102 B 1 ATOM 1973 C CA . TYR B 2 102 ? 2.872 -0.114 -12.989 1.00 80.84 102 B 1 ATOM 1974 C C . TYR B 2 102 ? 2.576 0.749 -14.220 1.00 83.41 102 B 1 ATOM 1975 O O . TYR B 2 102 ? 3.325 0.741 -15.196 1.00 81.13 102 B 1 ATOM 1976 C CB . TYR B 2 102 ? 3.461 0.709 -11.826 1.00 78.16 102 B 1 ATOM 1977 C CG . TYR B 2 102 ? 4.835 1.330 -12.040 1.00 78.94 102 B 1 ATOM 1978 C CD1 . TYR B 2 102 ? 5.912 0.939 -11.219 1.00 71.49 102 B 1 ATOM 1979 C CD2 . TYR B 2 102 ? 5.047 2.336 -13.002 1.00 75.19 102 B 1 ATOM 1980 C CE1 . TYR B 2 102 ? 7.173 1.532 -11.364 1.00 69.07 102 B 1 ATOM 1981 C CE2 . TYR B 2 102 ? 6.312 2.932 -13.167 1.00 71.28 102 B 1 ATOM 1982 C CZ . TYR B 2 102 ? 7.372 2.525 -12.343 1.00 74.06 102 B 1 ATOM 1983 O OH . TYR B 2 102 ? 8.607 3.095 -12.504 1.00 70.28 102 B 1 ATOM 1984 N N . ASP B 2 103 ? 1.478 1.505 -14.153 1.00 86.50 103 B 1 ATOM 1985 C CA . ASP B 2 103 ? 1.093 2.434 -15.207 1.00 88.67 103 B 1 ATOM 1986 C C . ASP B 2 103 ? 2.149 3.535 -15.373 1.00 91.90 103 B 1 ATOM 1987 O O . ASP B 2 103 ? 2.685 4.067 -14.401 1.00 90.54 103 B 1 ATOM 1988 C CB . ASP B 2 103 ? -0.268 3.068 -14.892 1.00 84.64 103 B 1 ATOM 1989 C CG . ASP B 2 103 ? -1.405 2.053 -14.809 1.00 81.42 103 B 1 ATOM 1990 O OD1 . ASP B 2 103 ? -1.415 1.119 -15.645 1.00 74.16 103 B 1 ATOM 1991 O OD2 . ASP B 2 103 ? -2.254 2.233 -13.906 1.00 75.34 103 B 1 ATOM 1992 N N . SER B 2 104 ? 2.426 3.909 -16.619 1.00 93.43 104 B 1 ATOM 1993 C CA . SER B 2 104 ? 3.317 5.020 -16.943 1.00 94.10 104 B 1 ATOM 1994 C C . SER B 2 104 ? 2.530 6.241 -17.407 1.00 95.28 104 B 1 ATOM 1995 O O . SER B 2 104 ? 1.414 6.130 -17.919 1.00 93.95 104 B 1 ATOM 1996 C CB . SER B 2 104 ? 4.370 4.586 -17.966 1.00 91.27 104 B 1 ATOM 1997 O OG . SER B 2 104 ? 3.784 4.262 -19.213 1.00 85.55 104 B 1 ATOM 1998 N N . LEU B 2 105 ? 3.126 7.424 -17.260 1.00 96.52 105 B 1 ATOM 1999 C CA . LEU B 2 105 ? 2.575 8.681 -17.752 1.00 96.74 105 B 1 ATOM 2000 C C . LEU B 2 105 ? 3.485 9.297 -18.817 1.00 96.88 105 B 1 ATOM 2001 O O . LEU B 2 105 ? 4.712 9.247 -18.724 1.00 96.08 105 B 1 ATOM 2002 C CB . LEU B 2 105 ? 2.331 9.647 -16.585 1.00 96.42 105 B 1 ATOM 2003 C CG . LEU B 2 105 ? 1.227 9.216 -15.599 1.00 95.13 105 B 1 ATOM 2004 C CD1 . LEU B 2 105 ? 1.105 10.270 -14.499 1.00 93.12 105 B 1 ATOM 2005 C CD2 . LEU B 2 105 ? -0.140 9.080 -16.272 1.00 93.23 105 B 1 ATOM 2006 N N . SER B 2 106 ? 2.865 9.920 -19.822 1.00 96.49 106 B 1 ATOM 2007 C CA . SER B 2 106 ? 3.595 10.753 -20.779 1.00 96.45 106 B 1 ATOM 2008 C C . SER B 2 106 ? 4.160 11.997 -20.090 1.00 96.95 106 B 1 ATOM 2009 O O . SER B 2 106 ? 3.624 12.458 -19.082 1.00 96.74 106 B 1 ATOM 2010 C CB . SER B 2 106 ? 2.700 11.157 -21.958 1.00 95.55 106 B 1 ATOM 2011 O OG . SER B 2 106 ? 1.632 11.982 -21.536 1.00 92.77 106 B 1 ATOM 2012 N N . ASP B 2 107 ? 5.204 12.573 -20.682 1.00 97.11 107 B 1 ATOM 2013 C CA . ASP B 2 107 ? 5.813 13.812 -20.184 1.00 97.24 107 B 1 ATOM 2014 C C . ASP B 2 107 ? 4.778 14.941 -20.087 1.00 97.51 107 B 1 ATOM 2015 O O . ASP B 2 107 ? 4.759 15.683 -19.113 1.00 97.03 107 B 1 ATOM 2016 C CB . ASP B 2 107 ? 6.971 14.233 -21.110 1.00 96.60 107 B 1 ATOM 2017 C CG . ASP B 2 107 ? 8.106 13.214 -21.198 1.00 95.95 107 B 1 ATOM 2018 O OD1 . ASP B 2 107 ? 8.174 12.264 -20.388 1.00 93.11 107 B 1 ATOM 2019 O OD2 . ASP B 2 107 ? 8.943 13.302 -22.126 1.00 92.80 107 B 1 ATOM 2020 N N . GLU B 2 108 ? 3.864 15.024 -21.048 1.00 96.93 108 B 1 ATOM 2021 C CA . GLU B 2 108 ? 2.781 16.008 -21.063 1.00 96.75 108 B 1 ATOM 2022 C C . GLU B 2 108 ? 1.849 15.862 -19.850 1.00 97.12 108 B 1 ATOM 2023 O O . GLU B 2 108 ? 1.551 16.842 -19.174 1.00 96.50 108 B 1 ATOM 2024 C CB . GLU B 2 108 ? 2.002 15.832 -22.372 1.00 96.03 108 B 1 ATOM 2025 C CG . GLU B 2 108 ? 0.915 16.892 -22.559 1.00 84.88 108 B 1 ATOM 2026 C CD . GLU B 2 108 ? 0.049 16.638 -23.804 1.00 77.64 108 B 1 ATOM 2027 O OE1 . GLU B 2 108 ? -0.830 17.484 -24.061 1.00 68.16 108 B 1 ATOM 2028 O OE2 . GLU B 2 108 ? 0.240 15.584 -24.460 1.00 70.48 108 B 1 ATOM 2029 N N . LYS B 2 109 ? 1.424 14.642 -19.512 1.00 97.58 109 B 1 ATOM 2030 C CA . LYS B 2 109 ? 0.553 14.403 -18.351 1.00 97.45 109 B 1 ATOM 2031 C C . LYS B 2 109 ? 1.236 14.753 -17.029 1.00 97.85 109 B 1 ATOM 2032 O O . LYS B 2 109 ? 0.574 15.244 -16.123 1.00 97.34 109 B 1 ATOM 2033 C CB . LYS B 2 109 ? 0.088 12.945 -18.318 1.00 96.94 109 B 1 ATOM 2034 C CG . LYS B 2 109 ? -0.989 12.644 -19.367 1.00 94.57 109 B 1 ATOM 2035 C CD . LYS B 2 109 ? -1.429 11.188 -19.221 1.00 89.60 109 B 1 ATOM 2036 C CE . LYS B 2 109 ? -2.568 10.852 -20.177 1.00 84.65 109 B 1 ATOM 2037 N NZ . LYS B 2 109 ? -3.088 9.490 -19.918 1.00 75.13 109 B 1 ATOM 2038 N N . ILE B 2 110 ? 2.536 14.501 -16.917 1.00 97.75 110 B 1 ATOM 2039 C CA . ILE B 2 110 ? 3.327 14.880 -15.741 1.00 97.98 110 B 1 ATOM 2040 C C . ILE B 2 110 ? 3.439 16.407 -15.671 1.00 98.14 110 B 1 ATOM 2041 O O . ILE B 2 110 ? 3.128 16.989 -14.636 1.00 97.88 110 B 1 ATOM 2042 C CB . ILE B 2 110 ? 4.702 14.176 -15.754 1.00 97.81 110 B 1 ATOM 2043 C CG1 . ILE B 2 110 ? 4.528 12.639 -15.675 1.00 96.92 110 B 1 ATOM 2044 C CG2 . ILE B 2 110 ? 5.579 14.664 -14.586 1.00 97.15 110 B 1 ATOM 2045 C CD1 . ILE B 2 110 ? 5.798 11.854 -16.022 1.00 94.12 110 B 1 ATOM 2046 N N . GLN B 2 111 ? 3.804 17.058 -16.770 1.00 97.92 111 B 1 ATOM 2047 C CA . GLN B 2 111 ? 3.953 18.518 -16.854 1.00 97.80 111 B 1 ATOM 2048 C C . GLN B 2 111 ? 2.648 19.266 -16.562 1.00 98.03 111 B 1 ATOM 2049 O O . GLN B 2 111 ? 2.684 20.345 -15.972 1.00 97.53 111 B 1 ATOM 2050 C CB . GLN B 2 111 ? 4.480 18.874 -18.252 1.00 96.76 111 B 1 ATOM 2051 C CG . GLN B 2 111 ? 4.697 20.382 -18.499 1.00 92.26 111 B 1 ATOM 2052 C CD . GLN B 2 111 ? 5.811 20.953 -17.621 1.00 87.32 111 B 1 ATOM 2053 O OE1 . GLN B 2 111 ? 6.979 20.861 -17.949 1.00 78.01 111 B 1 ATOM 2054 N NE2 . GLN B 2 111 ? 5.492 21.550 -16.505 1.00 73.83 111 B 1 ATOM 2055 N N . ASN B 2 112 ? 1.501 18.697 -16.940 1.00 97.54 112 B 1 ATOM 2056 C CA . ASN B 2 112 ? 0.180 19.304 -16.760 1.00 97.49 112 B 1 ATOM 2057 C C . ASN B 2 112 ? -0.322 19.286 -15.305 1.00 97.79 112 B 1 ATOM 2058 O O . ASN B 2 112 ? -1.354 19.891 -15.019 1.00 96.78 112 B 1 ATOM 2059 C CB . ASN B 2 112 ? -0.821 18.625 -17.712 1.00 96.53 112 B 1 ATOM 2060 C CG . ASN B 2 112 ? -0.623 19.010 -19.170 1.00 91.06 112 B 1 ATOM 2061 O OD1 . ASN B 2 112 ? 0.101 19.922 -19.515 1.00 81.49 112 B 1 ATOM 2062 N ND2 . ASN B 2 112 ? -1.291 18.325 -20.073 1.00 79.58 112 B 1 ATOM 2063 N N . MET B 2 113 ? 0.370 18.625 -14.372 1.00 97.96 113 B 1 ATOM 2064 C CA . MET B 2 113 ? 0.042 18.767 -12.950 1.00 98.08 113 B 1 ATOM 2065 C C . MET B 2 113 ? 0.272 20.220 -12.503 1.00 98.26 113 B 1 ATOM 2066 O O . MET B 2 113 ? 1.308 20.804 -12.830 1.00 97.84 113 B 1 ATOM 2067 C CB . MET B 2 113 ? 0.867 17.819 -12.082 1.00 97.73 113 B 1 ATOM 2068 C CG . MET B 2 113 ? 0.536 16.343 -12.327 1.00 96.67 113 B 1 ATOM 2069 S SD . MET B 2 113 ? 1.363 15.215 -11.170 1.00 96.22 113 B 1 ATOM 2070 C CE . MET B 2 113 ? 3.092 15.504 -11.583 1.00 89.83 113 B 1 ATOM 2071 N N . PRO B 2 114 ? -0.646 20.816 -11.719 1.00 98.20 114 B 1 ATOM 2072 C CA . PRO B 2 114 ? -0.565 22.227 -11.335 1.00 98.02 114 B 1 ATOM 2073 C C . PRO B 2 114 ? 0.401 22.461 -10.166 1.00 98.16 114 B 1 ATOM 2074 O O . PRO B 2 114 ? 0.041 23.080 -9.163 1.00 97.27 114 B 1 ATOM 2075 C CB . PRO B 2 114 ? -2.018 22.613 -11.038 1.00 97.34 114 B 1 ATOM 2076 C CG . PRO B 2 114 ? -2.579 21.334 -10.430 1.00 96.59 114 B 1 ATOM 2077 C CD . PRO B 2 114 ? -1.897 20.243 -11.256 1.00 97.61 114 B 1 ATOM 2078 N N . ILE B 2 115 ? 1.648 21.990 -10.281 1.00 98.33 115 B 1 ATOM 2079 C CA . ILE B 2 115 ? 2.669 22.045 -9.221 1.00 98.37 115 B 1 ATOM 2080 C C . ILE B 2 115 ? 2.916 23.482 -8.753 1.00 98.23 115 B 1 ATOM 2081 O O . ILE B 2 115 ? 3.084 23.735 -7.559 1.00 97.43 115 B 1 ATOM 2082 C CB . ILE B 2 115 ? 3.979 21.386 -9.702 1.00 98.17 115 B 1 ATOM 2083 C CG1 . ILE B 2 115 ? 3.792 19.928 -10.178 1.00 96.84 115 B 1 ATOM 2084 C CG2 . ILE B 2 115 ? 5.061 21.442 -8.615 1.00 97.29 115 B 1 ATOM 2085 C CD1 . ILE B 2 115 ? 3.169 18.981 -9.149 1.00 93.43 115 B 1 ATOM 2086 N N . GLN B 2 116 ? 2.837 24.453 -9.662 1.00 97.93 116 B 1 ATOM 2087 C CA . GLN B 2 116 ? 2.969 25.878 -9.362 1.00 97.38 116 B 1 ATOM 2088 C C . GLN B 2 116 ? 1.943 26.396 -8.341 1.00 97.41 116 B 1 ATOM 2089 O O . GLN B 2 116 ? 2.209 27.395 -7.678 1.00 95.71 116 B 1 ATOM 2090 C CB . GLN B 2 116 ? 2.916 26.700 -10.663 1.00 95.83 116 B 1 ATOM 2091 C CG . GLN B 2 116 ? 1.575 26.692 -11.445 1.00 89.58 116 B 1 ATOM 2092 C CD . GLN B 2 116 ? 1.351 25.446 -12.311 1.00 87.73 116 B 1 ATOM 2093 O OE1 . GLN B 2 116 ? 2.140 24.516 -12.337 1.00 78.06 116 B 1 ATOM 2094 N NE2 . GLN B 2 116 ? 0.269 25.397 -13.050 1.00 75.55 116 B 1 ATOM 2095 N N . SER B 2 117 ? 0.802 25.717 -8.187 1.00 97.78 117 B 1 ATOM 2096 C CA . SER B 2 117 ? -0.246 26.076 -7.225 1.00 97.39 117 B 1 ATOM 2097 C C . SER B 2 117 ? -0.094 25.373 -5.874 1.00 97.58 117 B 1 ATOM 2098 O O . SER B 2 117 ? -0.711 25.790 -4.899 1.00 96.13 117 B 1 ATOM 2099 C CB . SER B 2 117 ? -1.626 25.769 -7.814 1.00 96.29 117 B 1 ATOM 2100 O OG . SER B 2 117 ? -1.791 26.426 -9.059 1.00 89.74 117 B 1 ATOM 2101 N N . LEU B 2 118 ? 0.735 24.323 -5.793 1.00 98.17 118 B 1 ATOM 2102 C CA . LEU B 2 118 ? 0.930 23.520 -4.576 1.00 98.17 118 B 1 ATOM 2103 C C . LEU B 2 118 ? 2.010 24.082 -3.643 1.00 98.07 118 B 1 ATOM 2104 O O . LEU B 2 118 ? 2.127 23.653 -2.494 1.00 96.91 118 B 1 ATOM 2105 C CB . LEU B 2 118 ? 1.265 22.071 -4.969 1.00 97.97 118 B 1 ATOM 2106 C CG . LEU B 2 118 ? 0.179 21.354 -5.790 1.00 97.13 118 B 1 ATOM 2107 C CD1 . LEU B 2 118 ? 0.669 19.960 -6.174 1.00 95.08 118 B 1 ATOM 2108 C CD2 . LEU B 2 118 ? -1.128 21.199 -5.015 1.00 94.50 118 B 1 ATOM 2109 N N . GLN B 2 119 ? 2.810 25.035 -4.120 1.00 98.02 119 B 1 ATOM 2110 C CA . GLN B 2 119 ? 3.922 25.597 -3.363 1.00 97.82 119 B 1 ATOM 2111 C C . GLN B 2 119 ? 4.127 27.075 -3.699 1.00 97.75 119 B 1 ATOM 2112 O O . GLN B 2 119 ? 4.099 27.474 -4.870 1.00 96.63 119 B 1 ATOM 2113 C CB . GLN B 2 119 ? 5.170 24.749 -3.642 1.00 96.61 119 B 1 ATOM 2114 C CG . GLN B 2 119 ? 6.351 25.113 -2.748 1.00 95.68 119 B 1 ATOM 2115 C CD . GLN B 2 119 ? 7.484 24.107 -2.929 1.00 96.92 119 B 1 ATOM 2116 O OE1 . GLN B 2 119 ? 8.207 24.134 -3.912 1.00 92.19 119 B 1 ATOM 2117 N NE2 . GLN B 2 119 ? 7.641 23.180 -2.012 1.00 91.55 119 B 1 ATOM 2118 N N . GLN B 2 120 ? 4.348 27.890 -2.663 1.00 97.23 120 B 1 ATOM 2119 C CA . GLN B 2 120 ? 4.728 29.302 -2.794 1.00 96.77 120 B 1 ATOM 2120 C C . GLN B 2 120 ? 6.237 29.466 -2.638 1.00 97.13 120 B 1 ATOM 2121 O O . GLN B 2 120 ? 6.894 29.954 -3.559 1.00 95.10 120 B 1 ATOM 2122 C CB . GLN B 2 120 ? 3.957 30.154 -1.776 1.00 94.93 120 B 1 ATOM 2123 C CG . GLN B 2 120 ? 2.455 30.183 -2.098 1.00 85.37 120 B 1 ATOM 2124 C CD . GLN B 2 120 ? 1.651 31.046 -1.125 1.00 78.59 120 B 1 ATOM 2125 O OE1 . GLN B 2 120 ? 2.150 31.595 -0.157 1.00 70.16 120 B 1 ATOM 2126 N NE2 . GLN B 2 120 ? 0.366 31.200 -1.351 1.00 66.18 120 B 1 ATOM 2127 N N . ASP B 2 121 ? 6.774 29.002 -1.508 1.00 97.62 121 B 1 ATOM 2128 C CA . ASP B 2 121 ? 8.185 29.069 -1.138 1.00 97.49 121 B 1 ATOM 2129 C C . ASP B 2 121 ? 8.661 27.684 -0.707 1.00 97.64 121 B 1 ATOM 2130 O O . ASP B 2 121 ? 8.076 27.081 0.198 1.00 96.18 121 B 1 ATOM 2131 C CB . ASP B 2 121 ? 8.383 30.041 0.029 1.00 96.73 121 B 1 ATOM 2132 C CG . ASP B 2 121 ? 7.695 31.381 -0.184 1.00 96.22 121 B 1 ATOM 2133 O OD1 . ASP B 2 121 ? 8.183 32.161 -1.030 1.00 92.53 121 B 1 ATOM 2134 O OD2 . ASP B 2 121 ? 6.671 31.605 0.502 1.00 92.46 121 B 1 ATOM 2135 N N . GLY B 2 122 ? 9.728 27.185 -1.332 1.00 97.88 122 B 1 ATOM 2136 C CA . GLY B 2 122 ? 10.265 25.878 -0.976 1.00 98.05 122 B 1 ATOM 2137 C C . GLY B 2 122 ? 11.007 25.182 -2.097 1.00 98.40 122 B 1 ATOM 2138 O O . GLY B 2 122 ? 11.451 25.804 -3.062 1.00 97.90 122 B 1 ATOM 2139 N N . PHE B 2 123 ? 11.145 23.878 -1.951 1.00 98.53 123 B 1 ATOM 2140 C CA . PHE B 2 123 ? 11.920 23.038 -2.849 1.00 98.58 123 B 1 ATOM 2141 C C . PHE B 2 123 ? 11.057 21.970 -3.516 1.00 98.68 123 B 1 ATOM 2142 O O . PHE B 2 123 ? 10.115 21.437 -2.927 1.00 98.46 123 B 1 ATOM 2143 C CB . PHE B 2 123 ? 13.099 22.415 -2.102 1.00 98.40 123 B 1 ATOM 2144 C CG . PHE B 2 123 ? 14.086 23.426 -1.554 1.00 98.34 123 B 1 ATOM 2145 C CD1 . PHE B 2 123 ? 15.192 23.834 -2.325 1.00 97.33 123 B 1 ATOM 2146 C CD2 . PHE B 2 123 ? 13.902 23.971 -0.270 1.00 97.29 123 B 1 ATOM 2147 C CE1 . PHE B 2 123 ? 16.112 24.765 -1.819 1.00 96.75 123 B 1 ATOM 2148 C CE2 . PHE B 2 123 ? 14.818 24.909 0.244 1.00 96.76 123 B 1 ATOM 2149 C CZ . PHE B 2 123 ? 15.925 25.303 -0.529 1.00 97.13 123 B 1 ATOM 2150 N N . ILE B 2 124 ? 11.429 21.625 -4.736 1.00 98.67 124 B 1 ATOM 2151 C CA . ILE B 2 124 ? 10.915 20.454 -5.441 1.00 98.74 124 B 1 ATOM 2152 C C . ILE B 2 124 ? 12.047 19.461 -5.680 1.00 98.78 124 B 1 ATOM 2153 O O . ILE B 2 124 ? 13.141 19.840 -6.086 1.00 98.52 124 B 1 ATOM 2154 C CB . ILE B 2 124 ? 10.170 20.851 -6.726 1.00 98.52 124 B 1 ATOM 2155 C CG1 . ILE B 2 124 ? 9.396 19.642 -7.286 1.00 97.80 124 B 1 ATOM 2156 C CG2 . ILE B 2 124 ? 11.114 21.460 -7.789 1.00 97.32 124 B 1 ATOM 2157 C CD1 . ILE B 2 124 ? 8.439 20.009 -8.422 1.00 95.49 124 B 1 ATOM 2158 N N . PHE B 2 125 ? 11.779 18.189 -5.437 1.00 98.80 125 B 1 ATOM 2159 C CA . PHE B 2 125 ? 12.684 17.067 -5.649 1.00 98.81 125 B 1 ATOM 2160 C C . PHE B 2 125 ? 12.069 16.150 -6.705 1.00 98.82 125 B 1 ATOM 2161 O O . PHE B 2 125 ? 11.003 15.576 -6.485 1.00 98.54 125 B 1 ATOM 2162 C CB . PHE B 2 125 ? 12.891 16.324 -4.322 1.00 98.68 125 B 1 ATOM 2163 C CG . PHE B 2 125 ? 13.754 17.039 -3.298 1.00 98.62 125 B 1 ATOM 2164 C CD1 . PHE B 2 125 ? 15.002 16.497 -2.929 1.00 97.58 125 B 1 ATOM 2165 C CD2 . PHE B 2 125 ? 13.321 18.228 -2.690 1.00 97.71 125 B 1 ATOM 2166 C CE1 . PHE B 2 125 ? 15.810 17.141 -1.979 1.00 97.01 125 B 1 ATOM 2167 C CE2 . PHE B 2 125 ? 14.131 18.885 -1.744 1.00 97.01 125 B 1 ATOM 2168 C CZ . PHE B 2 125 ? 15.377 18.340 -1.389 1.00 97.53 125 B 1 ATOM 2169 N N . VAL B 2 126 ? 12.728 15.988 -7.846 1.00 98.77 126 B 1 ATOM 2170 C CA . VAL B 2 126 ? 12.231 15.138 -8.933 1.00 98.75 126 B 1 ATOM 2171 C C . VAL B 2 126 ? 13.259 14.073 -9.278 1.00 98.75 126 B 1 ATOM 2172 O O . VAL B 2 126 ? 14.329 14.367 -9.812 1.00 98.40 126 B 1 ATOM 2173 C CB . VAL B 2 126 ? 11.817 15.944 -10.178 1.00 98.56 126 B 1 ATOM 2174 C CG1 . VAL B 2 126 ? 11.102 15.035 -11.185 1.00 97.69 126 B 1 ATOM 2175 C CG2 . VAL B 2 126 ? 10.871 17.100 -9.829 1.00 97.75 126 B 1 ATOM 2176 N N . TRP B 2 127 ? 12.925 12.815 -9.007 1.00 98.64 127 B 1 ATOM 2177 C CA . TRP B 2 127 ? 13.730 11.678 -9.443 1.00 98.58 127 B 1 ATOM 2178 C C . TRP B 2 127 ? 13.642 11.524 -10.963 1.00 98.30 127 B 1 ATOM 2179 O O . TRP B 2 127 ? 12.562 11.329 -11.525 1.00 97.54 127 B 1 ATOM 2180 C CB . TRP B 2 127 ? 13.288 10.412 -8.716 1.00 98.55 127 B 1 ATOM 2181 C CG . TRP B 2 127 ? 13.614 10.401 -7.250 1.00 98.59 127 B 1 ATOM 2182 C CD1 . TRP B 2 127 ? 12.777 10.759 -6.254 1.00 98.16 127 B 1 ATOM 2183 C CD2 . TRP B 2 127 ? 14.885 10.046 -6.614 1.00 98.46 127 B 1 ATOM 2184 N NE1 . TRP B 2 127 ? 13.436 10.643 -5.031 1.00 97.98 127 B 1 ATOM 2185 C CE2 . TRP B 2 127 ? 14.729 10.212 -5.212 1.00 98.23 127 B 1 ATOM 2186 C CE3 . TRP B 2 127 ? 16.135 9.603 -7.096 1.00 98.29 127 B 1 ATOM 2187 C CZ2 . TRP B 2 127 ? 15.784 9.957 -4.306 1.00 97.93 127 B 1 ATOM 2188 C CZ3 . TRP B 2 127 ? 17.189 9.345 -6.190 1.00 97.59 127 B 1 ATOM 2189 C CH2 . TRP B 2 127 ? 17.014 9.523 -4.815 1.00 97.46 127 B 1 ATOM 2190 N N . ALA B 2 128 ? 14.784 11.573 -11.633 1.00 97.83 128 B 1 ATOM 2191 C CA . ALA B 2 128 ? 14.867 11.490 -13.082 1.00 97.23 128 B 1 ATOM 2192 C C . ALA B 2 128 ? 15.728 10.302 -13.520 1.00 96.55 128 B 1 ATOM 2193 O O . ALA B 2 128 ? 16.895 10.170 -13.156 1.00 94.15 128 B 1 ATOM 2194 C CB . ALA B 2 128 ? 15.393 12.821 -13.627 1.00 96.28 128 B 1 ATOM 2195 N N . ILE B 2 129 ? 15.164 9.465 -14.378 1.00 95.93 129 B 1 ATOM 2196 C CA . ILE B 2 129 ? 15.976 8.493 -15.118 1.00 94.71 129 B 1 ATOM 2197 C C . ILE B 2 129 ? 16.833 9.222 -16.159 1.00 95.11 129 B 1 ATOM 2198 O O . ILE B 2 129 ? 16.458 10.281 -16.664 1.00 94.41 129 B 1 ATOM 2199 C CB . ILE B 2 129 ? 15.112 7.382 -15.757 1.00 92.78 129 B 1 ATOM 2200 C CG1 . ILE B 2 129 ? 14.107 7.941 -16.785 1.00 88.58 129 B 1 ATOM 2201 C CG2 . ILE B 2 129 ? 14.409 6.577 -14.648 1.00 87.27 129 B 1 ATOM 2202 C CD1 . ILE B 2 129 ? 13.355 6.855 -17.571 1.00 84.27 129 B 1 ATOM 2203 N N . ASN B 2 130 ? 17.954 8.618 -16.549 1.00 93.17 130 B 1 ATOM 2204 C CA . ASN B 2 130 ? 18.915 9.239 -17.471 1.00 92.84 130 B 1 ATOM 2205 C C . ASN B 2 130 ? 18.276 9.752 -18.783 1.00 93.96 130 B 1 ATOM 2206 O O . ASN B 2 130 ? 18.540 10.872 -19.219 1.00 93.27 130 B 1 ATOM 2207 C CB . ASN B 2 130 ? 20.026 8.202 -17.739 1.00 91.14 130 B 1 ATOM 2208 C CG . ASN B 2 130 ? 21.251 8.821 -18.389 1.00 86.67 130 B 1 ATOM 2209 O OD1 . ASN B 2 130 ? 21.537 9.983 -18.255 1.00 78.36 130 B 1 ATOM 2210 N ND2 . ASN B 2 130 ? 22.028 8.042 -19.106 1.00 76.74 130 B 1 ATOM 2211 N N . ALA B 2 131 ? 17.372 8.974 -19.379 1.00 92.91 131 B 1 ATOM 2212 C CA . ALA B 2 131 ? 16.655 9.354 -20.603 1.00 92.98 131 B 1 ATOM 2213 C C . ALA B 2 131 ? 15.711 10.562 -20.426 1.00 94.49 131 B 1 ATOM 2214 O O . ALA B 2 131 ? 15.336 11.200 -21.410 1.00 93.74 131 B 1 ATOM 2215 C CB . ALA B 2 131 ? 15.885 8.125 -21.100 1.00 91.35 131 B 1 ATOM 2216 N N . LYS B 2 132 ? 15.317 10.886 -19.189 1.00 95.32 132 B 1 ATOM 2217 C CA . LYS B 2 132 ? 14.386 11.971 -18.846 1.00 96.44 132 B 1 ATOM 2218 C C . LYS B 2 132 ? 15.057 13.143 -18.134 1.00 97.28 132 B 1 ATOM 2219 O O . LYS B 2 132 ? 14.385 14.108 -17.806 1.00 96.83 132 B 1 ATOM 2220 C CB . LYS B 2 132 ? 13.203 11.397 -18.048 1.00 96.09 132 B 1 ATOM 2221 C CG . LYS B 2 132 ? 12.343 10.388 -18.838 1.00 94.83 132 B 1 ATOM 2222 C CD . LYS B 2 132 ? 11.639 11.032 -20.036 1.00 92.65 132 B 1 ATOM 2223 C CE . LYS B 2 132 ? 10.685 10.043 -20.703 1.00 90.72 132 B 1 ATOM 2224 N NZ . LYS B 2 132 ? 9.902 10.686 -21.771 1.00 87.30 132 B 1 ATOM 2225 N N . TYR B 2 133 ? 16.376 13.116 -17.975 1.00 96.35 133 B 1 ATOM 2226 C CA . TYR B 2 133 ? 17.123 14.153 -17.264 1.00 96.98 133 B 1 ATOM 2227 C C . TYR B 2 133 ? 16.842 15.568 -17.812 1.00 97.46 133 B 1 ATOM 2228 O O . TYR B 2 133 ? 16.421 16.463 -17.080 1.00 97.11 133 B 1 ATOM 2229 C CB . TYR B 2 133 ? 18.611 13.798 -17.341 1.00 96.67 133 B 1 ATOM 2230 C CG . TYR B 2 133 ? 19.474 14.606 -16.406 1.00 96.60 133 B 1 ATOM 2231 C CD1 . TYR B 2 133 ? 19.894 15.904 -16.756 1.00 94.11 133 B 1 ATOM 2232 C CD2 . TYR B 2 133 ? 19.859 14.055 -15.168 1.00 94.36 133 B 1 ATOM 2233 C CE1 . TYR B 2 133 ? 20.696 16.654 -15.881 1.00 93.32 133 B 1 ATOM 2234 C CE2 . TYR B 2 133 ? 20.664 14.792 -14.289 1.00 93.12 133 B 1 ATOM 2235 C CZ . TYR B 2 133 ? 21.079 16.094 -14.650 1.00 94.03 133 B 1 ATOM 2236 O OH . TYR B 2 133 ? 21.867 16.822 -13.797 1.00 92.55 133 B 1 ATOM 2237 N N . ARG B 2 134 ? 16.986 15.765 -19.124 1.00 96.97 134 B 1 ATOM 2238 C CA . ARG B 2 134 ? 16.773 17.078 -19.763 1.00 96.98 134 B 1 ATOM 2239 C C . ARG B 2 134 ? 15.316 17.547 -19.713 1.00 97.51 134 B 1 ATOM 2240 O O . ARG B 2 134 ? 15.078 18.737 -19.564 1.00 96.79 134 B 1 ATOM 2241 C CB . ARG B 2 134 ? 17.241 17.052 -21.224 1.00 96.21 134 B 1 ATOM 2242 C CG . ARG B 2 134 ? 18.765 16.937 -21.364 1.00 87.83 134 B 1 ATOM 2243 C CD . ARG B 2 134 ? 19.139 17.004 -22.840 1.00 84.35 134 B 1 ATOM 2244 N NE . ARG B 2 134 ? 20.595 16.894 -23.050 1.00 73.29 134 B 1 ATOM 2245 C CZ . ARG B 2 134 ? 21.220 16.876 -24.216 1.00 64.80 134 B 1 ATOM 2246 N NH1 . ARG B 2 134 ? 20.568 16.953 -25.344 1.00 57.80 134 B 1 ATOM 2247 N NH2 . ARG B 2 134 ? 22.515 16.772 -24.262 1.00 57.67 134 B 1 ATOM 2248 N N . VAL B 2 135 ? 14.354 16.645 -19.890 1.00 97.46 135 B 1 ATOM 2249 C CA . VAL B 2 135 ? 12.937 17.028 -19.828 1.00 97.35 135 B 1 ATOM 2250 C C . VAL B 2 135 ? 12.539 17.376 -18.398 1.00 97.97 135 B 1 ATOM 2251 O O . VAL B 2 135 ? 11.779 18.309 -18.207 1.00 97.42 135 B 1 ATOM 2252 C CB . VAL B 2 135 ? 12.011 15.982 -20.488 1.00 95.55 135 B 1 ATOM 2253 C CG1 . VAL B 2 135 ? 11.884 14.671 -19.717 1.00 87.71 135 B 1 ATOM 2254 C CG2 . VAL B 2 135 ? 10.615 16.558 -20.701 1.00 87.03 135 B 1 ATOM 2255 N N . THR B 2 136 ? 13.119 16.724 -17.399 1.00 98.02 136 B 1 ATOM 2256 C CA . THR B 2 136 ? 12.888 17.030 -15.983 1.00 98.20 136 B 1 ATOM 2257 C C . THR B 2 136 ? 13.340 18.442 -15.631 1.00 98.39 136 B 1 ATOM 2258 O O . THR B 2 136 ? 12.590 19.161 -14.981 1.00 98.12 136 B 1 ATOM 2259 C CB . THR B 2 136 ? 13.585 16.012 -15.079 1.00 97.89 136 B 1 ATOM 2260 O OG1 . THR B 2 136 ? 13.136 14.713 -15.394 1.00 94.93 136 B 1 ATOM 2261 C CG2 . THR B 2 136 ? 13.272 16.244 -13.604 1.00 95.19 136 B 1 ATOM 2262 N N . ILE B 2 137 ? 14.501 18.887 -16.107 1.00 98.29 137 B 1 ATOM 2263 C CA . ILE B 2 137 ? 14.957 20.276 -15.925 1.00 98.24 137 B 1 ATOM 2264 C C . ILE B 2 137 ? 13.911 21.246 -16.482 1.00 98.34 137 B 1 ATOM 2265 O O . ILE B 2 137 ? 13.452 22.133 -15.767 1.00 97.91 137 B 1 ATOM 2266 C CB . ILE B 2 137 ? 16.344 20.509 -16.563 1.00 97.86 137 B 1 ATOM 2267 C CG1 . ILE B 2 137 ? 17.412 19.618 -15.885 1.00 96.38 137 B 1 ATOM 2268 C CG2 . ILE B 2 137 ? 16.741 21.996 -16.461 1.00 96.49 137 B 1 ATOM 2269 C CD1 . ILE B 2 137 ? 18.786 19.647 -16.566 1.00 93.11 137 B 1 ATOM 2270 N N . LYS B 2 138 ? 13.454 21.032 -17.719 1.00 98.36 138 B 1 ATOM 2271 C CA . LYS B 2 138 ? 12.428 21.876 -18.345 1.00 98.27 138 B 1 ATOM 2272 C C . LYS B 2 138 ? 11.103 21.859 -17.579 1.00 98.38 138 B 1 ATOM 2273 O O . LYS B 2 138 ? 10.457 22.894 -17.472 1.00 97.73 138 B 1 ATOM 2274 C CB . LYS B 2 138 ? 12.183 21.449 -19.792 1.00 97.80 138 B 1 ATOM 2275 C CG . LYS B 2 138 ? 13.387 21.743 -20.692 1.00 85.42 138 B 1 ATOM 2276 C CD . LYS B 2 138 ? 13.041 21.357 -22.129 1.00 77.80 138 B 1 ATOM 2277 C CE . LYS B 2 138 ? 14.193 21.727 -23.056 1.00 65.46 138 B 1 ATOM 2278 N NZ . LYS B 2 138 ? 13.811 21.559 -24.483 1.00 56.06 138 B 1 ATOM 2279 N N . MET B 2 139 ? 10.681 20.717 -17.053 1.00 98.28 139 B 1 ATOM 2280 C CA . MET B 2 139 ? 9.467 20.618 -16.233 1.00 98.17 139 B 1 ATOM 2281 C C . MET B 2 139 ? 9.579 21.454 -14.960 1.00 98.40 139 B 1 ATOM 2282 O O . MET B 2 139 ? 8.668 22.220 -14.651 1.00 98.04 139 B 1 ATOM 2283 C CB . MET B 2 139 ? 9.188 19.161 -15.851 1.00 97.43 139 B 1 ATOM 2284 C CG . MET B 2 139 ? 8.634 18.336 -17.005 1.00 92.99 139 B 1 ATOM 2285 S SD . MET B 2 139 ? 8.353 16.605 -16.539 1.00 92.33 139 B 1 ATOM 2286 C CE . MET B 2 139 ? 7.574 16.018 -18.048 1.00 83.31 139 B 1 ATOM 2287 N N . ILE B 2 140 ? 10.700 21.339 -14.251 1.00 98.42 140 B 1 ATOM 2288 C CA . ILE B 2 140 ? 10.988 22.111 -13.036 1.00 98.34 140 B 1 ATOM 2289 C C . ILE B 2 140 ? 10.954 23.619 -13.333 1.00 98.41 140 B 1 ATOM 2290 O O . ILE B 2 140 ? 10.303 24.376 -12.617 1.00 97.84 140 B 1 ATOM 2291 C CB . ILE B 2 140 ? 12.342 21.642 -12.445 1.00 97.49 140 B 1 ATOM 2292 C CG1 . ILE B 2 140 ? 12.174 20.247 -11.793 1.00 93.29 140 B 1 ATOM 2293 C CG2 . ILE B 2 140 ? 12.907 22.641 -11.425 1.00 93.08 140 B 1 ATOM 2294 C CD1 . ILE B 2 140 ? 13.503 19.598 -11.368 1.00 91.53 140 B 1 ATOM 2295 N N . GLU B 2 141 ? 11.601 24.050 -14.415 1.00 98.39 141 B 1 ATOM 2296 C CA . GLU B 2 141 ? 11.610 25.452 -14.852 1.00 98.32 141 B 1 ATOM 2297 C C . GLU B 2 141 ? 10.204 25.940 -15.245 1.00 98.27 141 B 1 ATOM 2298 O O . GLU B 2 141 ? 9.778 27.011 -14.815 1.00 97.64 141 B 1 ATOM 2299 C CB . GLU B 2 141 ? 12.589 25.614 -16.027 1.00 98.10 141 B 1 ATOM 2300 C CG . GLU B 2 141 ? 14.057 25.462 -15.599 1.00 96.71 141 B 1 ATOM 2301 C CD . GLU B 2 141 ? 15.048 25.422 -16.776 1.00 95.64 141 B 1 ATOM 2302 O OE1 . GLU B 2 141 ? 16.257 25.629 -16.521 1.00 89.76 141 B 1 ATOM 2303 O OE2 . GLU B 2 141 ? 14.627 25.153 -17.930 1.00 91.82 141 B 1 ATOM 2304 N N . ASN B 2 142 ? 9.439 25.139 -15.985 1.00 98.31 142 B 1 ATOM 2305 C CA . ASN B 2 142 ? 8.071 25.466 -16.393 1.00 98.12 142 B 1 ATOM 2306 C C . ASN B 2 142 ? 7.108 25.590 -15.202 1.00 98.14 142 B 1 ATOM 2307 O O . ASN B 2 142 ? 6.157 26.367 -15.261 1.00 97.08 142 B 1 ATOM 2308 C CB . ASN B 2 142 ? 7.553 24.390 -17.355 1.00 97.67 142 B 1 ATOM 2309 C CG . ASN B 2 142 ? 8.140 24.461 -18.749 1.00 95.06 142 B 1 ATOM 2310 O OD1 . ASN B 2 142 ? 8.743 25.421 -19.183 1.00 86.35 142 B 1 ATOM 2311 N ND2 . ASN B 2 142 ? 7.925 23.424 -19.530 1.00 85.97 142 B 1 ATOM 2312 N N . TRP B 2 143 ? 7.331 24.862 -14.105 1.00 98.12 143 B 1 ATOM 2313 C CA . TRP B 2 143 ? 6.581 25.028 -12.856 1.00 98.14 143 B 1 ATOM 2314 C C . TRP B 2 143 ? 7.022 26.254 -12.032 1.00 98.11 143 B 1 ATOM 2315 O O . TRP B 2 143 ? 6.417 26.545 -10.998 1.00 97.35 143 B 1 ATOM 2316 C CB . TRP B 2 143 ? 6.647 23.732 -12.044 1.00 98.05 143 B 1 ATOM 2317 C CG . TRP B 2 143 ? 5.900 22.562 -12.619 1.00 98.12 143 B 1 ATOM 2318 C CD1 . TRP B 2 143 ? 4.693 22.610 -13.234 1.00 97.46 143 B 1 ATOM 2319 C CD2 . TRP B 2 143 ? 6.287 21.155 -12.595 1.00 98.03 143 B 1 ATOM 2320 N NE1 . TRP B 2 143 ? 4.300 21.319 -13.588 1.00 97.33 143 B 1 ATOM 2321 C CE2 . TRP B 2 143 ? 5.247 20.402 -13.207 1.00 97.75 143 B 1 ATOM 2322 C CE3 . TRP B 2 143 ? 7.407 20.453 -12.096 1.00 97.81 143 B 1 ATOM 2323 C CZ2 . TRP B 2 143 ? 5.313 18.992 -13.322 1.00 97.27 143 B 1 ATOM 2324 C CZ3 . TRP B 2 143 ? 7.469 19.050 -12.217 1.00 97.14 143 B 1 ATOM 2325 C CH2 . TRP B 2 143 ? 6.433 18.335 -12.826 1.00 96.93 143 B 1 ATOM 2326 N N . GLY B 2 144 ? 8.029 26.993 -12.488 1.00 97.99 144 B 1 ATOM 2327 C CA . GLY B 2 144 ? 8.495 28.234 -11.865 1.00 97.73 144 B 1 ATOM 2328 C C . GLY B 2 144 ? 9.634 28.056 -10.864 1.00 98.05 144 B 1 ATOM 2329 O O . GLY B 2 144 ? 9.861 28.950 -10.047 1.00 96.86 144 B 1 ATOM 2330 N N . TYR B 2 145 ? 10.341 26.938 -10.908 1.00 98.29 145 B 1 ATOM 2331 C CA . TYR B 2 145 ? 11.511 26.682 -10.074 1.00 98.47 145 B 1 ATOM 2332 C C . TYR B 2 145 ? 12.802 27.023 -10.815 1.00 98.48 145 B 1 ATOM 2333 O O . TYR B 2 145 ? 12.911 26.872 -12.028 1.00 97.87 145 B 1 ATOM 2334 C CB . TYR B 2 145 ? 11.549 25.225 -9.603 1.00 98.39 145 B 1 ATOM 2335 C CG . TYR B 2 145 ? 10.362 24.812 -8.763 1.00 98.56 145 B 1 ATOM 2336 C CD1 . TYR B 2 145 ? 10.434 24.840 -7.357 1.00 97.86 145 B 1 ATOM 2337 C CD2 . TYR B 2 145 ? 9.168 24.407 -9.383 1.00 97.96 145 B 1 ATOM 2338 C CE1 . TYR B 2 145 ? 9.326 24.474 -6.578 1.00 97.74 145 B 1 ATOM 2339 C CE2 . TYR B 2 145 ? 8.048 24.046 -8.615 1.00 97.79 145 B 1 ATOM 2340 C CZ . TYR B 2 145 ? 8.131 24.083 -7.214 1.00 98.16 145 B 1 ATOM 2341 O OH . TYR B 2 145 ? 7.030 23.746 -6.474 1.00 97.56 145 B 1 ATOM 2342 N N . LYS B 2 146 ? 13.823 27.403 -10.047 1.00 98.35 146 B 1 ATOM 2343 C CA . LYS B 2 146 ? 15.209 27.441 -10.502 1.00 98.29 146 B 1 ATOM 2344 C C . LYS B 2 146 ? 15.893 26.142 -10.089 1.00 98.36 146 B 1 ATOM 2345 O O . LYS B 2 146 ? 15.858 25.795 -8.912 1.00 97.57 146 B 1 ATOM 2346 C CB . LYS B 2 146 ? 15.887 28.680 -9.907 1.00 97.71 146 B 1 ATOM 2347 C CG . LYS B 2 146 ? 17.346 28.811 -10.354 1.00 89.07 146 B 1 ATOM 2348 C CD . LYS B 2 146 ? 18.001 30.022 -9.677 1.00 85.03 146 B 1 ATOM 2349 C CE . LYS B 2 146 ? 19.474 30.079 -10.054 1.00 70.59 146 B 1 ATOM 2350 N NZ . LYS B 2 146 ? 20.184 31.156 -9.319 1.00 62.34 146 B 1 ATOM 2351 N N . LEU B 2 147 ? 16.537 25.444 -11.029 1.00 98.37 147 B 1 ATOM 2352 C CA . LEU B 2 147 ? 17.386 24.300 -10.697 1.00 98.15 147 B 1 ATOM 2353 C C . LEU B 2 147 ? 18.587 24.786 -9.875 1.00 98.02 147 B 1 ATOM 2354 O O . LEU B 2 147 ? 19.281 25.713 -10.294 1.00 96.66 147 B 1 ATOM 2355 C CB . LEU B 2 147 ? 17.824 23.599 -11.989 1.00 97.40 147 B 1 ATOM 2356 C CG . LEU B 2 147 ? 18.590 22.277 -11.744 1.00 93.30 147 B 1 ATOM 2357 C CD1 . LEU B 2 147 ? 17.638 21.154 -11.319 1.00 87.50 147 B 1 ATOM 2358 C CD2 . LEU B 2 147 ? 19.290 21.840 -13.026 1.00 87.44 147 B 1 ATOM 2359 N N . VAL B 2 148 ? 18.821 24.184 -8.707 1.00 98.01 148 B 1 ATOM 2360 C CA . VAL B 2 148 ? 19.869 24.605 -7.765 1.00 97.42 148 B 1 ATOM 2361 C C . VAL B 2 148 ? 20.792 23.487 -7.325 1.00 97.28 148 B 1 ATOM 2362 O O . VAL B 2 148 ? 21.929 23.779 -6.971 1.00 94.63 148 B 1 ATOM 2363 C CB . VAL B 2 148 ? 19.297 25.298 -6.514 1.00 96.02 148 B 1 ATOM 2364 C CG1 . VAL B 2 148 ? 18.735 26.673 -6.896 1.00 92.32 148 B 1 ATOM 2365 C CG2 . VAL B 2 148 ? 18.222 24.484 -5.781 1.00 92.98 148 B 1 ATOM 2366 N N . ASP B 2 149 ? 20.335 22.248 -7.339 1.00 97.43 149 B 1 ATOM 2367 C CA . ASP B 2 149 ? 21.123 21.118 -6.843 1.00 97.64 149 B 1 ATOM 2368 C C . ASP B 2 149 ? 20.666 19.784 -7.447 1.00 98.05 149 B 1 ATOM 2369 O O . ASP B 2 149 ? 19.652 19.701 -8.153 1.00 97.13 149 B 1 ATOM 2370 C CB . ASP B 2 149 ? 21.060 21.099 -5.297 1.00 96.45 149 B 1 ATOM 2371 C CG . ASP B 2 149 ? 22.400 20.727 -4.664 1.00 94.08 149 B 1 ATOM 2372 O OD1 . ASP B 2 149 ? 23.157 19.976 -5.324 1.00 88.12 149 B 1 ATOM 2373 O OD2 . ASP B 2 149 ? 22.667 21.222 -3.547 1.00 88.17 149 B 1 ATOM 2374 N N . GLU B 2 150 ? 21.433 18.727 -7.173 1.00 97.87 150 B 1 ATOM 2375 C CA . GLU B 2 150 ? 21.112 17.353 -7.543 1.00 97.97 150 B 1 ATOM 2376 C C . GLU B 2 150 ? 21.630 16.401 -6.468 1.00 98.28 150 B 1 ATOM 2377 O O . GLU B 2 150 ? 22.826 16.346 -6.202 1.00 97.15 150 B 1 ATOM 2378 C CB . GLU B 2 150 ? 21.730 17.013 -8.919 1.00 96.05 150 B 1 ATOM 2379 C CG . GLU B 2 150 ? 21.548 15.522 -9.296 1.00 93.65 150 B 1 ATOM 2380 C CD . GLU B 2 150 ? 22.136 15.127 -10.665 1.00 94.39 150 B 1 ATOM 2381 O OE1 . GLU B 2 150 ? 22.420 13.922 -10.874 1.00 86.30 150 B 1 ATOM 2382 O OE2 . GLU B 2 150 ? 22.270 15.969 -11.573 1.00 88.78 150 B 1 ATOM 2383 N N . ILE B 2 151 ? 20.759 15.567 -5.922 1.00 98.30 151 B 1 ATOM 2384 C CA . ILE B 2 151 ? 21.180 14.432 -5.100 1.00 98.28 151 B 1 ATOM 2385 C C . ILE B 2 151 ? 21.447 13.235 -6.007 1.00 98.33 151 B 1 ATOM 2386 O O . ILE B 2 151 ? 20.579 12.778 -6.755 1.00 97.80 151 B 1 ATOM 2387 C CB . ILE B 2 151 ? 20.175 14.127 -3.973 1.00 97.81 151 B 1 ATOM 2388 C CG1 . ILE B 2 151 ? 20.215 15.262 -2.928 1.00 95.53 151 B 1 ATOM 2389 C CG2 . ILE B 2 151 ? 20.491 12.774 -3.299 1.00 96.03 151 B 1 ATOM 2390 C CD1 . ILE B 2 151 ? 19.067 15.215 -1.921 1.00 90.45 151 B 1 ATOM 2391 N N . THR B 2 152 ? 22.650 12.668 -5.895 1.00 98.21 152 B 1 ATOM 2392 C CA . THR B 2 152 ? 23.011 11.411 -6.544 1.00 98.10 152 B 1 ATOM 2393 C C . THR B 2 152 ? 22.927 10.259 -5.552 1.00 98.30 152 B 1 ATOM 2394 O O . THR B 2 152 ? 23.728 10.154 -4.626 1.00 97.63 152 B 1 ATOM 2395 C CB . THR B 2 152 ? 24.398 11.509 -7.191 1.00 97.22 152 B 1 ATOM 2396 O OG1 . THR B 2 152 ? 24.359 12.436 -8.258 1.00 92.92 152 B 1 ATOM 2397 C CG2 . THR B 2 152 ? 24.845 10.184 -7.801 1.00 92.94 152 B 1 ATOM 2398 N N . TRP B 2 153 ? 21.996 9.337 -5.779 1.00 98.00 153 B 1 ATOM 2399 C CA . TRP B 2 153 ? 21.984 8.071 -5.052 1.00 97.94 153 B 1 ATOM 2400 C C . TRP B 2 153 ? 22.930 7.075 -5.721 1.00 97.70 153 B 1 ATOM 2401 O O . TRP B 2 153 ? 22.604 6.473 -6.749 1.00 96.86 153 B 1 ATOM 2402 C CB . TRP B 2 153 ? 20.564 7.522 -4.935 1.00 97.71 153 B 1 ATOM 2403 C CG . TRP B 2 153 ? 20.473 6.160 -4.296 1.00 97.71 153 B 1 ATOM 2404 C CD1 . TRP B 2 153 ? 21.299 5.664 -3.342 1.00 96.81 153 B 1 ATOM 2405 C CD2 . TRP B 2 153 ? 19.507 5.099 -4.578 1.00 97.35 153 B 1 ATOM 2406 N NE1 . TRP B 2 153 ? 20.909 4.367 -3.009 1.00 96.49 153 B 1 ATOM 2407 C CE2 . TRP B 2 153 ? 19.806 3.987 -3.739 1.00 96.79 153 B 1 ATOM 2408 C CE3 . TRP B 2 153 ? 18.403 4.982 -5.454 1.00 96.64 153 B 1 ATOM 2409 C CZ2 . TRP B 2 153 ? 19.039 2.803 -3.752 1.00 96.06 153 B 1 ATOM 2410 C CZ3 . TRP B 2 153 ? 17.637 3.801 -5.468 1.00 95.61 153 B 1 ATOM 2411 C CH2 . TRP B 2 153 ? 17.955 2.727 -4.622 1.00 95.23 153 B 1 ATOM 2412 N N . VAL B 2 154 ? 24.087 6.851 -5.115 1.00 97.46 154 B 1 ATOM 2413 C CA . VAL B 2 154 ? 25.051 5.818 -5.504 1.00 97.14 154 B 1 ATOM 2414 C C . VAL B 2 154 ? 24.678 4.506 -4.819 1.00 97.18 154 B 1 ATOM 2415 O O . VAL B 2 154 ? 24.659 4.394 -3.592 1.00 96.47 154 B 1 ATOM 2416 C CB . VAL B 2 154 ? 26.495 6.241 -5.183 1.00 96.44 154 B 1 ATOM 2417 C CG1 . VAL B 2 154 ? 27.489 5.167 -5.636 1.00 93.93 154 B 1 ATOM 2418 C CG2 . VAL B 2 154 ? 26.864 7.550 -5.897 1.00 94.41 154 B 1 ATOM 2419 N N . LYS B 2 155 ? 24.393 3.488 -5.618 1.00 96.46 155 B 1 ATOM 2420 C CA . LYS B 2 155 ? 23.951 2.182 -5.126 1.00 95.84 155 B 1 ATOM 2421 C C . LYS B 2 155 ? 25.139 1.373 -4.614 1.00 95.64 155 B 1 ATOM 2422 O O . LYS B 2 155 ? 26.088 1.096 -5.355 1.00 94.23 155 B 1 ATOM 2423 C CB . LYS B 2 155 ? 23.179 1.440 -6.224 1.00 94.69 155 B 1 ATOM 2424 C CG . LYS B 2 155 ? 21.900 2.200 -6.610 1.00 92.52 155 B 1 ATOM 2425 C CD . LYS B 2 155 ? 21.206 1.564 -7.819 1.00 88.09 155 B 1 ATOM 2426 C CE . LYS B 2 155 ? 20.003 2.443 -8.161 1.00 83.79 155 B 1 ATOM 2427 N NZ . LYS B 2 155 ? 19.372 2.102 -9.454 1.00 77.96 155 B 1 ATOM 2428 N N . LYS B 2 156 ? 25.043 0.964 -3.370 1.00 96.31 156 B 1 ATOM 2429 C CA . LYS B 2 156 ? 26.038 0.159 -2.660 1.00 96.23 156 B 1 ATOM 2430 C C . LYS B 2 156 ? 25.691 -1.330 -2.754 1.00 96.18 156 B 1 ATOM 2431 O O . LYS B 2 156 ? 24.527 -1.719 -2.738 1.00 94.62 156 B 1 ATOM 2432 C CB . LYS B 2 156 ? 26.088 0.675 -1.214 1.00 94.57 156 B 1 ATOM 2433 C CG . LYS B 2 156 ? 27.225 0.091 -0.364 1.00 90.95 156 B 1 ATOM 2434 C CD . LYS B 2 156 ? 27.158 0.722 1.033 1.00 90.23 156 B 1 ATOM 2435 C CE . LYS B 2 156 ? 28.204 0.145 1.981 1.00 83.20 156 B 1 ATOM 2436 N NZ . LYS B 2 156 ? 28.073 0.739 3.331 1.00 78.82 156 B 1 ATOM 2437 N N . THR B 2 157 ? 26.715 -2.177 -2.859 1.00 95.12 157 B 1 ATOM 2438 C CA . THR B 2 157 ? 26.565 -3.628 -2.682 1.00 94.39 157 B 1 ATOM 2439 C C . THR B 2 157 ? 26.646 -3.994 -1.199 1.00 94.72 157 B 1 ATOM 2440 O O . THR B 2 157 ? 27.230 -3.250 -0.410 1.00 93.19 157 B 1 ATOM 2441 C CB . THR B 2 157 ? 27.634 -4.419 -3.453 1.00 92.75 157 B 1 ATOM 2442 O OG1 . THR B 2 157 ? 28.921 -4.158 -2.956 1.00 86.76 157 B 1 ATOM 2443 C CG2 . THR B 2 157 ? 27.638 -4.106 -4.949 1.00 85.95 157 B 1 ATOM 2444 N N . VAL B 2 158 ? 26.195 -5.203 -0.845 1.00 93.72 158 B 1 ATOM 2445 C CA . VAL B 2 158 ? 26.347 -5.763 0.517 1.00 92.84 158 B 1 ATOM 2446 C C . VAL B 2 158 ? 27.804 -5.752 1.016 1.00 93.49 158 B 1 ATOM 2447 O O . VAL B 2 158 ? 28.070 -5.569 2.194 1.00 90.60 158 B 1 ATOM 2448 C CB . VAL B 2 158 ? 25.782 -7.196 0.591 1.00 91.31 158 B 1 ATOM 2449 C CG1 . VAL B 2 158 ? 24.268 -7.194 0.317 1.00 80.40 158 B 1 ATOM 2450 C CG2 . VAL B 2 158 ? 26.452 -8.164 -0.401 1.00 80.65 158 B 1 ATOM 2451 N N . ASN B 2 159 ? 28.775 -5.839 0.099 1.00 93.64 159 B 1 ATOM 2452 C CA . ASN B 2 159 ? 30.213 -5.786 0.406 1.00 93.35 159 B 1 ATOM 2453 C C . ASN B 2 159 ? 30.788 -4.353 0.422 1.00 94.04 159 B 1 ATOM 2454 O O . ASN B 2 159 ? 32.004 -4.168 0.303 1.00 90.46 159 B 1 ATOM 2455 C CB . ASN B 2 159 ? 30.964 -6.703 -0.573 1.00 91.98 159 B 1 ATOM 2456 C CG . ASN B 2 159 ? 30.566 -8.168 -0.448 1.00 88.00 159 B 1 ATOM 2457 O OD1 . ASN B 2 159 ? 30.058 -8.626 0.548 1.00 77.30 159 B 1 ATOM 2458 N ND2 . ASN B 2 159 ? 30.807 -8.961 -1.469 1.00 77.06 159 B 1 ATOM 2459 N N . GLY B 2 160 ? 29.943 -3.329 0.471 1.00 92.76 160 B 1 ATOM 2460 C CA . GLY B 2 160 ? 30.370 -1.926 0.549 1.00 92.15 160 B 1 ATOM 2461 C C . GLY B 2 160 ? 30.924 -1.324 -0.744 1.00 93.79 160 B 1 ATOM 2462 O O . GLY B 2 160 ? 31.456 -0.214 -0.712 1.00 89.97 160 B 1 ATOM 2463 N N . LYS B 2 161 ? 30.814 -2.019 -1.879 1.00 92.86 161 B 1 ATOM 2464 C CA . LYS B 2 161 ? 31.296 -1.551 -3.188 1.00 93.20 161 B 1 ATOM 2465 C C . LYS B 2 161 ? 30.177 -0.886 -3.993 1.00 94.40 161 B 1 ATOM 2466 O O . LYS B 2 161 ? 28.998 -1.138 -3.757 1.00 92.38 161 B 1 ATOM 2467 C CB . LYS B 2 161 ? 31.940 -2.705 -3.971 1.00 91.67 161 B 1 ATOM 2468 C CG . LYS B 2 161 ? 33.164 -3.284 -3.242 1.00 88.41 161 B 1 ATOM 2469 C CD . LYS B 2 161 ? 33.878 -4.344 -4.091 1.00 80.60 161 B 1 ATOM 2470 C CE . LYS B 2 161 ? 35.087 -4.871 -3.313 1.00 73.22 161 B 1 ATOM 2471 N NZ . LYS B 2 161 ? 35.887 -5.856 -4.086 1.00 62.51 161 B 1 ATOM 2472 N N . ILE B 2 162 ? 30.560 -0.086 -4.994 1.00 93.64 162 B 1 ATOM 2473 C CA . ILE B 2 162 ? 29.616 0.474 -5.967 1.00 93.26 162 B 1 ATOM 2474 C C . ILE B 2 162 ? 28.966 -0.673 -6.755 1.00 92.86 162 B 1 ATOM 2475 O O . ILE B 2 162 ? 29.656 -1.544 -7.298 1.00 89.47 162 B 1 ATOM 2476 C CB . ILE B 2 162 ? 30.307 1.507 -6.882 1.00 91.97 162 B 1 ATOM 2477 C CG1 . ILE B 2 162 ? 30.887 2.675 -6.046 1.00 88.06 162 B 1 ATOM 2478 C CG2 . ILE B 2 162 ? 29.314 2.042 -7.927 1.00 88.33 162 B 1 ATOM 2479 C CD1 . ILE B 2 162 ? 31.702 3.688 -6.859 1.00 86.05 162 B 1 ATOM 2480 N N . ALA B 2 163 ? 27.638 -0.669 -6.817 1.00 93.35 163 B 1 ATOM 2481 C CA . ALA B 2 163 ? 26.877 -1.674 -7.543 1.00 91.05 163 B 1 ATOM 2482 C C . ALA B 2 163 ? 27.142 -1.588 -9.054 1.00 90.75 163 B 1 ATOM 2483 O O . ALA B 2 163 ? 27.473 -0.540 -9.600 1.00 86.77 163 B 1 ATOM 2484 C CB . ALA B 2 163 ? 25.388 -1.522 -7.208 1.00 88.17 163 B 1 ATOM 2485 N N . LYS B 2 164 ? 26.957 -2.708 -9.753 1.00 89.92 164 B 1 ATOM 2486 C CA . LYS B 2 164 ? 27.067 -2.785 -11.213 1.00 87.26 164 B 1 ATOM 2487 C C . LYS B 2 164 ? 25.690 -3.084 -11.790 1.00 86.28 164 B 1 ATOM 2488 O O . LYS B 2 164 ? 25.212 -4.216 -11.707 1.00 77.97 164 B 1 ATOM 2489 C CB . LYS B 2 164 ? 28.122 -3.825 -11.618 1.00 82.40 164 B 1 ATOM 2490 C CG . LYS B 2 164 ? 29.534 -3.429 -11.165 1.00 75.48 164 B 1 ATOM 2491 C CD . LYS B 2 164 ? 30.566 -4.448 -11.664 1.00 69.33 164 B 1 ATOM 2492 C CE . LYS B 2 164 ? 31.971 -4.038 -11.227 1.00 62.44 164 B 1 ATOM 2493 N NZ . LYS B 2 164 ? 33.006 -4.954 -11.767 1.00 53.60 164 B 1 ATOM 2494 N N . GLY B 2 165 ? 25.042 -2.047 -12.337 1.00 87.24 165 B 1 ATOM 2495 C CA . GLY B 2 165 ? 23.771 -2.164 -13.042 1.00 84.99 165 B 1 ATOM 2496 C C . GLY B 2 165 ? 23.950 -2.294 -14.554 1.00 86.42 165 B 1 ATOM 2497 O O . GLY B 2 165 ? 25.033 -2.070 -15.093 1.00 81.80 165 B 1 ATOM 2498 N N . HIS B 2 166 ? 22.877 -2.644 -15.244 1.00 86.61 166 B 1 ATOM 2499 C CA . HIS B 2 166 ? 22.871 -2.711 -16.703 1.00 86.24 166 B 1 ATOM 2500 C C . HIS B 2 166 ? 22.846 -1.306 -17.316 1.00 87.67 166 B 1 ATOM 2501 O O . HIS B 2 166 ? 22.166 -0.415 -16.816 1.00 82.99 166 B 1 ATOM 2502 C CB . HIS B 2 166 ? 21.688 -3.569 -17.165 1.00 82.00 166 B 1 ATOM 2503 C CG . HIS B 2 166 ? 21.823 -4.001 -18.600 1.00 75.13 166 B 1 ATOM 2504 N ND1 . HIS B 2 166 ? 22.695 -4.953 -19.080 1.00 64.42 166 B 1 ATOM 2505 C CD2 . HIS B 2 166 ? 21.132 -3.524 -19.682 1.00 64.57 166 B 1 ATOM 2506 C CE1 . HIS B 2 166 ? 22.526 -5.044 -20.410 1.00 60.62 166 B 1 ATOM 2507 N NE2 . HIS B 2 166 ? 21.586 -4.195 -20.809 1.00 62.43 166 B 1 ATOM 2508 N N . GLY B 2 167 ? 23.580 -1.121 -18.401 1.00 86.55 167 B 1 ATOM 2509 C CA . GLY B 2 167 ? 23.604 0.120 -19.165 1.00 86.17 167 B 1 ATOM 2510 C C . GLY B 2 167 ? 24.058 -0.150 -20.595 1.00 87.42 167 B 1 ATOM 2511 O O . GLY B 2 167 ? 24.660 -1.191 -20.867 1.00 83.78 167 B 1 ATOM 2512 N N . PHE B 2 168 ? 23.744 0.776 -21.512 1.00 86.34 168 B 1 ATOM 2513 C CA . PHE B 2 168 ? 24.057 0.594 -22.932 1.00 86.69 168 B 1 ATOM 2514 C C . PHE B 2 168 ? 25.533 0.883 -23.239 1.00 88.54 168 B 1 ATOM 2515 O O . PHE B 2 168 ? 26.219 0.036 -23.810 1.00 85.66 168 B 1 ATOM 2516 C CB . PHE B 2 168 ? 23.108 1.454 -23.773 1.00 83.46 168 B 1 ATOM 2517 C CG . PHE B 2 168 ? 23.174 1.130 -25.248 1.00 77.94 168 B 1 ATOM 2518 C CD1 . PHE B 2 168 ? 23.972 1.901 -26.111 1.00 73.23 168 B 1 ATOM 2519 C CD2 . PHE B 2 168 ? 22.446 0.045 -25.764 1.00 72.88 168 B 1 ATOM 2520 C CE1 . PHE B 2 168 ? 24.043 1.591 -27.479 1.00 68.70 168 B 1 ATOM 2521 C CE2 . PHE B 2 168 ? 22.514 -0.270 -27.132 1.00 69.14 168 B 1 ATOM 2522 C CZ . PHE B 2 168 ? 23.312 0.505 -27.989 1.00 67.83 168 B 1 ATOM 2523 N N . TYR B 2 169 ? 26.037 2.053 -22.808 1.00 88.68 169 B 1 ATOM 2524 C CA . TYR B 2 169 ? 27.447 2.434 -22.958 1.00 90.13 169 B 1 ATOM 2525 C C . TYR B 2 169 ? 28.246 2.154 -21.681 1.00 91.38 169 B 1 ATOM 2526 O O . TYR B 2 169 ? 29.230 1.413 -21.702 1.00 88.91 169 B 1 ATOM 2527 C CB . TYR B 2 169 ? 27.543 3.915 -23.349 1.00 89.64 169 B 1 ATOM 2528 C CG . TYR B 2 169 ? 26.876 4.251 -24.666 1.00 90.29 169 B 1 ATOM 2529 C CD1 . TYR B 2 169 ? 27.471 3.852 -25.878 1.00 86.38 169 B 1 ATOM 2530 C CD2 . TYR B 2 169 ? 25.666 4.972 -24.696 1.00 87.53 169 B 1 ATOM 2531 C CE1 . TYR B 2 169 ? 26.877 4.167 -27.106 1.00 86.21 169 B 1 ATOM 2532 C CE2 . TYR B 2 169 ? 25.060 5.291 -25.922 1.00 86.52 169 B 1 ATOM 2533 C CZ . TYR B 2 169 ? 25.670 4.890 -27.126 1.00 87.06 169 B 1 ATOM 2534 O OH . TYR B 2 169 ? 25.084 5.205 -28.328 1.00 84.49 169 B 1 ATOM 2535 N N . LEU B 2 170 ? 27.809 2.737 -20.555 1.00 92.54 170 B 1 ATOM 2536 C CA . LEU B 2 170 ? 28.407 2.536 -19.241 1.00 92.69 170 B 1 ATOM 2537 C C . LEU B 2 170 ? 27.464 1.725 -18.350 1.00 92.20 170 B 1 ATOM 2538 O O . LEU B 2 170 ? 26.242 1.756 -18.510 1.00 90.49 170 B 1 ATOM 2539 C CB . LEU B 2 170 ? 28.757 3.891 -18.600 1.00 92.64 170 B 1 ATOM 2540 C CG . LEU B 2 170 ? 29.764 4.754 -19.390 1.00 92.23 170 B 1 ATOM 2541 C CD1 . LEU B 2 170 ? 29.977 6.072 -18.667 1.00 89.05 170 B 1 ATOM 2542 C CD2 . LEU B 2 170 ? 31.120 4.062 -19.547 1.00 88.58 170 B 1 ATOM 2543 N N . GLN B 2 171 ? 28.034 1.018 -17.368 1.00 91.98 171 B 1 ATOM 2544 C CA . GLN B 2 171 ? 27.228 0.397 -16.324 1.00 91.45 171 B 1 ATOM 2545 C C . GLN B 2 171 ? 26.612 1.480 -15.436 1.00 92.13 171 B 1 ATOM 2546 O O . GLN B 2 171 ? 27.304 2.392 -14.990 1.00 90.64 171 B 1 ATOM 2547 C CB . GLN B 2 171 ? 28.067 -0.589 -15.503 1.00 89.77 171 B 1 ATOM 2548 C CG . GLN B 2 171 ? 28.468 -1.810 -16.341 1.00 85.40 171 B 1 ATOM 2549 C CD . GLN B 2 171 ? 29.218 -2.879 -15.545 1.00 82.88 171 B 1 ATOM 2550 O OE1 . GLN B 2 171 ? 29.905 -2.642 -14.570 1.00 74.98 171 B 1 ATOM 2551 N NE2 . GLN B 2 171 ? 29.116 -4.123 -15.958 1.00 73.33 171 B 1 ATOM 2552 N N . HIS B 2 172 ? 25.317 1.370 -15.150 1.00 92.95 172 B 1 ATOM 2553 C CA . HIS B 2 172 ? 24.617 2.312 -14.282 1.00 92.51 172 B 1 ATOM 2554 C C . HIS B 2 172 ? 24.726 1.867 -12.823 1.00 93.10 172 B 1 ATOM 2555 O O . HIS B 2 172 ? 24.421 0.725 -12.480 1.00 91.45 172 B 1 ATOM 2556 C CB . HIS B 2 172 ? 23.156 2.455 -14.733 1.00 90.57 172 B 1 ATOM 2557 C CG . HIS B 2 172 ? 22.975 3.047 -16.110 1.00 88.09 172 B 1 ATOM 2558 N ND1 . HIS B 2 172 ? 21.788 3.077 -16.813 1.00 76.34 172 B 1 ATOM 2559 C CD2 . HIS B 2 172 ? 23.904 3.671 -16.902 1.00 76.24 172 B 1 ATOM 2560 C CE1 . HIS B 2 172 ? 22.003 3.695 -17.977 1.00 78.11 172 B 1 ATOM 2561 N NE2 . HIS B 2 172 ? 23.278 4.071 -18.069 1.00 80.01 172 B 1 ATOM 2562 N N . ALA B 2 173 ? 25.149 2.784 -11.963 1.00 94.00 173 B 1 ATOM 2563 C CA . ALA B 2 173 ? 25.294 2.543 -10.530 1.00 94.14 173 B 1 ATOM 2564 C C . ALA B 2 173 ? 24.673 3.647 -9.670 1.00 95.25 173 B 1 ATOM 2565 O O . ALA B 2 173 ? 24.789 3.603 -8.448 1.00 93.76 173 B 1 ATOM 2566 C CB . ALA B 2 173 ? 26.781 2.350 -10.226 1.00 92.12 173 B 1 ATOM 2567 N N . LYS B 2 174 ? 24.019 4.634 -10.288 1.00 95.49 174 B 1 ATOM 2568 C CA . LYS B 2 174 ? 23.389 5.769 -9.614 1.00 95.54 174 B 1 ATOM 2569 C C . LYS B 2 174 ? 21.987 6.053 -10.144 1.00 96.00 174 B 1 ATOM 2570 O O . LYS B 2 174 ? 21.640 5.640 -11.249 1.00 95.22 174 B 1 ATOM 2571 C CB . LYS B 2 174 ? 24.305 7.011 -9.685 1.00 93.61 174 B 1 ATOM 2572 C CG . LYS B 2 174 ? 24.475 7.608 -11.093 1.00 91.52 174 B 1 ATOM 2573 C CD . LYS B 2 174 ? 25.070 9.017 -11.020 1.00 89.74 174 B 1 ATOM 2574 C CE . LYS B 2 174 ? 24.964 9.781 -12.339 1.00 83.89 174 B 1 ATOM 2575 N NZ . LYS B 2 174 ? 24.718 11.241 -12.113 1.00 80.08 174 B 1 ATOM 2576 N N . GLU B 2 175 ? 21.221 6.791 -9.364 1.00 96.46 175 B 1 ATOM 2577 C CA . GLU B 2 175 ? 20.035 7.534 -9.797 1.00 96.41 175 B 1 ATOM 2578 C C . GLU B 2 175 ? 20.177 8.986 -9.353 1.00 97.18 175 B 1 ATOM 2579 O O . GLU B 2 175 ? 20.887 9.266 -8.390 1.00 96.69 175 B 1 ATOM 2580 C CB . GLU B 2 175 ? 18.753 6.891 -9.253 1.00 95.23 175 B 1 ATOM 2581 C CG . GLU B 2 175 ? 18.521 5.516 -9.890 1.00 91.77 175 B 1 ATOM 2582 C CD . GLU B 2 175 ? 17.245 4.799 -9.436 1.00 91.56 175 B 1 ATOM 2583 O OE1 . GLU B 2 175 ? 17.270 3.544 -9.453 1.00 84.08 175 B 1 ATOM 2584 O OE2 . GLU B 2 175 ? 16.252 5.450 -9.073 1.00 86.72 175 B 1 ATOM 2585 N N . SER B 2 176 ? 19.516 9.902 -10.070 1.00 97.60 176 B 1 ATOM 2586 C CA . SER B 2 176 ? 19.596 11.337 -9.814 1.00 97.81 176 B 1 ATOM 2587 C C . SER B 2 176 ? 18.240 11.873 -9.361 1.00 98.30 176 B 1 ATOM 2588 O O . SER B 2 176 ? 17.209 11.516 -9.936 1.00 97.87 176 B 1 ATOM 2589 C CB . SER B 2 176 ? 20.068 12.078 -11.069 1.00 96.72 176 B 1 ATOM 2590 O OG . SER B 2 176 ? 21.417 11.769 -11.379 1.00 90.23 176 B 1 ATOM 2591 N N . CYS B 2 177 ? 18.254 12.740 -8.354 1.00 98.42 177 B 1 ATOM 2592 C CA . CYS B 2 177 ? 17.108 13.513 -7.894 1.00 98.52 177 B 1 ATOM 2593 C C . CYS B 2 177 ? 17.422 14.996 -8.087 1.00 98.62 177 B 1 ATOM 2594 O O . CYS B 2 177 ? 18.270 15.546 -7.384 1.00 98.24 177 B 1 ATOM 2595 C CB . CYS B 2 177 ? 16.827 13.159 -6.434 1.00 98.34 177 B 1 ATOM 2596 S SG . CYS B 2 177 ? 15.262 13.917 -5.922 1.00 97.87 177 B 1 ATOM 2597 N N . LEU B 2 178 ? 16.772 15.632 -9.060 1.00 98.63 178 B 1 ATOM 2598 C CA . LEU B 2 178 ? 16.988 17.042 -9.378 1.00 98.68 178 B 1 ATOM 2599 C C . LEU B 2 178 ? 16.223 17.921 -8.396 1.00 98.72 178 B 1 ATOM 2600 O O . LEU B 2 178 ? 15.066 17.632 -8.091 1.00 98.38 178 B 1 ATOM 2601 C CB . LEU B 2 178 ? 16.558 17.324 -10.825 1.00 98.47 178 B 1 ATOM 2602 C CG . LEU B 2 178 ? 17.342 16.538 -11.895 1.00 96.51 178 B 1 ATOM 2603 C CD1 . LEU B 2 178 ? 16.819 16.893 -13.285 1.00 89.54 178 B 1 ATOM 2604 C CD2 . LEU B 2 178 ? 18.834 16.861 -11.866 1.00 89.60 178 B 1 ATOM 2605 N N . ILE B 2 179 ? 16.851 19.004 -7.931 1.00 98.53 179 B 1 ATOM 2606 C CA . ILE B 2 179 ? 16.301 19.904 -6.918 1.00 98.47 179 B 1 ATOM 2607 C C . ILE B 2 179 ? 16.113 21.301 -7.502 1.00 98.45 179 B 1 ATOM 2608 O O . ILE B 2 179 ? 17.063 21.951 -7.953 1.00 97.88 179 B 1 ATOM 2609 C CB . ILE B 2 179 ? 17.162 19.916 -5.640 1.00 98.13 179 B 1 ATOM 2610 C CG1 . ILE B 2 179 ? 17.365 18.472 -5.111 1.00 96.84 179 B 1 ATOM 2611 C CG2 . ILE B 2 179 ? 16.492 20.800 -4.568 1.00 97.00 179 B 1 ATOM 2612 C CD1 . ILE B 2 179 ? 18.275 18.380 -3.889 1.00 91.91 179 B 1 ATOM 2613 N N . GLY B 2 180 ? 14.870 21.776 -7.470 1.00 98.55 180 B 1 ATOM 2614 C CA . GLY B 2 180 ? 14.495 23.142 -7.800 1.00 98.50 180 B 1 ATOM 2615 C C . GLY B 2 180 ? 14.095 23.931 -6.562 1.00 98.62 180 B 1 ATOM 2616 O O . GLY B 2 180 ? 13.564 23.371 -5.606 1.00 98.25 180 B 1 ATOM 2617 N N . VAL B 2 181 ? 14.307 25.245 -6.593 1.00 98.48 181 B 1 ATOM 2618 C CA . VAL B 2 181 ? 13.862 26.197 -5.567 1.00 98.45 181 B 1 ATOM 2619 C C . VAL B 2 181 ? 12.896 27.215 -6.160 1.00 98.49 181 B 1 ATOM 2620 O O . VAL B 2 181 ? 13.027 27.622 -7.321 1.00 97.82 181 B 1 ATOM 2621 C CB . VAL B 2 181 ? 15.061 26.864 -4.870 1.00 97.52 181 B 1 ATOM 2622 C CG1 . VAL B 2 181 ? 15.787 27.883 -5.757 1.00 91.73 181 B 1 ATOM 2623 C CG2 . VAL B 2 181 ? 14.643 27.567 -3.576 1.00 91.35 181 B 1 ATOM 2624 N N . LYS B 2 182 ? 11.923 27.658 -5.348 1.00 98.19 182 B 1 ATOM 2625 C CA . LYS B 2 182 ? 10.944 28.682 -5.707 1.00 97.86 182 B 1 ATOM 2626 C C . LYS B 2 182 ? 10.668 29.598 -4.521 1.00 98.05 182 B 1 ATOM 2627 O O . LYS B 2 182 ? 10.591 29.131 -3.388 1.00 96.76 182 B 1 ATOM 2628 C CB . LYS B 2 182 ? 9.666 27.972 -6.183 1.00 95.22 182 B 1 ATOM 2629 C CG . LYS B 2 182 ? 8.534 28.931 -6.573 1.00 91.41 182 B 1 ATOM 2630 C CD . LYS B 2 182 ? 7.285 28.122 -6.925 1.00 91.55 182 B 1 ATOM 2631 C CE . LYS B 2 182 ? 6.102 29.049 -7.187 1.00 86.96 182 B 1 ATOM 2632 N NZ . LYS B 2 182 ? 4.854 28.266 -7.290 1.00 85.12 182 B 1 ATOM 2633 N N . GLY B 2 183 ? 10.462 30.882 -4.802 1.00 96.95 183 B 1 ATOM 2634 C CA . GLY B 2 183 ? 10.095 31.876 -3.799 1.00 96.76 183 B 1 ATOM 2635 C C . GLY B 2 183 ? 11.209 32.169 -2.799 1.00 97.18 183 B 1 ATOM 2636 O O . GLY B 2 183 ? 12.399 32.076 -3.129 1.00 94.50 183 B 1 ATOM 2637 N N . ASP B 2 184 ? 10.816 32.552 -1.582 1.00 96.28 184 B 1 ATOM 2638 C CA . ASP B 2 184 ? 11.720 32.886 -0.486 1.00 96.27 184 B 1 ATOM 2639 C C . ASP B 2 184 ? 11.936 31.675 0.431 1.00 96.42 184 B 1 ATOM 2640 O O . ASP B 2 184 ? 11.052 31.274 1.193 1.00 93.94 184 B 1 ATOM 2641 C CB . ASP B 2 184 ? 11.175 34.094 0.285 1.00 94.86 184 B 1 ATOM 2642 C CG . ASP B 2 184 ? 12.064 34.472 1.476 1.00 92.56 184 B 1 ATOM 2643 O OD1 . ASP B 2 184 ? 13.240 34.046 1.500 1.00 87.27 184 B 1 ATOM 2644 O OD2 . ASP B 2 184 ? 11.554 35.168 2.381 1.00 86.48 184 B 1 ATOM 2645 N N . VAL B 2 185 ? 13.139 31.104 0.378 1.00 96.30 185 B 1 ATOM 2646 C CA . VAL B 2 185 ? 13.564 30.008 1.262 1.00 96.01 185 B 1 ATOM 2647 C C . VAL B 2 185 ? 14.433 30.486 2.427 1.00 95.96 185 B 1 ATOM 2648 O O . VAL B 2 185 ? 14.882 29.677 3.237 1.00 92.13 185 B 1 ATOM 2649 C CB . VAL B 2 185 ? 14.230 28.859 0.482 1.00 94.04 185 B 1 ATOM 2650 C CG1 . VAL B 2 185 ? 13.225 28.227 -0.495 1.00 88.12 185 B 1 ATOM 2651 C CG2 . VAL B 2 185 ? 15.473 29.318 -0.288 1.00 89.60 185 B 1 ATOM 2652 N N . ASP B 2 186 ? 14.619 31.802 2.563 1.00 95.44 186 B 1 ATOM 2653 C CA . ASP B 2 186 ? 15.310 32.448 3.687 1.00 94.68 186 B 1 ATOM 2654 C C . ASP B 2 186 ? 14.325 32.905 4.777 1.00 94.48 186 B 1 ATOM 2655 O O . ASP B 2 186 ? 14.685 33.594 5.726 1.00 89.83 186 B 1 ATOM 2656 C CB . ASP B 2 186 ? 16.232 33.569 3.164 1.00 92.96 186 B 1 ATOM 2657 C CG . ASP B 2 186 ? 17.425 33.029 2.364 1.00 89.71 186 B 1 ATOM 2658 O OD1 . ASP B 2 186 ? 17.568 31.798 2.211 1.00 84.03 186 B 1 ATOM 2659 O OD2 . ASP B 2 186 ? 18.349 33.796 2.009 1.00 84.99 186 B 1 ATOM 2660 N N . ASN B 2 187 ? 13.078 32.439 4.708 1.00 93.31 187 B 1 ATOM 2661 C CA . ASN B 2 187 ? 11.981 32.731 5.642 1.00 91.65 187 B 1 ATOM 2662 C C . ASN B 2 187 ? 12.097 32.048 7.027 1.00 92.35 187 B 1 ATOM 2663 O O . ASN B 2 187 ? 11.160 32.095 7.826 1.00 87.68 187 B 1 ATOM 2664 C CB . ASN B 2 187 ? 10.656 32.404 4.928 1.00 86.96 187 B 1 ATOM 2665 C CG . ASN B 2 187 ? 10.546 30.942 4.515 1.00 85.42 187 B 1 ATOM 2666 O OD1 . ASN B 2 187 ? 10.954 30.013 5.195 1.00 78.34 187 B 1 ATOM 2667 N ND2 . ASN B 2 187 ? 9.973 30.702 3.352 1.00 80.49 187 B 1 ATOM 2668 N N . GLY B 2 188 ? 13.214 31.380 7.315 1.00 92.44 188 B 1 ATOM 2669 C CA . GLY B 2 188 ? 13.482 30.708 8.594 1.00 92.40 188 B 1 ATOM 2670 C C . GLY B 2 188 ? 12.903 29.294 8.727 1.00 93.99 188 B 1 ATOM 2671 O O . GLY B 2 188 ? 13.194 28.618 9.717 1.00 90.26 188 B 1 ATOM 2672 N N . ARG B 2 189 ? 12.121 28.818 7.754 1.00 94.02 189 B 1 ATOM 2673 C CA . ARG B 2 189 ? 11.601 27.436 7.741 1.00 93.96 189 B 1 ATOM 2674 C C . ARG B 2 189 ? 12.637 26.426 7.250 1.00 95.06 189 B 1 ATOM 2675 O O . ARG B 2 189 ? 12.586 25.265 7.648 1.00 93.26 189 B 1 ATOM 2676 C CB . ARG B 2 189 ? 10.333 27.349 6.884 1.00 91.80 189 B 1 ATOM 2677 C CG . ARG B 2 189 ? 9.186 28.191 7.476 1.00 86.40 189 B 1 ATOM 2678 C CD . ARG B 2 189 ? 7.908 28.057 6.650 1.00 81.08 189 B 1 ATOM 2679 N NE . ARG B 2 189 ? 8.013 28.726 5.348 1.00 74.99 189 B 1 ATOM 2680 C CZ . ARG B 2 189 ? 7.289 28.456 4.273 1.00 70.80 189 B 1 ATOM 2681 N NH1 . ARG B 2 189 ? 6.385 27.523 4.269 1.00 63.18 189 B 1 ATOM 2682 N NH2 . ARG B 2 189 ? 7.455 29.132 3.175 1.00 63.26 189 B 1 ATOM 2683 N N . PHE B 2 190 ? 13.574 26.876 6.422 1.00 96.26 190 B 1 ATOM 2684 C CA . PHE B 2 190 ? 14.598 26.037 5.813 1.00 96.33 190 B 1 ATOM 2685 C C . PHE B 2 190 ? 15.956 26.231 6.486 1.00 96.24 190 B 1 ATOM 2686 O O . PHE B 2 190 ? 16.314 27.321 6.935 1.00 93.94 190 B 1 ATOM 2687 C CB . PHE B 2 190 ? 14.664 26.303 4.307 1.00 95.89 190 B 1 ATOM 2688 C CG . PHE B 2 190 ? 13.345 26.066 3.602 1.00 96.95 190 B 1 ATOM 2689 C CD1 . PHE B 2 190 ? 12.991 24.776 3.174 1.00 96.05 190 B 1 ATOM 2690 C CD2 . PHE B 2 190 ? 12.446 27.130 3.408 1.00 96.32 190 B 1 ATOM 2691 C CE1 . PHE B 2 190 ? 11.756 24.549 2.550 1.00 95.79 190 B 1 ATOM 2692 C CE2 . PHE B 2 190 ? 11.206 26.907 2.785 1.00 96.02 190 B 1 ATOM 2693 C CZ . PHE B 2 190 ? 10.860 25.618 2.358 1.00 96.41 190 B 1 ATOM 2694 N N . LYS B 2 191 ? 16.737 25.154 6.525 1.00 96.42 191 B 1 ATOM 2695 C CA . LYS B 2 191 ? 18.135 25.143 6.955 1.00 96.20 191 B 1 ATOM 2696 C C . LYS B 2 191 ? 19.040 25.212 5.728 1.00 96.24 191 B 1 ATOM 2697 O O . LYS B 2 191 ? 18.665 24.786 4.640 1.00 93.55 191 B 1 ATOM 2698 C CB . LYS B 2 191 ? 18.405 23.877 7.781 1.00 95.35 191 B 1 ATOM 2699 C CG . LYS B 2 191 ? 17.538 23.761 9.050 1.00 91.71 191 B 1 ATOM 2700 C CD . LYS B 2 191 ? 18.233 24.306 10.289 1.00 84.01 191 B 1 ATOM 2701 C CE . LYS B 2 191 ? 17.319 24.110 11.497 1.00 77.65 191 B 1 ATOM 2702 N NZ . LYS B 2 191 ? 18.028 24.301 12.788 1.00 67.26 191 B 1 ATOM 2703 N N . LYS B 2 192 ? 20.266 25.710 5.922 1.00 96.01 192 B 1 ATOM 2704 C CA . LYS B 2 192 ? 21.301 25.765 4.881 1.00 95.21 192 B 1 ATOM 2705 C C . LYS B 2 192 ? 22.490 24.890 5.263 1.00 95.38 192 B 1 ATOM 2706 O O . LYS B 2 192 ? 22.739 24.682 6.451 1.00 90.80 192 B 1 ATOM 2707 C CB . LYS B 2 192 ? 21.729 27.223 4.623 1.00 92.01 192 B 1 ATOM 2708 C CG . LYS B 2 192 ? 20.597 28.065 4.015 1.00 87.41 192 B 1 ATOM 2709 C CD . LYS B 2 192 ? 21.073 29.480 3.663 1.00 80.88 192 B 1 ATOM 2710 C CE . LYS B 2 192 ? 19.913 30.235 3.008 1.00 73.61 192 B 1 ATOM 2711 N NZ . LYS B 2 192 ? 20.249 31.626 2.613 1.00 64.16 192 B 1 ATOM 2712 N N . ASN B 2 193 ? 23.243 24.445 4.256 1.00 95.03 193 B 1 ATOM 2713 C CA . ASN B 2 193 ? 24.481 23.679 4.426 1.00 95.02 193 B 1 ATOM 2714 C C . ASN B 2 193 ? 24.299 22.417 5.298 1.00 95.16 193 B 1 ATOM 2715 O O . ASN B 2 193 ? 25.008 22.204 6.282 1.00 91.41 193 B 1 ATOM 2716 C CB . ASN B 2 193 ? 25.580 24.643 4.915 1.00 93.88 193 B 1 ATOM 2717 C CG . ASN B 2 193 ? 26.961 24.019 4.819 1.00 92.14 193 B 1 ATOM 2718 O OD1 . ASN B 2 193 ? 27.348 23.471 3.816 1.00 84.40 193 B 1 ATOM 2719 N ND2 . ASN B 2 193 ? 27.760 24.114 5.858 1.00 84.21 193 B 1 ATOM 2720 N N . ILE B 2 194 ? 23.290 21.623 4.964 1.00 94.88 194 B 1 ATOM 2721 C CA . ILE B 2 194 ? 22.919 20.397 5.680 1.00 93.93 194 B 1 ATOM 2722 C C . ILE B 2 194 ? 22.938 19.185 4.749 1.00 94.47 194 B 1 ATOM 2723 O O . ILE B 2 194 ? 22.940 19.340 3.529 1.00 90.71 194 B 1 ATOM 2724 C CB . ILE B 2 194 ? 21.569 20.563 6.403 1.00 90.73 194 B 1 ATOM 2725 C CG1 . ILE B 2 194 ? 20.374 20.904 5.484 1.00 81.05 194 B 1 ATOM 2726 C CG2 . ILE B 2 194 ? 21.685 21.637 7.517 1.00 77.39 194 B 1 ATOM 2727 C CD1 . ILE B 2 194 ? 19.728 19.701 4.815 1.00 75.41 194 B 1 ATOM 2728 N N . ALA B 2 195 ? 22.929 17.996 5.336 1.00 94.64 195 B 1 ATOM 2729 C CA . ALA B 2 195 ? 22.930 16.725 4.615 1.00 94.02 195 B 1 ATOM 2730 C C . ALA B 2 195 ? 24.092 16.617 3.600 1.00 94.81 195 B 1 ATOM 2731 O O . ALA B 2 195 ? 25.210 17.068 3.870 1.00 90.75 195 B 1 ATOM 2732 C CB . ALA B 2 195 ? 21.518 16.479 4.046 1.00 91.35 195 B 1 ATOM 2733 N N . SER B 2 196 ? 23.850 15.976 2.459 1.00 94.44 196 B 1 ATOM 2734 C CA . SER B 2 196 ? 24.814 15.789 1.371 1.00 95.15 196 B 1 ATOM 2735 C C . SER B 2 196 ? 24.061 15.711 0.045 1.00 96.26 196 B 1 ATOM 2736 O O . SER B 2 196 ? 22.903 15.301 0.009 1.00 93.97 196 B 1 ATOM 2737 C CB . SER B 2 196 ? 25.600 14.494 1.614 1.00 93.11 196 B 1 ATOM 2738 O OG . SER B 2 196 ? 26.550 14.255 0.596 1.00 89.46 196 B 1 ATOM 2739 N N . ASP B 2 197 ? 24.740 16.046 -1.048 1.00 96.76 197 B 1 ATOM 2740 C CA . ASP B 2 197 ? 24.270 15.796 -2.416 1.00 97.10 197 B 1 ATOM 2741 C C . ASP B 2 197 ? 24.514 14.345 -2.879 1.00 97.59 197 B 1 ATOM 2742 O O . ASP B 2 197 ? 24.195 13.961 -4.003 1.00 96.28 197 B 1 ATOM 2743 C CB . ASP B 2 197 ? 24.929 16.822 -3.353 1.00 95.95 197 B 1 ATOM 2744 C CG . ASP B 2 197 ? 26.454 16.662 -3.481 1.00 96.18 197 B 1 ATOM 2745 O OD1 . ASP B 2 197 ? 27.060 15.910 -2.673 1.00 92.50 197 B 1 ATOM 2746 O OD2 . ASP B 2 197 ? 27.023 17.280 -4.403 1.00 92.41 197 B 1 ATOM 2747 N N . VAL B 2 198 ? 25.057 13.499 -2.001 1.00 97.39 198 B 1 ATOM 2748 C CA . VAL B 2 198 ? 25.284 12.074 -2.254 1.00 97.29 198 B 1 ATOM 2749 C C . VAL B 2 198 ? 24.618 11.219 -1.181 1.00 97.52 198 B 1 ATOM 2750 O O . VAL B 2 198 ? 24.883 11.349 0.013 1.00 96.52 198 B 1 ATOM 2751 C CB . VAL B 2 198 ? 26.786 11.751 -2.382 1.00 96.04 198 B 1 ATOM 2752 C CG1 . VAL B 2 198 ? 27.027 10.255 -2.625 1.00 91.88 198 B 1 ATOM 2753 C CG2 . VAL B 2 198 ? 27.425 12.511 -3.551 1.00 92.23 198 B 1 ATOM 2754 N N . ILE B 2 199 ? 23.823 10.265 -1.618 1.00 97.74 199 B 1 ATOM 2755 C CA . ILE B 2 199 ? 23.363 9.138 -0.803 1.00 97.78 199 B 1 ATOM 2756 C C . ILE B 2 199 ? 24.126 7.894 -1.258 1.00 97.62 199 B 1 ATOM 2757 O O . ILE B 2 199 ? 24.114 7.543 -2.439 1.00 96.97 199 B 1 ATOM 2758 C CB . ILE B 2 199 ? 21.833 8.959 -0.896 1.00 97.76 199 B 1 ATOM 2759 C CG1 . ILE B 2 199 ? 21.096 10.203 -0.346 1.00 96.92 199 B 1 ATOM 2760 C CG2 . ILE B 2 199 ? 21.403 7.690 -0.137 1.00 96.75 199 B 1 ATOM 2761 C CD1 . ILE B 2 199 ? 19.582 10.205 -0.615 1.00 95.98 199 B 1 ATOM 2762 N N . PHE B 2 200 ? 24.792 7.211 -0.332 1.00 97.04 200 B 1 ATOM 2763 C CA . PHE B 2 200 ? 25.503 5.965 -0.618 1.00 96.69 200 B 1 ATOM 2764 C C . PHE B 2 200 ? 24.922 4.819 0.203 1.00 96.65 200 B 1 ATOM 2765 O O . PHE B 2 200 ? 25.380 4.524 1.309 1.00 95.08 200 B 1 ATOM 2766 C CB . PHE B 2 200 ? 27.013 6.148 -0.410 1.00 95.66 200 B 1 ATOM 2767 C CG . PHE B 2 200 ? 27.841 4.918 -0.773 1.00 95.07 200 B 1 ATOM 2768 C CD1 . PHE B 2 200 ? 28.782 4.396 0.141 1.00 91.08 200 B 1 ATOM 2769 C CD2 . PHE B 2 200 ? 27.689 4.299 -2.025 1.00 91.66 200 B 1 ATOM 2770 C CE1 . PHE B 2 200 ? 29.572 3.283 -0.205 1.00 90.75 200 B 1 ATOM 2771 C CE2 . PHE B 2 200 ? 28.468 3.177 -2.373 1.00 90.12 200 B 1 ATOM 2772 C CZ . PHE B 2 200 ? 29.413 2.675 -1.467 1.00 91.26 200 B 1 ATOM 2773 N N . SER B 2 201 ? 23.913 4.148 -0.346 1.00 97.00 201 B 1 ATOM 2774 C CA . SER B 2 201 ? 23.210 3.075 0.353 1.00 96.91 201 B 1 ATOM 2775 C C . SER B 2 201 ? 22.769 1.936 -0.566 1.00 97.00 201 B 1 ATOM 2776 O O . SER B 2 201 ? 22.850 2.004 -1.802 1.00 96.38 201 B 1 ATOM 2777 C CB . SER B 2 201 ? 22.047 3.643 1.174 1.00 95.96 201 B 1 ATOM 2778 O OG . SER B 2 201 ? 20.977 4.086 0.372 1.00 93.47 201 B 1 ATOM 2779 N N . GLU B 2 202 ? 22.376 0.835 0.052 1.00 96.62 202 B 1 ATOM 2780 C CA . GLU B 2 202 ? 21.958 -0.365 -0.657 1.00 96.27 202 B 1 ATOM 2781 C C . GLU B 2 202 ? 20.591 -0.187 -1.315 1.00 96.14 202 B 1 ATOM 2782 O O . GLU B 2 202 ? 19.692 0.481 -0.808 1.00 94.95 202 B 1 ATOM 2783 C CB . GLU B 2 202 ? 21.967 -1.587 0.272 1.00 95.47 202 B 1 ATOM 2784 C CG . GLU B 2 202 ? 23.391 -1.940 0.724 1.00 90.53 202 B 1 ATOM 2785 C CD . GLU B 2 202 ? 23.475 -3.224 1.552 1.00 88.60 202 B 1 ATOM 2786 O OE1 . GLU B 2 202 ? 24.459 -3.344 2.317 1.00 81.11 202 B 1 ATOM 2787 O OE2 . GLU B 2 202 ? 22.608 -4.110 1.374 1.00 82.54 202 B 1 ATOM 2788 N N . ARG B 2 203 ? 20.414 -0.849 -2.451 1.00 95.74 203 B 1 ATOM 2789 C CA . ARG B 2 203 ? 19.098 -0.978 -3.058 1.00 94.51 203 B 1 ATOM 2790 C C . ARG B 2 203 ? 18.235 -1.893 -2.191 1.00 94.58 203 B 1 ATOM 2791 O O . ARG B 2 203 ? 18.618 -3.021 -1.912 1.00 92.44 203 B 1 ATOM 2792 C CB . ARG B 2 203 ? 19.241 -1.494 -4.499 1.00 92.00 203 B 1 ATOM 2793 C CG . ARG B 2 203 ? 17.875 -1.626 -5.182 1.00 82.99 203 B 1 ATOM 2794 C CD . ARG B 2 203 ? 18.012 -2.168 -6.598 1.00 79.74 203 B 1 ATOM 2795 N NE . ARG B 2 203 ? 16.688 -2.528 -7.130 1.00 70.98 203 B 1 ATOM 2796 C CZ . ARG B 2 203 ? 16.426 -3.136 -8.270 1.00 64.58 203 B 1 ATOM 2797 N NH1 . ARG B 2 203 ? 17.364 -3.446 -9.113 1.00 59.38 203 B 1 ATOM 2798 N NH2 . ARG B 2 203 ? 15.198 -3.446 -8.565 1.00 57.33 203 B 1 ATOM 2799 N N . ARG B 2 204 ? 17.023 -1.426 -1.865 1.00 94.14 204 B 1 ATOM 2800 C CA . ARG B 2 204 ? 15.975 -2.196 -1.173 1.00 92.31 204 B 1 ATOM 2801 C C . ARG B 2 204 ? 15.010 -2.821 -2.190 1.00 90.90 204 B 1 ATOM 2802 O O . ARG B 2 204 ? 15.439 -3.584 -3.076 1.00 84.47 204 B 1 ATOM 2803 C CB . ARG B 2 204 ? 15.319 -1.299 -0.101 1.00 90.08 204 B 1 ATOM 2804 C CG . ARG B 2 204 ? 16.319 -0.813 0.973 1.00 87.82 204 B 1 ATOM 2805 C CD . ARG B 2 204 ? 15.624 0.001 2.076 1.00 85.86 204 B 1 ATOM 2806 N NE . ARG B 2 204 ? 15.125 1.308 1.585 1.00 83.56 204 B 1 ATOM 2807 C CZ . ARG B 2 204 ? 14.256 2.100 2.194 1.00 83.35 204 B 1 ATOM 2808 N NH1 . ARG B 2 204 ? 13.719 1.797 3.341 1.00 72.72 204 B 1 ATOM 2809 N NH2 . ARG B 2 204 ? 13.915 3.239 1.664 1.00 76.46 204 B 1 ATOM 2810 N N . GLY B 2 205 ? 13.730 -2.494 -2.103 1.00 92.23 205 B 1 ATOM 2811 C CA . GLY B 2 205 ? 12.710 -2.976 -3.031 1.00 91.38 205 B 1 ATOM 2812 C C . GLY B 2 205 ? 12.920 -2.531 -4.488 1.00 92.90 205 B 1 ATOM 2813 O O . GLY B 2 205 ? 13.741 -1.668 -4.809 1.00 90.86 205 B 1 ATOM 2814 N N . GLN B 2 206 ? 12.150 -3.108 -5.402 1.00 88.89 206 B 1 ATOM 2815 C CA . GLN B 2 206 ? 12.171 -2.700 -6.804 1.00 88.85 206 B 1 ATOM 2816 C C . GLN B 2 206 ? 11.705 -1.245 -6.943 1.00 90.18 206 B 1 ATOM 2817 O O . GLN B 2 206 ? 10.640 -0.892 -6.455 1.00 86.91 206 B 1 ATOM 2818 C CB . GLN B 2 206 ? 11.300 -3.651 -7.629 1.00 85.39 206 B 1 ATOM 2819 C CG . GLN B 2 206 ? 11.327 -3.292 -9.123 1.00 76.31 206 B 1 ATOM 2820 C CD . GLN B 2 206 ? 10.477 -4.243 -9.965 1.00 68.93 206 B 1 ATOM 2821 O OE1 . GLN B 2 206 ? 10.025 -5.275 -9.509 1.00 63.95 206 B 1 ATOM 2822 N NE2 . GLN B 2 206 ? 10.238 -3.919 -11.215 1.00 60.34 206 B 1 ATOM 2823 N N . SER B 2 207 ? 12.509 -0.428 -7.634 1.00 90.84 207 B 1 ATOM 2824 C CA . SER B 2 207 ? 12.262 1.009 -7.832 1.00 92.02 207 B 1 ATOM 2825 C C . SER B 2 207 ? 12.098 1.820 -6.538 1.00 94.05 207 B 1 ATOM 2826 O O . SER B 2 207 ? 11.767 2.997 -6.603 1.00 92.50 207 B 1 ATOM 2827 C CB . SER B 2 207 ? 11.104 1.247 -8.816 1.00 88.98 207 B 1 ATOM 2828 O OG . SER B 2 207 ? 11.346 0.540 -10.019 1.00 79.41 207 B 1 ATOM 2829 N N . GLN B 2 208 ? 12.360 1.232 -5.369 1.00 94.51 208 B 1 ATOM 2830 C CA . GLN B 2 208 ? 12.276 1.921 -4.085 1.00 95.65 208 B 1 ATOM 2831 C C . GLN B 2 208 ? 13.461 2.870 -3.919 1.00 96.62 208 B 1 ATOM 2832 O O . GLN B 2 208 ? 14.619 2.445 -4.004 1.00 96.04 208 B 1 ATOM 2833 C CB . GLN B 2 208 ? 12.199 0.896 -2.949 1.00 94.71 208 B 1 ATOM 2834 C CG . GLN B 2 208 ? 11.916 1.555 -1.592 1.00 91.58 208 B 1 ATOM 2835 C CD . GLN B 2 208 ? 11.781 0.547 -0.454 1.00 89.62 208 B 1 ATOM 2836 O OE1 . GLN B 2 208 ? 12.090 -0.628 -0.573 1.00 83.47 208 B 1 ATOM 2837 N NE2 . GLN B 2 208 ? 11.327 0.976 0.702 1.00 80.71 208 B 1 ATOM 2838 N N . LYS B 2 209 ? 13.157 4.150 -3.662 1.00 96.58 209 B 1 ATOM 2839 C CA . LYS B 2 209 ? 14.155 5.176 -3.364 1.00 96.89 209 B 1 ATOM 2840 C C . LYS B 2 209 ? 14.719 4.989 -1.948 1.00 96.97 209 B 1 ATOM 2841 O O . LYS B 2 209 ? 14.100 4.302 -1.125 1.00 96.12 209 B 1 ATOM 2842 C CB . LYS B 2 209 ? 13.547 6.567 -3.612 1.00 95.99 209 B 1 ATOM 2843 C CG . LYS B 2 209 ? 13.131 6.794 -5.084 1.00 94.22 209 B 1 ATOM 2844 C CD . LYS B 2 209 ? 14.287 6.625 -6.082 1.00 91.24 209 B 1 ATOM 2845 C CE . LYS B 2 209 ? 13.879 6.980 -7.515 1.00 89.47 209 B 1 ATOM 2846 N NZ . LYS B 2 209 ? 13.063 5.928 -8.155 1.00 84.51 209 B 1 ATOM 2847 N N . PRO B 2 210 ? 15.934 5.502 -1.682 1.00 97.86 210 B 1 ATOM 2848 C CA . PRO B 2 210 ? 16.590 5.315 -0.393 1.00 97.93 210 B 1 ATOM 2849 C C . PRO B 2 210 ? 15.847 6.061 0.723 1.00 98.04 210 B 1 ATOM 2850 O O . PRO B 2 210 ? 15.247 7.099 0.481 1.00 97.37 210 B 1 ATOM 2851 C CB . PRO B 2 210 ? 18.018 5.825 -0.594 1.00 97.32 210 B 1 ATOM 2852 C CG . PRO B 2 210 ? 17.852 6.904 -1.662 1.00 95.97 210 B 1 ATOM 2853 C CD . PRO B 2 210 ? 16.759 6.324 -2.554 1.00 97.40 210 B 1 ATOM 2854 N N . GLU B 2 211 ? 15.913 5.531 1.943 1.00 97.63 211 B 1 ATOM 2855 C CA . GLU B 2 211 ? 15.265 6.130 3.119 1.00 97.43 211 B 1 ATOM 2856 C C . GLU B 2 211 ? 15.865 7.495 3.483 1.00 97.77 211 B 1 ATOM 2857 O O . GLU B 2 211 ? 15.185 8.383 3.971 1.00 97.04 211 B 1 ATOM 2858 C CB . GLU B 2 211 ? 15.436 5.155 4.299 1.00 96.26 211 B 1 ATOM 2859 C CG . GLU B 2 211 ? 14.538 5.503 5.503 1.00 90.03 211 B 1 ATOM 2860 C CD . GLU B 2 211 ? 13.047 5.415 5.128 1.00 90.60 211 B 1 ATOM 2861 O OE1 . GLU B 2 211 ? 12.254 6.146 5.735 1.00 82.69 211 B 1 ATOM 2862 O OE2 . GLU B 2 211 ? 12.707 4.606 4.215 1.00 84.45 211 B 1 ATOM 2863 N N . GLU B 2 212 ? 17.154 7.662 3.199 1.00 97.38 212 B 1 ATOM 2864 C CA . GLU B 2 212 ? 17.936 8.853 3.507 1.00 97.39 212 B 1 ATOM 2865 C C . GLU B 2 212 ? 17.327 10.114 2.883 1.00 97.76 212 B 1 ATOM 2866 O O . GLU B 2 212 ? 17.466 11.190 3.452 1.00 97.13 212 B 1 ATOM 2867 C CB . GLU B 2 212 ? 19.383 8.651 3.021 1.00 96.95 212 B 1 ATOM 2868 C CG . GLU B 2 212 ? 20.151 7.509 3.727 1.00 94.40 212 B 1 ATOM 2869 C CD . GLU B 2 212 ? 20.022 6.121 3.057 1.00 94.36 212 B 1 ATOM 2870 O OE1 . GLU B 2 212 ? 20.959 5.313 3.191 1.00 86.68 212 B 1 ATOM 2871 O OE2 . GLU B 2 212 ? 19.015 5.834 2.368 1.00 88.95 212 B 1 ATOM 2872 N N . ILE B 2 213 ? 16.584 10.004 1.775 1.00 98.10 213 B 1 ATOM 2873 C CA . ILE B 2 213 ? 15.968 11.173 1.138 1.00 98.29 213 B 1 ATOM 2874 C C . ILE B 2 213 ? 14.953 11.856 2.066 1.00 98.35 213 B 1 ATOM 2875 O O . ILE B 2 213 ? 14.934 13.081 2.154 1.00 98.12 213 B 1 ATOM 2876 C CB . ILE B 2 213 ? 15.353 10.807 -0.230 1.00 98.06 213 B 1 ATOM 2877 C CG1 . ILE B 2 213 ? 15.063 12.043 -1.109 1.00 96.56 213 B 1 ATOM 2878 C CG2 . ILE B 2 213 ? 14.062 9.978 -0.109 1.00 97.21 213 B 1 ATOM 2879 C CD1 . ILE B 2 213 ? 16.316 12.829 -1.490 1.00 95.31 213 B 1 ATOM 2880 N N . TYR B 2 214 ? 14.169 11.078 2.825 1.00 98.37 214 B 1 ATOM 2881 C CA . TYR B 2 214 ? 13.202 11.614 3.787 1.00 98.32 214 B 1 ATOM 2882 C C . TYR B 2 214 ? 13.913 12.290 4.962 1.00 98.13 214 B 1 ATOM 2883 O O . TYR B 2 214 ? 13.495 13.344 5.436 1.00 97.44 214 B 1 ATOM 2884 C CB . TYR B 2 214 ? 12.292 10.488 4.286 1.00 98.23 214 B 1 ATOM 2885 C CG . TYR B 2 214 ? 11.507 9.798 3.186 1.00 98.40 214 B 1 ATOM 2886 C CD1 . TYR B 2 214 ? 10.341 10.388 2.659 1.00 97.74 214 B 1 ATOM 2887 C CD2 . TYR B 2 214 ? 11.958 8.568 2.668 1.00 97.78 214 B 1 ATOM 2888 C CE1 . TYR B 2 214 ? 9.631 9.759 1.620 1.00 97.50 214 B 1 ATOM 2889 C CE2 . TYR B 2 214 ? 11.260 7.932 1.626 1.00 97.49 214 B 1 ATOM 2890 C CZ . TYR B 2 214 ? 10.095 8.535 1.101 1.00 97.95 214 B 1 ATOM 2891 O OH . TYR B 2 214 ? 9.437 7.919 0.074 1.00 97.17 214 B 1 ATOM 2892 N N . GLN B 2 215 ? 15.043 11.718 5.404 1.00 97.89 215 B 1 ATOM 2893 C CA . GLN B 2 215 ? 15.874 12.295 6.462 1.00 97.40 215 B 1 ATOM 2894 C C . GLN B 2 215 ? 16.510 13.615 6.009 1.00 97.58 215 B 1 ATOM 2895 O O . GLN B 2 215 ? 16.548 14.576 6.779 1.00 96.80 215 B 1 ATOM 2896 C CB . GLN B 2 215 ? 16.973 11.305 6.872 1.00 96.60 215 B 1 ATOM 2897 C CG . GLN B 2 215 ? 16.417 9.981 7.421 1.00 91.39 215 B 1 ATOM 2898 C CD . GLN B 2 215 ? 17.522 8.971 7.742 1.00 86.05 215 B 1 ATOM 2899 O OE1 . GLN B 2 215 ? 18.713 9.231 7.622 1.00 78.50 215 B 1 ATOM 2900 N NE2 . GLN B 2 215 ? 17.168 7.776 8.157 1.00 75.01 215 B 1 ATOM 2901 N N . TYR B 2 216 ? 16.980 13.689 4.763 1.00 97.78 216 B 1 ATOM 2902 C CA . TYR B 2 216 ? 17.563 14.907 4.194 1.00 97.76 216 B 1 ATOM 2903 C C . TYR B 2 216 ? 16.520 16.021 4.067 1.00 97.80 216 B 1 ATOM 2904 O O . TYR B 2 216 ? 16.783 17.152 4.465 1.00 97.19 216 B 1 ATOM 2905 C CB . TYR B 2 216 ? 18.200 14.593 2.831 1.00 97.37 216 B 1 ATOM 2906 C CG . TYR B 2 216 ? 19.504 13.813 2.842 1.00 95.90 216 B 1 ATOM 2907 C CD1 . TYR B 2 216 ? 19.993 13.144 3.989 1.00 92.02 216 B 1 ATOM 2908 C CD2 . TYR B 2 216 ? 20.262 13.762 1.650 1.00 92.41 216 B 1 ATOM 2909 C CE1 . TYR B 2 216 ? 21.218 12.452 3.962 1.00 90.79 216 B 1 ATOM 2910 C CE2 . TYR B 2 216 ? 21.488 13.073 1.609 1.00 91.08 216 B 1 ATOM 2911 C CZ . TYR B 2 216 ? 21.967 12.422 2.769 1.00 90.43 216 B 1 ATOM 2912 O OH . TYR B 2 216 ? 23.175 11.772 2.731 1.00 86.40 216 B 1 ATOM 2913 N N . ILE B 2 217 ? 15.314 15.692 3.605 1.00 98.01 217 B 1 ATOM 2914 C CA . ILE B 2 217 ? 14.203 16.645 3.529 1.00 98.03 217 B 1 ATOM 2915 C C . ILE B 2 217 ? 13.797 17.128 4.929 1.00 97.81 217 B 1 ATOM 2916 O O . ILE B 2 217 ? 13.591 18.325 5.127 1.00 97.24 217 B 1 ATOM 2917 C CB . ILE B 2 217 ? 13.033 16.023 2.739 1.00 98.10 217 B 1 ATOM 2918 C CG1 . ILE B 2 217 ? 13.428 15.936 1.245 1.00 97.55 217 B 1 ATOM 2919 C CG2 . ILE B 2 217 ? 11.742 16.841 2.908 1.00 97.70 217 B 1 ATOM 2920 C CD1 . ILE B 2 217 ? 12.502 15.050 0.404 1.00 96.54 217 B 1 ATOM 2921 N N . ASN B 2 218 ? 13.758 16.240 5.923 1.00 97.79 218 B 1 ATOM 2922 C CA . ASN B 2 218 ? 13.492 16.625 7.310 1.00 97.27 218 B 1 ATOM 2923 C C . ASN B 2 218 ? 14.578 17.558 7.879 1.00 97.33 218 B 1 ATOM 2924 O O . ASN B 2 218 ? 14.263 18.511 8.593 1.00 96.56 218 B 1 ATOM 2925 C CB . ASN B 2 218 ? 13.349 15.350 8.155 1.00 96.12 218 B 1 ATOM 2926 C CG . ASN B 2 218 ? 12.938 15.677 9.579 1.00 87.73 218 B 1 ATOM 2927 O OD1 . ASN B 2 218 ? 13.753 15.915 10.451 1.00 76.88 218 B 1 ATOM 2928 N ND2 . ASN B 2 218 ? 11.651 15.724 9.848 1.00 74.87 218 B 1 ATOM 2929 N N . GLN B 2 219 ? 15.853 17.342 7.536 1.00 97.57 219 B 1 ATOM 2930 C CA . GLN B 2 219 ? 16.948 18.242 7.916 1.00 97.42 219 B 1 ATOM 2931 C C . GLN B 2 219 ? 16.870 19.592 7.191 1.00 97.53 219 B 1 ATOM 2932 O O . GLN B 2 219 ? 17.151 20.625 7.800 1.00 96.67 219 B 1 ATOM 2933 C CB . GLN B 2 219 ? 18.301 17.577 7.626 1.00 96.99 219 B 1 ATOM 2934 C CG . GLN B 2 219 ? 18.627 16.427 8.592 1.00 93.36 219 B 1 ATOM 2935 C CD . GLN B 2 219 ? 19.911 15.706 8.169 1.00 90.33 219 B 1 ATOM 2936 O OE1 . GLN B 2 219 ? 20.934 16.311 7.869 1.00 81.57 219 B 1 ATOM 2937 N NE2 . GLN B 2 219 ? 19.909 14.394 8.124 1.00 78.31 219 B 1 ATOM 2938 N N . LEU B 2 220 ? 16.473 19.591 5.913 1.00 97.60 220 B 1 ATOM 2939 C CA . LEU B 2 220 ? 16.313 20.800 5.098 1.00 97.54 220 B 1 ATOM 2940 C C . LEU B 2 220 ? 15.162 21.674 5.603 1.00 97.57 220 B 1 ATOM 2941 O O . LEU B 2 220 ? 15.298 22.894 5.679 1.00 96.89 220 B 1 ATOM 2942 C CB . LEU B 2 220 ? 16.102 20.374 3.634 1.00 97.45 220 B 1 ATOM 2943 C CG . LEU B 2 220 ? 15.906 21.543 2.643 1.00 96.99 220 B 1 ATOM 2944 C CD1 . LEU B 2 220 ? 17.151 22.426 2.539 1.00 95.68 220 B 1 ATOM 2945 C CD2 . LEU B 2 220 ? 15.582 20.989 1.257 1.00 95.50 220 B 1 ATOM 2946 N N . CYS B 2 221 ? 14.036 21.063 5.961 1.00 97.54 221 B 1 ATOM 2947 C CA . CYS B 2 221 ? 12.851 21.758 6.452 1.00 97.41 221 B 1 ATOM 2948 C C . CYS B 2 221 ? 12.257 21.038 7.678 1.00 97.40 221 B 1 ATOM 2949 O O . CYS B 2 221 ? 11.275 20.297 7.548 1.00 96.61 221 B 1 ATOM 2950 C CB . CYS B 2 221 ? 11.862 21.901 5.288 1.00 97.04 221 B 1 ATOM 2951 S SG . CYS B 2 221 ? 10.514 23.021 5.771 1.00 95.70 221 B 1 ATOM 2952 N N . PRO B 2 222 ? 12.825 21.240 8.881 1.00 97.02 222 B 1 ATOM 2953 C CA . PRO B 2 222 ? 12.300 20.617 10.092 1.00 96.20 222 B 1 ATOM 2954 C C . PRO B 2 222 ? 10.849 21.034 10.357 1.00 95.38 222 B 1 ATOM 2955 O O . PRO B 2 222 ? 10.518 22.214 10.279 1.00 92.03 222 B 1 ATOM 2956 C CB . PRO B 2 222 ? 13.233 21.063 11.226 1.00 95.14 222 B 1 ATOM 2957 C CG . PRO B 2 222 ? 14.530 21.435 10.506 1.00 93.97 222 B 1 ATOM 2958 C CD . PRO B 2 222 ? 14.032 21.997 9.181 1.00 96.39 222 B 1 ATOM 2959 N N . ASN B 2 223 ? 9.994 20.068 10.709 1.00 95.95 223 B 1 ATOM 2960 C CA . ASN B 2 223 ? 8.559 20.289 10.945 1.00 95.63 223 B 1 ATOM 2961 C C . ASN B 2 223 ? 7.832 20.945 9.754 1.00 96.16 223 B 1 ATOM 2962 O O . ASN B 2 223 ? 6.852 21.674 9.938 1.00 93.84 223 B 1 ATOM 2963 C CB . ASN B 2 223 ? 8.347 21.051 12.266 1.00 93.72 223 B 1 ATOM 2964 C CG . ASN B 2 223 ? 9.035 20.394 13.449 1.00 90.15 223 B 1 ATOM 2965 O OD1 . ASN B 2 223 ? 8.986 19.197 13.658 1.00 80.04 223 B 1 ATOM 2966 N ND2 . ASN B 2 223 ? 9.714 21.173 14.270 1.00 78.00 223 B 1 ATOM 2967 N N . GLY B 2 224 ? 8.328 20.722 8.536 1.00 96.19 224 B 1 ATOM 2968 C CA . GLY B 2 224 ? 7.709 21.207 7.313 1.00 96.67 224 B 1 ATOM 2969 C C . GLY B 2 224 ? 6.452 20.436 6.915 1.00 97.32 224 B 1 ATOM 2970 O O . GLY B 2 224 ? 6.132 19.375 7.458 1.00 96.43 224 B 1 ATOM 2971 N N . ASN B 2 225 ? 5.755 20.986 5.933 1.00 97.28 225 B 1 ATOM 2972 C CA . ASN B 2 225 ? 4.678 20.295 5.234 1.00 97.83 225 B 1 ATOM 2973 C C . ASN B 2 225 ? 5.234 19.657 3.958 1.00 98.24 225 B 1 ATOM 2974 O O . ASN B 2 225 ? 5.721 20.367 3.071 1.00 97.70 225 B 1 ATOM 2975 C CB . ASN B 2 225 ? 3.540 21.277 4.941 1.00 97.39 225 B 1 ATOM 2976 C CG . ASN B 2 225 ? 2.824 21.711 6.205 1.00 96.82 225 B 1 ATOM 2977 O OD1 . ASN B 2 225 ? 2.974 22.811 6.692 1.00 87.91 225 B 1 ATOM 2978 N ND2 . ASN B 2 225 ? 2.001 20.851 6.772 1.00 87.61 225 B 1 ATOM 2979 N N . TYR B 2 226 ? 5.151 18.336 3.867 1.00 98.41 226 B 1 ATOM 2980 C CA . TYR B 2 226 ? 5.756 17.564 2.784 1.00 98.57 226 B 1 ATOM 2981 C C . TYR B 2 226 ? 4.681 16.898 1.923 1.00 98.68 226 B 1 ATOM 2982 O O . TYR B 2 226 ? 3.716 16.329 2.437 1.00 98.30 226 B 1 ATOM 2983 C CB . TYR B 2 226 ? 6.722 16.520 3.357 1.00 98.32 226 B 1 ATOM 2984 C CG . TYR B 2 226 ? 7.630 16.988 4.475 1.00 98.25 226 B 1 ATOM 2985 C CD1 . TYR B 2 226 ? 8.486 18.097 4.307 1.00 96.87 226 B 1 ATOM 2986 C CD2 . TYR B 2 226 ? 7.622 16.304 5.709 1.00 96.77 226 B 1 ATOM 2987 C CE1 . TYR B 2 226 ? 9.330 18.516 5.352 1.00 96.00 226 B 1 ATOM 2988 C CE2 . TYR B 2 226 ? 8.465 16.711 6.758 1.00 96.06 226 B 1 ATOM 2989 C CZ . TYR B 2 226 ? 9.321 17.817 6.577 1.00 96.66 226 B 1 ATOM 2990 O OH . TYR B 2 226 ? 10.145 18.207 7.601 1.00 95.25 226 B 1 ATOM 2991 N N . LEU B 2 227 ? 4.871 16.934 0.612 1.00 98.73 227 B 1 ATOM 2992 C CA . LEU B 2 227 ? 4.025 16.250 -0.362 1.00 98.83 227 B 1 ATOM 2993 C C . LEU B 2 227 ? 4.876 15.315 -1.220 1.00 98.88 227 B 1 ATOM 2994 O O . LEU B 2 227 ? 5.819 15.760 -1.870 1.00 98.73 227 B 1 ATOM 2995 C CB . LEU B 2 227 ? 3.297 17.308 -1.210 1.00 98.70 227 B 1 ATOM 2996 C CG . LEU B 2 227 ? 2.467 16.742 -2.381 1.00 98.35 227 B 1 ATOM 2997 C CD1 . LEU B 2 227 ? 1.278 15.909 -1.900 1.00 97.48 227 B 1 ATOM 2998 C CD2 . LEU B 2 227 ? 1.918 17.890 -3.224 1.00 97.29 227 B 1 ATOM 2999 N N . GLU B 2 228 ? 4.500 14.046 -1.299 1.00 98.84 228 B 1 ATOM 3000 C CA . GLU B 2 228 ? 5.068 13.105 -2.259 1.00 98.84 228 B 1 ATOM 3001 C C . GLU B 2 228 ? 4.031 12.736 -3.323 1.00 98.84 228 B 1 ATOM 3002 O O . GLU B 2 228 ? 2.908 12.332 -3.017 1.00 98.54 228 B 1 ATOM 3003 C CB . GLU B 2 228 ? 5.638 11.873 -1.537 1.00 98.64 228 B 1 ATOM 3004 C CG . GLU B 2 228 ? 6.349 10.928 -2.523 1.00 98.02 228 B 1 ATOM 3005 C CD . GLU B 2 228 ? 7.128 9.789 -1.852 1.00 97.94 228 B 1 ATOM 3006 O OE1 . GLU B 2 228 ? 7.870 9.082 -2.577 1.00 94.79 228 B 1 ATOM 3007 O OE2 . GLU B 2 228 ? 7.015 9.595 -0.623 1.00 95.90 228 B 1 ATOM 3008 N N . ILE B 2 229 ? 4.410 12.838 -4.585 1.00 98.80 229 B 1 ATOM 3009 C CA . ILE B 2 229 ? 3.592 12.435 -5.728 1.00 98.76 229 B 1 ATOM 3010 C C . ILE B 2 229 ? 4.202 11.179 -6.358 1.00 98.71 229 B 1 ATOM 3011 O O . ILE B 2 229 ? 5.417 11.076 -6.508 1.00 98.31 229 B 1 ATOM 3012 C CB . ILE B 2 229 ? 3.413 13.593 -6.737 1.00 98.62 229 B 1 ATOM 3013 C CG1 . ILE B 2 229 ? 2.976 14.900 -6.025 1.00 97.96 229 B 1 ATOM 3014 C CG2 . ILE B 2 229 ? 2.381 13.188 -7.806 1.00 98.06 229 B 1 ATOM 3015 C CD1 . ILE B 2 229 ? 2.803 16.105 -6.960 1.00 96.49 229 B 1 ATOM 3016 N N . PHE B 2 230 ? 3.347 10.234 -6.751 1.00 98.56 230 B 1 ATOM 3017 C CA . PHE B 2 230 ? 3.721 8.900 -7.230 1.00 98.41 230 B 1 ATOM 3018 C C . PHE B 2 230 ? 4.273 7.979 -6.132 1.00 98.09 230 B 1 ATOM 3019 O O . PHE B 2 230 ? 5.128 7.121 -6.377 1.00 97.15 230 B 1 ATOM 3020 C CB . PHE B 2 230 ? 4.613 8.992 -8.478 1.00 98.28 230 B 1 ATOM 3021 C CG . PHE B 2 230 ? 4.093 9.918 -9.554 1.00 98.39 230 B 1 ATOM 3022 C CD1 . PHE B 2 230 ? 2.892 9.612 -10.223 1.00 98.00 230 B 1 ATOM 3023 C CD2 . PHE B 2 230 ? 4.794 11.091 -9.886 1.00 98.02 230 B 1 ATOM 3024 C CE1 . PHE B 2 230 ? 2.404 10.462 -11.226 1.00 97.76 230 B 1 ATOM 3025 C CE2 . PHE B 2 230 ? 4.312 11.945 -10.896 1.00 97.68 230 B 1 ATOM 3026 C CZ . PHE B 2 230 ? 3.116 11.627 -11.566 1.00 97.81 230 B 1 ATOM 3027 N N . ALA B 2 231 ? 3.739 8.138 -4.929 1.00 98.31 231 B 1 ATOM 3028 C CA . ALA B 2 231 ? 4.064 7.284 -3.801 1.00 98.11 231 B 1 ATOM 3029 C C . ALA B 2 231 ? 3.454 5.880 -3.939 1.00 97.57 231 B 1 ATOM 3030 O O . ALA B 2 231 ? 2.375 5.669 -4.501 1.00 96.14 231 B 1 ATOM 3031 C CB . ALA B 2 231 ? 3.597 7.969 -2.512 1.00 97.87 231 B 1 ATOM 3032 N N . ARG B 2 232 ? 4.141 4.921 -3.323 1.00 97.33 232 B 1 ATOM 3033 C CA . ARG B 2 232 ? 3.638 3.579 -3.016 1.00 96.91 232 B 1 ATOM 3034 C C . ARG B 2 232 ? 3.547 3.411 -1.500 1.00 97.20 232 B 1 ATOM 3035 O O . ARG B 2 232 ? 4.053 4.241 -0.752 1.00 96.53 232 B 1 ATOM 3036 C CB . ARG B 2 232 ? 4.556 2.528 -3.646 1.00 95.36 232 B 1 ATOM 3037 C CG . ARG B 2 232 ? 4.656 2.664 -5.174 1.00 92.82 232 B 1 ATOM 3038 C CD . ARG B 2 232 ? 5.493 1.533 -5.778 1.00 90.29 232 B 1 ATOM 3039 N NE . ARG B 2 232 ? 6.864 1.537 -5.245 1.00 86.09 232 B 1 ATOM 3040 C CZ . ARG B 2 232 ? 7.883 0.803 -5.665 1.00 85.54 232 B 1 ATOM 3041 N NH1 . ARG B 2 232 ? 7.771 -0.019 -6.671 1.00 77.62 232 B 1 ATOM 3042 N NH2 . ARG B 2 232 ? 9.036 0.890 -5.075 1.00 78.92 232 B 1 ATOM 3043 N N . ARG B 2 233 ? 2.985 2.305 -1.040 1.00 96.92 233 B 1 ATOM 3044 C CA . ARG B 2 233 ? 2.847 2.032 0.408 1.00 96.71 233 B 1 ATOM 3045 C C . ARG B 2 233 ? 4.168 2.118 1.189 1.00 97.01 233 B 1 ATOM 3046 O O . ARG B 2 233 ? 4.171 2.546 2.333 1.00 95.77 233 B 1 ATOM 3047 C CB . ARG B 2 233 ? 2.214 0.653 0.628 1.00 95.65 233 B 1 ATOM 3048 C CG . ARG B 2 233 ? 0.743 0.626 0.188 1.00 94.06 233 B 1 ATOM 3049 C CD . ARG B 2 233 ? 0.119 -0.721 0.542 1.00 92.51 233 B 1 ATOM 3050 N NE . ARG B 2 233 ? -1.316 -0.738 0.193 1.00 91.44 233 B 1 ATOM 3051 C CZ . ARG B 2 233 ? -2.192 -1.649 0.565 1.00 91.15 233 B 1 ATOM 3052 N NH1 . ARG B 2 233 ? -1.860 -2.712 1.244 1.00 87.04 233 B 1 ATOM 3053 N NH2 . ARG B 2 233 ? -3.446 -1.491 0.260 1.00 86.86 233 B 1 ATOM 3054 N N . ASN B 2 234 ? 5.288 1.725 0.579 1.00 96.55 234 B 1 ATOM 3055 C CA . ASN B 2 234 ? 6.609 1.818 1.208 1.00 96.47 234 B 1 ATOM 3056 C C . ASN B 2 234 ? 7.169 3.252 1.293 1.00 97.33 234 B 1 ATOM 3057 O O . ASN B 2 234 ? 8.226 3.430 1.893 1.00 96.83 234 B 1 ATOM 3058 C CB . ASN B 2 234 ? 7.587 0.884 0.463 1.00 95.28 234 B 1 ATOM 3059 C CG . ASN B 2 234 ? 7.786 1.304 -0.987 1.00 93.53 234 B 1 ATOM 3060 O OD1 . ASN B 2 234 ? 7.167 0.766 -1.901 1.00 85.48 234 B 1 ATOM 3061 N ND2 . ASN B 2 234 ? 8.648 2.261 -1.255 1.00 85.78 234 B 1 ATOM 3062 N N . ASN B 2 235 ? 6.512 4.231 0.670 1.00 97.53 235 B 1 ATOM 3063 C CA . ASN B 2 235 ? 6.879 5.644 0.733 1.00 97.93 235 B 1 ATOM 3064 C C . ASN B 2 235 ? 6.084 6.407 1.801 1.00 98.26 235 B 1 ATOM 3065 O O . ASN B 2 235 ? 6.356 7.577 2.031 1.00 97.79 235 B 1 ATOM 3066 C CB . ASN B 2 235 ? 6.670 6.294 -0.646 1.00 97.65 235 B 1 ATOM 3067 C CG . ASN B 2 235 ? 7.477 5.630 -1.754 1.00 97.33 235 B 1 ATOM 3068 O OD1 . ASN B 2 235 ? 6.954 4.993 -2.659 1.00 89.54 235 B 1 ATOM 3069 N ND2 . ASN B 2 235 ? 8.784 5.760 -1.711 1.00 89.64 235 B 1 ATOM 3070 N N . LEU B 2 236 ? 5.103 5.773 2.430 1.00 98.24 236 B 1 ATOM 3071 C CA . LEU B 2 236 ? 4.300 6.426 3.457 1.00 98.28 236 B 1 ATOM 3072 C C . LEU B 2 236 ? 5.166 6.702 4.691 1.00 98.26 236 B 1 ATOM 3073 O O . LEU B 2 236 ? 5.730 5.778 5.272 1.00 97.51 236 B 1 ATOM 3074 C CB . LEU B 2 236 ? 3.065 5.575 3.790 1.00 98.02 236 B 1 ATOM 3075 C CG . LEU B 2 236 ? 2.112 5.346 2.598 1.00 97.47 236 B 1 ATOM 3076 C CD1 . LEU B 2 236 ? 0.946 4.455 3.018 1.00 96.89 236 B 1 ATOM 3077 C CD2 . LEU B 2 236 ? 1.535 6.653 2.050 1.00 96.53 236 B 1 ATOM 3078 N N . HIS B 2 237 ? 5.245 7.985 5.073 1.00 98.46 237 B 1 ATOM 3079 C CA . HIS B 2 237 ? 6.011 8.471 6.221 1.00 98.48 237 B 1 ATOM 3080 C C . HIS B 2 237 ? 5.143 9.409 7.060 1.00 98.53 237 B 1 ATOM 3081 O O . HIS B 2 237 ? 4.185 10.005 6.554 1.00 98.01 237 B 1 ATOM 3082 C CB . HIS B 2 237 ? 7.289 9.183 5.751 1.00 98.16 237 B 1 ATOM 3083 C CG . HIS B 2 237 ? 8.332 8.249 5.209 1.00 97.78 237 B 1 ATOM 3084 N ND1 . HIS B 2 237 ? 8.290 7.615 3.974 1.00 87.73 237 B 1 ATOM 3085 C CD2 . HIS B 2 237 ? 9.464 7.822 5.848 1.00 90.03 237 B 1 ATOM 3086 C CE1 . HIS B 2 237 ? 9.358 6.819 3.890 1.00 90.76 237 B 1 ATOM 3087 N NE2 . HIS B 2 237 ? 10.097 6.928 4.997 1.00 93.21 237 B 1 ATOM 3088 N N . ASP B 2 238 ? 5.487 9.546 8.335 1.00 97.87 238 B 1 ATOM 3089 C CA . ASP B 2 238 ? 4.816 10.499 9.210 1.00 97.62 238 B 1 ATOM 3090 C C . ASP B 2 238 ? 4.923 11.928 8.661 1.00 97.63 238 B 1 ATOM 3091 O O . ASP B 2 238 ? 5.976 12.373 8.199 1.00 96.56 238 B 1 ATOM 3092 C CB . ASP B 2 238 ? 5.381 10.424 10.635 1.00 96.96 238 B 1 ATOM 3093 C CG . ASP B 2 238 ? 4.807 9.247 11.439 1.00 96.35 238 B 1 ATOM 3094 O OD1 . ASP B 2 238 ? 3.614 8.917 11.240 1.00 93.81 238 B 1 ATOM 3095 O OD2 . ASP B 2 238 ? 5.547 8.697 12.281 1.00 93.63 238 B 1 ATOM 3096 N N . ASN B 2 239 ? 3.810 12.643 8.721 1.00 97.22 239 B 1 ATOM 3097 C CA . ASN B 2 239 ? 3.646 14.036 8.288 1.00 97.11 239 B 1 ATOM 3098 C C . ASN B 2 239 ? 3.735 14.265 6.768 1.00 97.62 239 B 1 ATOM 3099 O O . ASN B 2 239 ? 3.633 15.407 6.320 1.00 96.57 239 B 1 ATOM 3100 C CB . ASN B 2 239 ? 4.592 14.954 9.085 1.00 95.75 239 B 1 ATOM 3101 C CG . ASN B 2 239 ? 4.629 14.639 10.578 1.00 93.99 239 B 1 ATOM 3102 O OD1 . ASN B 2 239 ? 3.652 14.237 11.196 1.00 85.88 239 B 1 ATOM 3103 N ND2 . ASN B 2 239 ? 5.771 14.805 11.205 1.00 84.63 239 B 1 ATOM 3104 N N . TRP B 2 240 ? 3.850 13.206 5.973 1.00 98.45 240 B 1 ATOM 3105 C CA . TRP B 2 240 ? 3.827 13.280 4.515 1.00 98.64 240 B 1 ATOM 3106 C C . TRP B 2 240 ? 2.413 13.076 3.972 1.00 98.67 240 B 1 ATOM 3107 O O . TRP B 2 240 ? 1.772 12.052 4.244 1.00 98.27 240 B 1 ATOM 3108 C CB . TRP B 2 240 ? 4.799 12.266 3.912 1.00 98.56 240 B 1 ATOM 3109 C CG . TRP B 2 240 ? 6.242 12.666 3.987 1.00 98.57 240 B 1 ATOM 3110 C CD1 . TRP B 2 240 ? 7.030 12.599 5.085 1.00 98.11 240 B 1 ATOM 3111 C CD2 . TRP B 2 240 ? 7.074 13.216 2.918 1.00 98.45 240 B 1 ATOM 3112 N NE1 . TRP B 2 240 ? 8.305 13.074 4.771 1.00 98.01 240 B 1 ATOM 3113 C CE2 . TRP B 2 240 ? 8.367 13.459 3.450 1.00 98.23 240 B 1 ATOM 3114 C CE3 . TRP B 2 240 ? 6.847 13.522 1.560 1.00 98.30 240 B 1 ATOM 3115 C CZ2 . TRP B 2 240 ? 9.408 14.000 2.662 1.00 97.91 240 B 1 ATOM 3116 C CZ3 . TRP B 2 240 ? 7.884 14.054 0.775 1.00 97.69 240 B 1 ATOM 3117 C CH2 . TRP B 2 240 ? 9.148 14.293 1.324 1.00 97.52 240 B 1 ATOM 3118 N N . VAL B 2 241 ? 1.964 14.002 3.132 1.00 98.76 241 B 1 ATOM 3119 C CA . VAL B 2 241 ? 0.855 13.759 2.210 1.00 98.77 241 B 1 ATOM 3120 C C . VAL B 2 241 ? 1.411 12.987 1.020 1.00 98.82 241 B 1 ATOM 3121 O O . VAL B 2 241 ? 2.335 13.452 0.361 1.00 98.65 241 B 1 ATOM 3122 C CB . VAL B 2 241 ? 0.192 15.067 1.753 1.00 98.58 241 B 1 ATOM 3123 C CG1 . VAL B 2 241 ? -0.981 14.794 0.808 1.00 97.84 241 B 1 ATOM 3124 C CG2 . VAL B 2 241 ? -0.349 15.859 2.950 1.00 97.86 241 B 1 ATOM 3125 N N . SER B 2 242 ? 0.872 11.817 0.741 1.00 98.77 242 B 1 ATOM 3126 C CA . SER B 2 242 ? 1.412 10.915 -0.277 1.00 98.73 242 B 1 ATOM 3127 C C . SER B 2 242 ? 0.332 10.522 -1.276 1.00 98.68 242 B 1 ATOM 3128 O O . SER B 2 242 ? -0.671 9.916 -0.908 1.00 98.17 242 B 1 ATOM 3129 C CB . SER B 2 242 ? 2.013 9.677 0.389 1.00 98.48 242 B 1 ATOM 3130 O OG . SER B 2 242 ? 3.059 10.026 1.274 1.00 96.49 242 B 1 ATOM 3131 N N . ILE B 2 243 ? 0.531 10.842 -2.549 1.00 98.69 243 B 1 ATOM 3132 C CA . ILE B 2 243 ? -0.419 10.575 -3.631 1.00 98.68 243 B 1 ATOM 3133 C C . ILE B 2 243 ? 0.123 9.458 -4.519 1.00 98.61 243 B 1 ATOM 3134 O O . ILE B 2 243 ? 1.231 9.550 -5.047 1.00 98.17 243 B 1 ATOM 3135 C CB . ILE B 2 243 ? -0.720 11.846 -4.448 1.00 98.59 243 B 1 ATOM 3136 C CG1 . ILE B 2 243 ? -1.183 13.017 -3.541 1.00 98.01 243 B 1 ATOM 3137 C CG2 . ILE B 2 243 ? -1.783 11.540 -5.522 1.00 98.00 243 B 1 ATOM 3138 C CD1 . ILE B 2 243 ? -1.232 14.366 -4.262 1.00 96.88 243 B 1 ATOM 3139 N N . GLY B 2 244 ? -0.674 8.426 -4.750 1.00 97.89 244 B 1 ATOM 3140 C CA . GLY B 2 244 ? -0.327 7.367 -5.694 1.00 97.57 244 B 1 ATOM 3141 C C . GLY B 2 244 ? -1.539 6.534 -6.086 1.00 97.18 244 B 1 ATOM 3142 O O . GLY B 2 244 ? -2.449 6.333 -5.289 1.00 95.81 244 B 1 ATOM 3143 N N . ASN B 2 245 ? -1.558 6.022 -7.314 1.00 96.74 245 B 1 ATOM 3144 C CA . ASN B 2 245 ? -2.678 5.203 -7.799 1.00 95.88 245 B 1 ATOM 3145 C C . ASN B 2 245 ? -2.662 3.757 -7.275 1.00 95.42 245 B 1 ATOM 3146 O O . ASN B 2 245 ? -3.589 2.999 -7.552 1.00 92.38 245 B 1 ATOM 3147 C CB . ASN B 2 245 ? -2.737 5.259 -9.342 1.00 94.53 245 B 1 ATOM 3148 C CG . ASN B 2 245 ? -1.618 4.498 -10.036 1.00 95.07 245 B 1 ATOM 3149 O OD1 . ASN B 2 245 ? -0.570 4.223 -9.469 1.00 88.97 245 B 1 ATOM 3150 N ND2 . ASN B 2 245 ? -1.803 4.123 -11.286 1.00 88.88 245 B 1 ATOM 3151 N N . GLU B 2 246 ? -1.621 3.365 -6.533 1.00 95.07 246 B 1 ATOM 3152 C CA . GLU B 2 246 ? -1.427 2.009 -5.983 1.00 94.44 246 B 1 ATOM 3153 C C . GLU B 2 246 ? -1.453 1.944 -4.445 1.00 95.39 246 B 1 ATOM 3154 O O . GLU B 2 246 ? -1.135 0.897 -3.879 1.00 93.32 246 B 1 ATOM 3155 C CB . GLU B 2 246 ? -0.116 1.399 -6.515 1.00 91.63 246 B 1 ATOM 3156 C CG . GLU B 2 246 ? -0.078 1.220 -8.032 1.00 87.51 246 B 1 ATOM 3157 C CD . GLU B 2 246 ? 1.126 0.381 -8.481 1.00 83.71 246 B 1 ATOM 3158 O OE1 . GLU B 2 246 ? 1.005 -0.290 -9.528 1.00 74.96 246 B 1 ATOM 3159 O OE2 . GLU B 2 246 ? 2.165 0.365 -7.771 1.00 75.69 246 B 1 ATOM 3160 N N . LEU B 2 247 ? -1.824 3.039 -3.779 1.00 96.09 247 B 1 ATOM 3161 C CA . LEU B 2 247 ? -1.903 3.104 -2.322 1.00 96.44 247 B 1 ATOM 3162 C C . LEU B 2 247 ? -3.037 2.245 -1.751 1.00 95.06 247 B 1 ATOM 3163 O O . LEU B 2 247 ? -4.062 2.018 -2.434 1.00 89.74 247 B 1 ATOM 3164 C CB . LEU B 2 247 ? -1.938 4.569 -1.844 1.00 96.06 247 B 1 ATOM 3165 C CG . LEU B 2 247 ? -0.604 5.327 -2.052 1.00 96.86 247 B 1 ATOM 3166 C CD1 . LEU B 2 247 ? -0.768 6.790 -1.643 1.00 95.12 247 B 1 ATOM 3167 C CD2 . LEU B 2 247 ? 0.540 4.732 -1.215 1.00 94.36 247 B 1 ATOM 3168 O OXT . LEU B 2 247 ? -2.850 1.761 -0.608 1.00 92.73 247 B 1 HETATM 3169 N N . SAH C 3 . ? 9.290 6.267 -5.392 1.00 95.34 1 C 1 HETATM 3170 C CA . SAH C 3 . ? 8.618 4.974 -5.263 1.00 96.16 1 C 1 HETATM 3171 C CB . SAH C 3 . ? 8.404 4.304 -6.620 1.00 95.13 1 C 1 HETATM 3172 C CG . SAH C 3 . ? 7.429 5.051 -7.511 1.00 94.51 1 C 1 HETATM 3173 S SD . SAH C 3 . ? 7.078 4.130 -8.995 1.00 94.80 1 C 1 HETATM 3174 C C . SAH C 3 . ? 9.381 4.071 -4.319 1.00 95.95 1 C 1 HETATM 3175 O O . SAH C 3 . ? 8.942 2.939 -4.079 1.00 92.59 1 C 1 HETATM 3176 O OXT . SAH C 3 . ? 10.404 4.498 -3.750 1.00 95.13 1 C 1 HETATM 3177 C "C5'" . SAH C 3 . ? 5.857 5.222 -9.742 1.00 95.42 1 C 1 HETATM 3178 C "C4'" . SAH C 3 . ? 4.487 5.066 -9.117 1.00 96.63 1 C 1 HETATM 3179 O "O4'" . SAH C 3 . ? 3.581 5.951 -9.789 1.00 96.89 1 C 1 HETATM 3180 C "C3'" . SAH C 3 . ? 3.882 3.668 -9.260 1.00 95.81 1 C 1 HETATM 3181 O "O3'" . SAH C 3 . ? 3.447 3.234 -7.975 1.00 94.83 1 C 1 HETATM 3182 C "C2'" . SAH C 3 . ? 2.686 3.853 -10.180 1.00 95.71 1 C 1 HETATM 3183 O "O2'" . SAH C 3 . ? 1.619 2.977 -9.877 1.00 94.59 1 C 1 HETATM 3184 C "C1'" . SAH C 3 . ? 2.326 5.286 -9.886 1.00 96.86 1 C 1 HETATM 3185 N N9 . SAH C 3 . ? 1.504 5.900 -10.924 1.00 97.08 1 C 1 HETATM 3186 C C8 . SAH C 3 . ? 1.522 5.638 -12.244 1.00 96.67 1 C 1 HETATM 3187 N N7 . SAH C 3 . ? 0.628 6.383 -12.894 1.00 96.66 1 C 1 HETATM 3188 C C5 . SAH C 3 . ? 0.001 7.137 -11.954 1.00 97.33 1 C 1 HETATM 3189 C C6 . SAH C 3 . ? -1.043 8.101 -11.981 1.00 97.36 1 C 1 HETATM 3190 N N6 . SAH C 3 . ? -1.635 8.443 -13.133 1.00 96.72 1 C 1 HETATM 3191 N N1 . SAH C 3 . ? -1.443 8.675 -10.827 1.00 97.13 1 C 1 HETATM 3192 C C2 . SAH C 3 . ? -0.855 8.325 -9.653 1.00 97.13 1 C 1 HETATM 3193 N N3 . SAH C 3 . ? 0.128 7.417 -9.556 1.00 97.24 1 C 1 HETATM 3194 C C4 . SAH C 3 . ? 0.559 6.832 -10.688 1.00 97.27 1 C 1 #