data_2khx_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2khx _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 34.6 tptt . . . . . 0 CA--C 1.526 0.048 0 CA-C-O 121.01 0.433 . . . . 1.0 110.423 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A 1263 ' ' SER . . . . . . . . . . . . . 68.3 m -57.5 -41.39 80.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.706 -0.679 . . . . 1.0 111.112 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 25.0 mp0 -58.97 -43.99 91.46 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.703 -0.399 . . . . 1.0 110.209 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1265 ' ' LEU . . . . . 0.482 ' CD2' ' OH ' ' A' 1332 ' ' TYR . 36.9 mt -63.61 -41.95 98.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 1.0 110.505 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -63.46 -44.73 93.63 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.346 -0.388 . . . . 1.0 110.718 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -64.02 -39.76 94.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.127 -0.488 . . . . 1.0 110.689 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1268 ' ' CYS . . . . . 0.437 ' O ' ' OG1' ' A' 1271 ' ' THR . 98.3 m -64.92 -35.74 82.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.02 -0.536 . . . . 1.0 110.859 -179.522 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 79.1 m -60.44 -37.51 81.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.443 -0.344 . . . . 1.0 110.771 -179.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 89.1 mt -63.86 -39.31 93.9 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.214 -0.448 . . . . 1.0 111.106 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1271 ' ' THR . . . . . 0.437 ' OG1' ' O ' ' A' 1268 ' ' CYS . 68.7 p -65.06 -30.06 71.0 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.504 -0.316 . . . . 1.0 111.478 -179.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 77.6 mt -77.67 84.48 4.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.496 -0.32 . . . . 1.0 111.492 -178.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -119.74 130.09 54.81 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 110.139 -0.319 . . . . 1.0 110.139 178.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1274 ' ' THR . . . . . . . . . . . . . 21.4 m -129.65 133.4 47.09 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 120.773 0.32 . . . . 1.0 110.434 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 39.9 tp10 -111.54 142.72 43.47 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.356 -0.384 . . . . 1.0 110.202 179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 88.2 7.11 73.82 Favored Glycine 0 CA--C 1.527 0.815 0 N-CA-C 111.201 -0.76 . . . . 1.0 111.201 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 49.4 mtpt -138.63 -164.71 1.69 Allowed 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 110.239 -0.282 . . . . 1.0 110.239 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -92.43 151.05 41.01 Favored Pre-proline 0 CA--C 1.531 0.238 0 N-CA-C 109.87 -0.418 . . . . 1.0 109.87 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.09 76.13 1.29 Allowed 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.278 1.986 . . . . 1.0 112.22 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -90.83 121.5 32.75 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.815 -0.439 . . . . 1.0 109.815 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 13.1 mt -148.67 133.51 9.12 Favored Pre-proline 0 CA--C 1.535 0.398 0 N-CA-C 109.953 -0.388 . . . . 1.0 109.953 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.09 111.82 3.27 Favored 'Trans proline' 0 N--CA 1.495 1.597 0 C-N-CA 121.323 1.349 . . . . 1.0 111.514 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 89.5 mt -121.59 154.47 36.69 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.033 0.444 . . . . 1.0 110.867 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1284 ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -79.0 140.45 37.97 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.876 -0.602 . . . . 1.0 110.892 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 79.7 tttt -145.97 115.13 7.04 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.515 -0.766 . . . . 1.0 109.575 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1286 ' ' THR . . . . . . . . . . . . . 27.2 m -63.83 131.88 49.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.843 0.354 . . . . 1.0 110.686 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 72.8 mt -87.74 -172.2 3.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.046 -0.525 . . . . 1.0 110.302 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -107.67 137.61 45.39 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.285 -0.416 . . . . 1.0 110.052 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1289 ' ' THR . . . . . . . . . . . . . 19.0 p -75.49 115.95 15.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.095 -0.502 . . . . 1.0 111.286 -178.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 16.6 m -136.11 122.15 30.31 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-N 116.051 -0.522 . . . . 1.0 109.836 178.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.86 159.25 27.33 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 110.947 -0.861 . . . . 1.0 110.947 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -63.67 -38.91 37.71 Favored 'Trans proline' 0 C--N 1.308 -1.593 0 C-N-CA 122.371 2.047 . . . . 1.0 111.132 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1293 ' ' SER . . . . . . . . . . . . . 14.3 t -91.86 165.13 13.4 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.728 -0.669 . . . . 1.0 110.55 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -61.38 -9.5 5.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.172 0.511 . . . . 1.0 109.75 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -62.91 144.98 56.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.481 -0.782 . . . . 1.0 111.11 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -103.01 130.35 50.08 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.097 -0.501 . . . . 1.0 110.685 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1297 ' ' THR . . . . . . . . . . . . . 92.3 m -125.92 127.65 46.33 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.923 -0.58 . . . . 1.0 110.093 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -101.44 127.2 48.21 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.001 0.429 . . . . 1.0 110.819 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1299 ' ' THR . . . . . . . . . . . . . 64.0 m -127.56 130.56 49.3 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.86 -0.609 . . . . 1.0 110.313 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 54.3 t -116.77 128.0 74.26 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 N-CA-C 109.139 -0.689 . . . . 1.0 109.139 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -130.49 142.35 50.49 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.13 0.49 . . . . 1.0 111.657 -179.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 2.7 t -112.28 127.43 69.49 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 N-CA-C 108.801 -0.814 . . . . 1.0 108.801 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -115.98 139.54 50.15 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.146 0.498 . . . . 1.0 111.449 -178.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 52.7 t80 -128.38 102.31 6.59 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.6 -0.727 . . . . 1.0 110.212 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 64.4 mttp 47.01 36.58 4.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.108 -0.497 . . . . 1.0 111.05 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 90.99 4.34 69.22 Favored Glycine 0 CA--C 1.527 0.815 0 N-CA-C 111.946 -0.462 . . . . 1.0 111.946 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -110.05 119.77 40.36 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 120.992 0.425 . . . . 1.0 110.356 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 62.0 ttp180 -76.08 136.43 39.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.931 -0.577 . . . . 1.0 110.634 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 42.1 pt -138.56 20.17 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-N 116.36 -0.382 . . . . 1.0 110.169 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -151.03 148.35 19.37 Favored Glycine 0 CA--C 1.523 0.587 0 N-CA-C 111.062 -0.815 . . . . 1.0 111.062 -179.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 25.0 p -171.35 116.37 0.42 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.804 0.335 . . . . 1.0 110.185 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -175.57 131.05 1.83 Allowed Glycine 0 CA--C 1.523 0.583 0 N-CA-C 111.018 -0.833 . . . . 1.0 111.018 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 68.8 mttm -109.95 146.0 35.97 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.778 0.323 . . . . 1.0 110.373 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -167.16 173.2 42.36 Favored Glycine 0 CA--C 1.524 0.634 0 N-CA-C 111.139 -0.785 . . . . 1.0 111.139 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -69.41 -75.08 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.677 0 C-N-CA 122.592 2.195 . . . . 1.0 111.918 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1316 ' ' SER . . . . . . . . . . . . . 95.5 p -79.0 158.2 27.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.926 0.393 . . . . 1.0 110.943 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 47.5 mm -63.88 -44.66 98.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.0 -0.545 . . . . 1.0 111.209 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -54.48 -46.34 73.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.536 -0.302 . . . . 1.0 111.125 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -62.89 -38.77 92.24 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.842 -0.343 . . . . 1.0 110.865 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -64.63 -38.49 91.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.425 -0.352 . . . . 1.0 111.08 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -66.41 -36.46 82.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.299 -0.41 . . . . 1.0 111.404 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1322 ' ' MET . . . . . . . . . . . . . 95.1 mmm -62.74 -42.65 99.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.323 -0.399 . . . . 1.0 111.469 -179.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -66.7 -49.68 53.69 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 120.711 -0.757 . . . . 1.0 111.528 -179.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -70.27 -36.22 74.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.792 0.329 . . . . 1.0 111.534 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -56.01 -50.27 71.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.23 -0.441 . . . . 1.0 111.729 -178.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1326 ' ' MET . . . . . . . . . . . . . 66.4 mtt -65.57 -38.56 89.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.744 0.307 . . . . 1.0 111.484 -179.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -63.52 -36.98 85.58 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.348 -0.387 . . . . 1.0 111.549 -179.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1328 ' ' ALA . . . . . 0.524 ' O ' ' CD2' ' A' 1332 ' ' TYR . . . -58.69 -25.76 63.19 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.188 0.44 . . . . 1.0 112.188 -178.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 1.9 mm? -62.05 -41.45 98.14 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.679 -0.408 . . . . 1.0 111.148 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -93.62 4.57 53.75 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.142 0.423 . . . . 1.0 112.142 -178.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 67.5 mttm -117.7 20.65 13.35 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.269 0.47 . . . . 1.0 112.269 -178.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1332 ' ' TYR . . . . . 0.524 ' CD2' ' O ' ' A' 1328 ' ' ALA . 11.4 m-85 -83.54 137.76 33.71 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.122 0.487 . . . . 1.0 110.502 179.249 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -117.33 -175.98 2.91 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.521 -0.763 . . . . 1.0 110.17 179.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 53.8 m-85 -34.99 151.05 0.07 OUTLIER Pre-proline 0 CA--C 1.538 0.484 0 CA-C-N 115.977 -0.556 . . . . 1.0 111.115 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -69.61 -178.9 2.5 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 C-N-CA 122.419 2.079 . . . . 1.0 112.133 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 1336 ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 . . . . . 0 N--CA 1.462 0.175 0 CA-C-O 121.168 0.509 . . . . 1.0 111.205 -179.911 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 55.0 mtpt . . . . . 0 CA--C 1.53 0.18 0 CA-C-O 120.565 0.221 . . . . 1.0 111.156 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A 1263 ' ' SER . . . . . . . . . . . . . 50.4 m -61.0 -42.66 98.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.891 0.376 . . . . 1.0 110.701 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1264 ' ' GLN . . . . . 0.431 ' O ' ' SG ' ' A' 1268 ' ' CYS . 28.0 mm100 -65.08 -46.88 79.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.102 -0.499 . . . . 1.0 111.497 -179.451 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1265 ' ' LEU . . . . . 0.475 ' O ' ' SG ' ' A' 1269 ' ' CYS . 92.7 mt -64.66 -42.03 95.69 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.35 -0.386 . . . . 1.0 111.59 -179.256 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -64.9 -43.54 92.52 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.47 -0.492 . . . . 1.0 110.575 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 17.5 mm100 -68.19 -38.61 82.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.087 -0.506 . . . . 1.0 110.944 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1268 ' ' CYS . . . . . 0.44 ' O ' ' OG1' ' A' 1271 ' ' THR . 93.5 m -64.9 -36.48 84.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.45 -0.341 . . . . 1.0 111.047 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1269 ' ' CYS . . . . . 0.475 ' SG ' ' O ' ' A' 1265 ' ' LEU . 84.0 m -56.5 -36.69 69.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.753 0.311 . . . . 1.0 110.839 -179.393 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 97.2 mt -63.25 -40.87 98.64 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.329 -0.396 . . . . 1.0 111.042 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1271 ' ' THR . . . . . 0.44 ' OG1' ' O ' ' A' 1268 ' ' CYS . 68.3 p -67.76 -26.31 66.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.195 -0.457 . . . . 1.0 111.369 -179.345 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 82.2 mt -85.68 86.65 7.35 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.823 0.344 . . . . 1.0 111.382 -178.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -119.19 117.98 30.09 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.071 -0.513 . . . . 1.0 110.112 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1274 ' ' THR . . . . . 0.427 ' OG1' ' OE1' ' A' 1336 ' ' GLN . 6.8 m -129.04 131.24 47.32 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 120.844 0.355 . . . . 1.0 110.268 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -113.03 134.97 54.28 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.207 -0.451 . . . . 1.0 110.304 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 89.67 7.11 69.32 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 111.38 -0.688 . . . . 1.0 111.38 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 50.6 mtpt -138.41 -168.75 2.44 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.79 0.329 . . . . 1.0 110.613 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -93.38 136.02 24.77 Favored Pre-proline 0 CA--C 1.536 0.409 0 CA-C-N 116.11 -0.495 . . . . 1.0 110.104 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -76.49 87.74 1.42 Allowed 'Trans proline' 0 N--CA 1.493 1.461 0 C-N-CA 121.869 1.713 . . . . 1.0 112.353 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1280 ' ' ASP . . . . . 0.5 ' OD2' ' NZ ' ' A' 1305 ' ' LYS . 78.3 m-20 -86.49 124.39 32.76 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.726 -0.472 . . . . 1.0 109.726 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 2.5 mt -148.02 124.08 5.34 Favored Pre-proline 0 CA--C 1.54 0.579 0 N-CA-C 109.972 -0.381 . . . . 1.0 109.972 -179.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 45.0 Cg_exo -51.79 131.44 37.97 Favored 'Trans proline' 0 N--CA 1.494 1.501 0 CA-C-N 120.246 1.123 . . . . 1.0 111.828 179.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 55.6 mt -134.74 152.49 51.8 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.028 -0.533 . . . . 1.0 109.871 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1284 ' ' TYR . . . . . 0.465 ' CD1' ' OE1' ' A' 1321 ' ' GLU . 84.6 m-85 -78.46 137.8 38.14 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.043 0.449 . . . . 1.0 111.152 -179.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 85.7 tttt -139.01 104.81 5.13 Favored 'General case' 0 N--CA 1.462 0.175 0 N-CA-C 108.918 -0.771 . . . . 1.0 108.918 178.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1286 ' ' THR . . . . . . . . . . . . . 24.0 m -63.17 134.93 56.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.406 0.622 . . . . 1.0 112.174 -178.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 70.3 mt -87.0 -169.22 2.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.179 -0.919 . . . . 1.0 109.998 179.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -106.44 136.88 45.43 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 109.593 -0.521 . . . . 1.0 109.593 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1289 ' ' THR . . . . . . . . . . . . . 3.5 p -88.87 115.09 26.16 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.156 -0.475 . . . . 1.0 111.452 -178.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 7.1 m -133.55 123.56 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 121.034 0.445 . . . . 1.0 110.153 178.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.29 166.42 26.41 Favored Glycine 0 CA--C 1.524 0.644 0 N-CA-C 110.674 -0.97 . . . . 1.0 110.674 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -67.9 -42.89 5.73 Favored 'Trans proline' 0 C--N 1.306 -1.667 0 C-N-CA 122.467 2.112 . . . . 1.0 111.125 179.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1293 ' ' SER . . . . . 0.613 ' HG ' ' N ' ' A' 1294 ' ' HIS . 31.4 t -90.3 165.51 13.85 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.621 -0.718 . . . . 1.0 110.484 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1294 ' ' HIS . . . . . 0.613 ' N ' ' HG ' ' A' 1293 ' ' SER . 95.9 m-70 -58.11 -14.49 6.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.281 -0.418 . . . . 1.0 110.207 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -65.92 142.0 58.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.922 -0.581 . . . . 1.0 110.72 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -110.53 145.19 38.19 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.211 -0.45 . . . . 1.0 110.837 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1297 ' ' THR . . . . . . . . . . . . . 94.9 m -116.25 124.31 49.88 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.264 -0.643 . . . . 1.0 109.264 178.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -96.37 119.83 35.58 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.057 0.456 . . . . 1.0 110.786 -179.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1299 ' ' THR . . . . . 0.415 ' CG2' ' HZ2' ' A' 1313 ' ' LYS . 88.8 m -127.35 127.97 45.11 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.777 -0.647 . . . . 1.0 110.321 179.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 25.3 t -118.26 128.43 75.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 N-CA-C 109.58 -0.526 . . . . 1.0 109.58 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -130.69 148.7 52.51 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.3 -0.409 . . . . 1.0 110.228 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 3.0 t -105.91 125.95 61.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 N-CA-C 109.54 -0.541 . . . . 1.0 109.54 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -107.3 129.0 54.94 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.904 0.383 . . . . 1.0 110.878 -179.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 88.7 t80 -139.08 119.73 14.1 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 115.886 -0.597 . . . . 1.0 109.698 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1305 ' ' LYS . . . . . 0.5 ' NZ ' ' OD2' ' A' 1280 ' ' ASP . 72.7 mmtt 49.25 32.51 4.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.388 -0.369 . . . . 1.0 110.115 -179.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 78.35 21.48 69.89 Favored Glycine 0 CA--C 1.526 0.74 0 C-N-CA 121.076 -0.583 . . . . 1.0 111.816 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -121.08 130.86 53.94 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 116.987 0.393 . . . . 1.0 110.865 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 44.5 ttm180 -87.44 90.92 8.55 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.241 -0.651 . . . . 1.0 109.241 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 34.7 pt -81.35 -17.29 12.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 112.715 0.635 . . . . 1.0 112.715 -178.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -147.51 156.8 27.14 Favored Glycine 0 CA--C 1.525 0.669 0 C-N-CA 120.389 -0.91 . . . . 1.0 112.089 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 2.6 p -177.0 144.5 0.44 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.395 -0.403 . . . . 1.0 109.99 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -165.57 158.86 31.9 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 111.093 -0.803 . . . . 1.0 111.093 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1313 ' ' LYS . . . . . 0.415 ' HZ2' ' CG2' ' A' 1299 ' ' THR . 68.2 mttm -129.02 141.2 51.32 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.678 0.275 . . . . 1.0 110.269 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -164.33 -179.76 38.68 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.812 -0.915 . . . . 1.0 110.812 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -58.93 -59.82 0.42 Allowed 'Trans proline' 0 N--CA 1.494 1.521 0 C-N-CA 122.132 1.888 . . . . 1.0 112.017 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1316 ' ' SER . . . . . 0.443 ' OG ' ' OE1' ' A' 1319 ' ' GLN . 6.5 p -103.33 168.97 8.82 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.114 -0.494 . . . . 1.0 110.658 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 43.4 mt -67.05 -41.54 87.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.874 -0.603 . . . . 1.0 110.955 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -51.57 -41.41 61.12 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.463 -0.335 . . . . 1.0 111.215 -178.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1319 ' ' GLN . . . . . 0.443 ' OE1' ' OG ' ' A' 1316 ' ' SER . 7.3 mp0 -64.54 -39.77 94.36 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.753 -0.379 . . . . 1.0 110.052 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -65.88 -37.4 86.04 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.169 -0.469 . . . . 1.0 110.99 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1321 ' ' GLU . . . . . 0.465 ' OE1' ' CD1' ' A' 1284 ' ' TYR . 80.5 mm-40 -61.08 -50.22 74.16 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.452 -0.34 . . . . 1.0 110.862 -179.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1322 ' ' MET . . . . . . . . . . . . . 63.7 mtm -66.51 -38.95 88.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.137 -0.483 . . . . 1.0 111.553 -179.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -62.42 -48.28 83.29 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.891 -0.884 . . . . 1.0 110.891 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -66.12 -35.33 80.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.926 0.393 . . . . 1.0 110.601 179.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -57.69 -48.64 78.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.903 -0.589 . . . . 1.0 112.031 -179.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1326 ' ' MET . . . . . . . . . . . . . 93.8 mmm -63.67 -40.57 97.17 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.809 -0.356 . . . . 1.0 111.598 -179.014 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -67.7 -28.79 67.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.731 0.3 . . . . 1.0 111.173 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1328 ' ' ALA . . . . . . . . . . . . . . . -62.04 -35.45 78.63 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.414 0.524 . . . . 1.0 112.414 -178.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.93 -40.47 93.35 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 120.923 -0.311 . . . . 1.0 111.329 -178.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -75.09 15.07 0.45 Allowed 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.258 0.466 . . . . 1.0 112.258 -178.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 97.0 mttt -146.24 45.39 1.24 Allowed 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 113.061 0.763 . . . . 1.0 113.061 -178.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1332 ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -101.96 153.32 19.99 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.145 0.497 . . . . 1.0 110.342 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 9.1 m120 -127.74 -177.47 4.12 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.508 -0.769 . . . . 1.0 110.629 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 1334 ' ' PHE . . . . . 0.477 ' O ' ' O ' ' A' 1335 ' ' PRO . 61.7 m-85 -42.48 153.98 0.29 Allowed Pre-proline 0 CA--C 1.534 0.355 0 CA-C-N 115.815 -0.63 . . . . 1.0 110.662 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1335 ' ' PRO . . . . . 0.477 ' O ' ' O ' ' A' 1334 ' ' PHE . 77.3 Cg_exo -39.73 174.77 0.0 OUTLIER 'Trans proline' 0 N--CA 1.496 1.66 0 C-N-CA 122.826 2.351 . . . . 1.0 113.56 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 1336 ' ' GLN . . . . . 0.427 ' OE1' ' OG1' ' A' 1274 ' ' THR . 11.2 mt-30 . . . . . 0 N--CA 1.462 0.174 0 CA-C-N 115.382 -0.826 . . . . 1.0 110.99 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 87.7 mttt . . . . . 0 N--CA 1.463 0.185 0 CA-C-O 120.975 0.417 . . . . 1.0 110.508 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A 1263 ' ' SER . . . . . . . . . . . . . 35.9 m -59.16 -31.23 68.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.697 -0.683 . . . . 1.0 111.681 -179.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -56.75 -53.01 62.67 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.705 -0.398 . . . . 1.0 111.49 -178.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1265 ' ' LEU . . . . . 0.489 ' O ' ' SG ' ' A' 1269 ' ' CYS . 15.9 mt -67.87 -39.29 83.75 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.671 -0.411 . . . . 1.0 111.037 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -57.72 -43.9 85.61 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.543 -0.299 . . . . 1.0 111.175 -179.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -64.06 -42.48 97.0 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.502 -0.479 . . . . 1.0 110.522 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1268 ' ' CYS . . . . . . . . . . . . . 91.5 m -70.7 -36.59 73.33 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.176 -0.466 . . . . 1.0 110.936 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1269 ' ' CYS . . . . . 0.489 ' SG ' ' O ' ' A' 1265 ' ' LEU . 87.9 m -62.43 -35.23 78.62 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.092 -0.503 . . . . 1.0 112.018 -178.724 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 81.5 mt -61.96 -39.43 92.11 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.889 -0.324 . . . . 1.0 110.738 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1271 ' ' THR . . . . . . . . . . . . . 58.0 p -65.36 -29.19 69.89 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.969 -0.292 . . . . 1.0 111.15 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 87.2 mt -74.66 86.88 2.15 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.798 -0.361 . . . . 1.0 110.59 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 100.0 mtt180 -118.41 116.04 25.89 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.269 -0.423 . . . . 1.0 110.131 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1274 ' ' THR . . . . . . . . . . . . . 3.0 m -124.28 124.64 42.85 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.875 0.369 . . . . 1.0 110.162 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -112.71 138.18 49.91 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.024 -0.535 . . . . 1.0 110.194 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 90.38 0.62 76.23 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.677 -0.969 . . . . 1.0 110.677 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 21.5 mtpp -135.31 -167.5 2.02 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.11 0.481 . . . . 1.0 110.589 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -94.28 130.17 34.83 Favored Pre-proline 0 CA--C 1.536 0.423 0 CA-C-N 115.713 -0.676 . . . . 1.0 109.606 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -78.15 110.24 2.84 Favored 'Trans proline' 0 N--CA 1.493 1.466 0 C-N-CA 121.798 1.666 . . . . 1.0 112.683 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -104.24 129.73 52.04 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.887 -0.597 . . . . 1.0 109.584 178.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 4.8 mt -147.31 121.95 5.14 Favored Pre-proline 0 CA--C 1.54 0.571 0 CA-C-O 119.303 -0.38 . . . . 1.0 110.308 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -56.27 141.89 88.13 Favored 'Trans proline' 0 N--CA 1.494 1.532 0 CA-C-N 120.337 1.156 . . . . 1.0 111.129 178.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 89.9 mt -139.12 160.67 39.24 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.724 0.297 . . . . 1.0 110.393 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1284 ' ' TYR . . . . . 0.531 ' CD1' ' OE1' ' A' 1321 ' ' GLU . 62.8 m-85 -78.52 139.73 38.62 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.123 0.487 . . . . 1.0 111.46 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -151.34 107.56 3.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.588 -0.733 . . . . 1.0 109.998 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1286 ' ' THR . . . . . . . . . . . . . 18.5 m -74.78 140.59 44.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.11 0.481 . . . . 1.0 111.063 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 73.3 mt -81.73 -169.93 2.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.637 -0.711 . . . . 1.0 110.672 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -107.08 136.4 47.0 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.9 -0.591 . . . . 1.0 109.561 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1289 ' ' THR . . . . . . . . . . . . . 57.3 p -83.27 115.05 21.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.982 0.42 . . . . 1.0 111.701 -178.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 9.4 m -143.9 122.19 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 115.682 -0.69 . . . . 1.0 109.449 178.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.46 172.37 24.33 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 111.113 -0.795 . . . . 1.0 111.113 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -72.14 -46.49 0.52 Allowed 'Trans proline' 0 C--N 1.307 -1.646 0 C-N-CA 122.494 2.129 . . . . 1.0 111.143 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1293 ' ' SER . . . . . . . . . . . . . 11.3 t -89.85 165.34 14.18 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.656 -0.702 . . . . 1.0 110.046 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 28.2 m170 -59.73 -18.96 46.9 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.621 -0.511 . . . . 1.0 109.621 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -59.76 144.15 49.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.812 -0.631 . . . . 1.0 109.963 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 85.2 mtm-85 -117.54 143.51 46.01 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.014 0.435 . . . . 1.0 111.038 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1297 ' ' THR . . . . . . . . . . . . . 91.8 m -120.17 127.28 52.33 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.734 -0.666 . . . . 1.0 109.808 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -99.82 116.41 31.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.026 0.441 . . . . 1.0 110.721 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1299 ' ' THR . . . . . 0.642 ' HG1' ' NZ ' ' A' 1313 ' ' LYS . 91.8 m -127.11 130.31 49.6 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.743 -0.662 . . . . 1.0 110.092 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 83.2 t -111.44 129.86 66.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 N-CA-C 109.734 -0.469 . . . . 1.0 109.734 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -129.25 140.91 51.28 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.077 0.465 . . . . 1.0 110.93 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 43.7 t -113.25 128.36 70.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 N-CA-C 108.65 -0.87 . . . . 1.0 108.65 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -113.66 141.37 47.31 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.029 0.443 . . . . 1.0 110.934 -178.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 79.1 t80 -149.43 109.08 4.02 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.593 -0.731 . . . . 1.0 110.159 -179.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 49.87 30.07 3.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.281 -0.418 . . . . 1.0 110.808 179.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 86.04 1.97 86.33 Favored Glycine 0 CA--C 1.525 0.69 0 C-N-CA 121.317 -0.468 . . . . 1.0 112.06 178.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -106.5 115.95 31.09 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 110.132 -0.322 . . . . 1.0 110.132 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -72.52 130.16 40.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.466 . . . . 1.0 110.302 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 30.5 pt -122.46 23.23 4.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-N 116.484 -0.325 . . . . 1.0 110.906 -179.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -155.96 153.28 24.62 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 111.354 -0.699 . . . . 1.0 111.354 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1311 ' ' CYS . . . . . 0.412 ' SG ' ' OD2' ' A' 1327 ' ' ASP . 31.3 p -167.65 164.23 14.51 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.21 -0.293 . . . . 1.0 110.21 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . 121.92 157.64 10.07 Favored Glycine 0 N--CA 1.468 0.801 0 N-CA-C 110.939 -0.864 . . . . 1.0 110.939 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1313 ' ' LYS . . . . . 0.642 ' NZ ' ' HG1' ' A' 1299 ' ' THR . 68.6 mttm -129.61 151.3 50.37 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.93 0.395 . . . . 1.0 110.758 -179.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -159.49 163.72 33.64 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 110.434 -1.067 . . . . 1.0 110.434 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -64.58 -67.13 0.04 OUTLIER 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 122.408 2.072 . . . . 1.0 111.697 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1316 ' ' SER . . . . . . . . . . . . . 13.6 p -83.89 164.27 19.53 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.361 -0.381 . . . . 1.0 110.328 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 36.7 mm -65.29 -44.31 94.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.12 -0.491 . . . . 1.0 110.836 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -55.36 -42.99 74.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.085 -0.507 . . . . 1.0 111.712 -178.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -60.01 -41.75 92.83 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.593 -0.443 . . . . 1.0 110.708 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -68.55 -37.76 80.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.307 -0.406 . . . . 1.0 110.998 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1321 ' ' GLU . . . . . 0.531 ' OE1' ' CD1' ' A' 1284 ' ' TYR . 64.8 mm-40 -61.58 -45.35 94.51 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.305 -0.407 . . . . 1.0 111.821 -179.11 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1322 ' ' MET . . . . . 0.579 ' N ' ' SD ' ' A' 1322 ' ' MET . 0.1 OUTLIER -64.2 -41.08 97.23 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.805 -0.358 . . . . 1.0 111.366 -179.259 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -64.97 -43.39 95.98 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 120.799 -0.715 . . . . 1.0 111.847 -179.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -66.35 -38.21 87.08 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.737 0.273 . . . . 1.0 111.737 -179.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -61.03 -42.69 98.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.477 -0.328 . . . . 1.0 111.862 -178.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1326 ' ' MET . . . . . . . . . . . . . 2.0 tpt -62.74 -41.83 99.37 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.471 -0.492 . . . . 1.0 110.064 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1327 ' ' ASP . . . . . 0.412 ' OD2' ' SG ' ' A' 1311 ' ' CYS . 64.7 m-20 -65.04 -34.7 79.05 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.965 -0.561 . . . . 1.0 110.544 -179.383 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1328 ' ' ALA . . . . . 0.499 ' O ' ' CD2' ' A' 1332 ' ' TYR . . . -58.83 -23.75 61.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.307 -0.406 . . . . 1.0 111.45 -179.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 92.6 mt -62.48 -42.48 99.52 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.727 -0.389 . . . . 1.0 110.838 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -95.11 23.98 5.27 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.357 -0.383 . . . . 1.0 111.955 -178.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 97.3 mttt -137.82 42.55 2.29 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 120.697 -0.401 . . . . 1.0 111.072 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1332 ' ' TYR . . . . . 0.499 ' CD2' ' O ' ' A' 1328 ' ' ALA . 14.0 m-85 -115.15 145.98 41.83 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.285 0.564 . . . . 1.0 110.977 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -117.76 -176.71 3.09 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.368 -0.833 . . . . 1.0 108.819 178.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -41.8 148.7 0.44 Allowed Pre-proline 0 CA--C 1.536 0.405 0 C-N-CA 120.711 -0.396 . . . . 1.0 110.475 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -68.46 154.63 71.4 Favored 'Trans proline' 0 N--CA 1.497 1.72 0 C-N-CA 122.292 1.995 . . . . 1.0 111.763 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 1336 ' ' GLN . . . . . . . . . . . . . 15.3 mm100 . . . . . 0 N--CA 1.462 0.133 0 CA-C-O 120.772 0.32 . . . . 1.0 110.26 -179.615 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 56.8 mttp . . . . . 0 N--CA 1.467 0.397 0 N-CA-C 111.731 0.271 . . . . 1.0 111.731 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A 1263 ' ' SER . . . . . . . . . . . . . 64.8 m -52.09 -39.86 60.39 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.532 -0.467 . . . . 1.0 110.807 -179.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -63.26 -47.89 80.49 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.878 0.37 . . . . 1.0 110.495 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1265 ' ' LEU . . . . . . . . . . . . . 88.2 mt -65.71 -39.76 91.54 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.114 -0.494 . . . . 1.0 111.413 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -54.1 -40.27 67.14 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 121.043 -0.263 . . . . 1.0 111.007 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -62.95 -42.41 99.81 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.728 -0.389 . . . . 1.0 110.425 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1268 ' ' CYS . . . . . 0.43 ' O ' ' OG1' ' A' 1271 ' ' THR . 90.4 m -66.28 -37.2 84.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.296 -0.411 . . . . 1.0 110.747 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 99.8 m -59.18 -35.38 73.48 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.261 -0.427 . . . . 1.0 110.964 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 86.2 mt -62.61 -40.89 98.38 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.335 -0.393 . . . . 1.0 110.991 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1271 ' ' THR . . . . . 0.43 ' OG1' ' O ' ' A' 1268 ' ' CYS . 74.3 p -65.68 -31.68 72.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.339 -0.391 . . . . 1.0 111.562 -179.131 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 72.1 mt -74.28 83.69 1.89 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.599 -0.44 . . . . 1.0 110.578 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 7.3 mmp_? -119.51 110.76 17.27 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.244 -0.435 . . . . 1.0 110.842 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1274 ' ' THR . . . . . . . . . . . . . 21.6 m -129.29 129.89 45.46 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 109.94 -0.393 . . . . 1.0 109.94 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -112.42 136.52 51.81 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.937 0.399 . . . . 1.0 110.705 -179.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 88.37 8.27 71.41 Favored Glycine 0 CA--C 1.526 0.747 0 CA-C-N 116.06 -0.518 . . . . 1.0 111.894 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 50.4 mtpt -138.91 -172.27 3.28 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.212 0.529 . . . . 1.0 111.113 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -94.5 108.95 40.29 Favored Pre-proline 0 CA--C 1.537 0.47 0 CA-C-N 115.275 -0.875 . . . . 1.0 109.41 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -80.97 92.95 1.03 Allowed 'Trans proline' 0 N--CA 1.491 1.33 0 C-N-CA 121.769 1.646 . . . . 1.0 112.476 -179.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -80.94 141.43 34.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.163 -0.471 . . . . 1.0 109.742 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 10.5 mt -141.51 133.0 13.48 Favored Pre-proline 0 CA--C 1.536 0.417 0 N-CA-C 110.066 -0.346 . . . . 1.0 110.066 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -76.12 120.0 5.54 Favored 'Trans proline' 0 N--CA 1.491 1.342 0 C-N-CA 121.538 1.492 . . . . 1.0 111.466 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 11.0 mp -106.11 153.22 22.39 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.147 -0.479 . . . . 1.0 109.759 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1284 ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -77.14 141.26 40.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.289 0.566 . . . . 1.0 111.042 -179.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 64.3 tttm -136.57 124.89 23.27 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.313 -0.858 . . . . 1.0 109.471 179.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1286 ' ' THR . . . . . . . . . . . . . 59.3 m -85.65 129.87 34.71 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.918 0.389 . . . . 1.0 111.087 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 77.2 mt -82.95 -170.49 3.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.919 -0.582 . . . . 1.0 110.128 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -107.99 152.73 24.08 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.097 -0.502 . . . . 1.0 109.909 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1289 ' ' THR . . . . . . . . . . . . . 73.3 p -86.53 113.21 22.25 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.896 0.379 . . . . 1.0 111.427 -179.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 3.4 m -149.43 122.57 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.916 -0.584 . . . . 1.0 109.915 178.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -141.85 166.85 26.14 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.123 -0.791 . . . . 1.0 111.123 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -63.27 -47.22 8.29 Favored 'Trans proline' 0 C--N 1.307 -1.609 0 C-N-CA 122.761 2.308 . . . . 1.0 111.077 179.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1293 ' ' SER . . . . . . . . . . . . . 31.2 t -85.49 165.36 17.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.537 -0.756 . . . . 1.0 110.416 179.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 17.9 m170 -59.45 -14.91 14.21 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.876 -0.416 . . . . 1.0 109.876 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -65.33 144.49 57.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.835 -0.62 . . . . 1.0 111.317 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -105.67 136.46 45.24 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.059 -0.519 . . . . 1.0 110.409 179.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1297 ' ' THR . . . . . . . . . . . . . 55.5 m -124.33 127.91 48.31 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 109.871 -0.418 . . . . 1.0 109.871 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -96.95 123.5 40.69 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.928 0.395 . . . . 1.0 110.251 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1299 ' ' THR . . . . . . . . . . . . . 99.6 m -126.76 130.5 50.44 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.012 -0.54 . . . . 1.0 110.722 -179.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 56.5 t -117.59 129.88 73.35 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.19 0 N-CA-C 109.076 -0.713 . . . . 1.0 109.076 179.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -129.01 147.73 50.9 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.146 0.498 . . . . 1.0 111.104 -179.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 29.5 t -114.16 129.84 69.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.555 -0.748 . . . . 1.0 109.055 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -113.59 141.44 47.17 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.212 0.53 . . . . 1.0 111.825 -178.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1304 ' ' PHE . . . . . 0.618 ' CE1' ' NE2' ' A' 1336 ' ' GLN . 80.1 t80 -137.58 100.58 4.25 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.242 -0.89 . . . . 1.0 109.355 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 50.7 mtmt 43.75 39.81 2.71 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.233 -0.439 . . . . 1.0 110.883 -178.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 88.53 6.37 73.7 Favored Glycine 0 CA--C 1.528 0.902 0 CA-C-N 116.266 -0.425 . . . . 1.0 112.361 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -112.45 121.47 44.92 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.854 0.359 . . . . 1.0 110.288 179.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 37.5 ttm180 -80.37 134.24 36.01 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.126 -0.488 . . . . 1.0 110.699 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 36.2 pt -131.25 9.71 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-N 116.152 -0.476 . . . . 1.0 110.442 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -159.27 151.7 22.6 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.897 -0.881 . . . . 1.0 110.897 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 9.2 t -170.8 47.1 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.76 0.314 . . . . 1.0 110.723 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -75.77 149.61 38.4 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 111.231 -0.748 . . . . 1.0 111.231 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -136.2 149.14 48.44 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 110.137 -0.32 . . . . 1.0 110.137 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -177.94 163.47 31.74 Favored Glycine 0 CA--C 1.53 1.018 0 N-CA-C 110.663 -0.975 . . . . 1.0 110.663 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -53.7 -45.8 38.4 Favored 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 121.551 1.501 . . . . 1.0 112.16 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1316 ' ' SER . . . . . . . . . . . . . 91.1 p -105.32 161.99 13.82 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.005 0.431 . . . . 1.0 111.189 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 46.2 mm -64.97 -44.7 96.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.712 -0.677 . . . . 1.0 110.9 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -55.75 -44.04 77.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.146 -0.479 . . . . 1.0 111.124 -178.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -66.77 -39.38 87.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.509 -0.314 . . . . 1.0 110.881 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -65.21 -39.68 93.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 1.0 111.405 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -66.8 -35.54 80.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.588 -0.278 . . . . 1.0 111.291 -179.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1322 ' ' MET . . . . . . . . . . . . . 59.7 mtt -62.38 -42.17 99.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.515 -0.311 . . . . 1.0 110.769 -179.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -67.35 -43.32 88.38 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 111.196 -0.762 . . . . 1.0 111.196 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -67.48 -39.47 85.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.725 0.298 . . . . 1.0 111.31 -179.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -64.66 -41.22 96.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.438 -0.346 . . . . 1.0 111.599 -179.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1326 ' ' MET . . . . . . . . . . . . . 22.3 tpp -61.37 -48.56 80.72 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.87 -0.332 . . . . 1.0 110.436 -179.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -65.49 -37.46 86.87 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.998 -0.546 . . . . 1.0 111.186 -179.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1328 ' ' ALA . . . . . 0.531 ' O ' ' CD2' ' A' 1332 ' ' TYR . . . -56.47 -25.05 49.83 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 111.973 0.361 . . . . 1.0 111.973 -178.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 78.3 mt -62.61 -42.23 99.46 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.98 0.363 . . . . 1.0 111.98 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -95.19 23.89 5.4 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 111.994 0.368 . . . . 1.0 111.994 -178.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -132.44 34.46 3.72 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 121.197 -0.201 . . . . 1.0 110.973 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1332 ' ' TYR . . . . . 0.531 ' CD2' ' O ' ' A' 1328 ' ' ALA . 29.2 m-85 -111.5 139.38 46.98 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.325 0.583 . . . . 1.0 110.956 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1333 ' ' ASN . . . . . 0.451 ' O ' ' O ' ' A' 1334 ' ' PHE . 11.4 m120 -102.78 -175.46 2.82 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 115.141 -0.936 . . . . 1.0 110.187 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 1334 ' ' PHE . . . . . 0.451 ' O ' ' O ' ' A' 1333 ' ' ASN . 0.5 OUTLIER -49.27 -179.56 0.03 OUTLIER Pre-proline 0 CA--C 1.539 0.542 0 N-CA-C 109.024 -0.732 . . . . 1.0 109.024 179.408 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -59.34 145.11 98.88 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 121.704 1.603 . . . . 1.0 111.693 -179.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 1336 ' ' GLN . . . . . 0.618 ' NE2' ' CE1' ' A' 1304 ' ' PHE . 1.3 mm100 . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.056 -0.52 . . . . 1.0 110.53 -179.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 18.7 pttp . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.795 0.331 . . . . 1.0 110.773 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A 1263 ' ' SER . . . . . . . . . . . . . 58.2 m -61.13 -32.13 71.83 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.133 -0.485 . . . . 1.0 110.623 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1264 ' ' GLN . . . . . 0.507 ' O ' ' SG ' ' A' 1268 ' ' CYS . 28.3 mp0 -57.04 -49.55 75.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.22 -0.446 . . . . 1.0 110.986 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1265 ' ' LEU . . . . . 0.466 ' O ' ' SG ' ' A' 1269 ' ' CYS . 34.4 mt -63.39 -40.6 97.67 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.762 -0.375 . . . . 1.0 110.605 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -63.71 -45.45 89.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.352 -0.386 . . . . 1.0 110.789 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -70.51 -39.61 74.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.447 -0.342 . . . . 1.0 111.236 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1268 ' ' CYS . . . . . 0.507 ' SG ' ' O ' ' A' 1264 ' ' GLN . 89.2 m -60.93 -35.57 77.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.46 -0.336 . . . . 1.0 111.376 -179.317 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1269 ' ' CYS . . . . . 0.466 ' SG ' ' O ' ' A' 1265 ' ' LEU . 83.9 m -54.71 -37.95 66.46 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.864 -0.335 . . . . 1.0 111.005 -179.434 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1270 ' ' LEU . . . . . 0.45 ' CD2' ' N ' ' A' 1270 ' ' LEU . 3.6 mm? -64.89 -39.86 94.2 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.931 -0.308 . . . . 1.0 111.07 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1271 ' ' THR . . . . . 0.441 ' OG1' ' O ' ' A' 1268 ' ' CYS . 76.6 p -66.06 -31.11 71.79 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.979 0.363 . . . . 1.0 111.979 -178.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 60.4 mt -81.09 89.54 5.98 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 120.626 -0.43 . . . . 1.0 110.83 -179.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -119.19 151.76 37.79 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.088 -0.506 . . . . 1.0 110.57 179.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1274 ' ' THR . . . . . . . . . . . . . 1.3 m -126.91 162.03 26.91 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 109.866 -0.42 . . . . 1.0 109.866 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1275 ' ' GLU . . . . . 0.586 ' C ' ' H ' ' A' 1277 ' ' LYS . 79.0 tt0 -87.97 100.18 12.71 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 112.273 0.472 . . . . 1.0 112.273 -178.603 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 57.83 -13.97 0.02 OUTLIER Glycine 0 CA--C 1.529 0.92 0 CA-C-N 115.729 -0.669 . . . . 1.0 113.353 178.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1277 ' ' LYS . . . . . 0.586 ' H ' ' C ' ' A' 1275 ' ' GLU . 48.9 mtpt -79.17 -166.25 0.9 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 117.694 0.747 . . . . 1.0 110.474 -179.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -93.45 110.14 44.96 Favored Pre-proline 0 CA--C 1.538 0.5 0 CA-C-N 116.039 -0.528 . . . . 1.0 109.813 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -80.65 114.85 3.03 Favored 'Trans proline' 0 N--CA 1.492 1.403 0 C-N-CA 121.867 1.712 . . . . 1.0 112.171 -179.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1280 ' ' ASP . . . . . 0.524 ' OD2' ' NZ ' ' A' 1305 ' ' LYS . 66.0 m-20 -83.82 133.54 34.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.001 -0.545 . . . . 1.0 109.982 179.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 1.8 mt -144.76 127.89 8.51 Favored Pre-proline 0 CA--C 1.538 0.501 0 CA-C-O 118.991 -0.528 . . . . 1.0 110.138 -179.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 43.3 Cg_exo -52.95 135.57 58.62 Favored 'Trans proline' 0 N--CA 1.493 1.469 0 CA-C-N 120.482 1.208 . . . . 1.0 111.31 177.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 80.5 mt -122.32 152.63 39.91 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 109.596 -0.52 . . . . 1.0 109.596 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1284 ' ' TYR . . . . . 0.434 ' HH ' ' CB ' ' A' 1265 ' ' LEU . 94.5 m-85 -81.1 136.41 35.92 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.95 0.405 . . . . 1.0 110.914 -179.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 62.9 tttm -141.17 113.74 8.22 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.922 -0.581 . . . . 1.0 109.92 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1286 ' ' THR . . . . . . . . . . . . . 97.3 m -92.14 127.05 37.47 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.321 -0.399 . . . . 1.0 110.87 -179.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 60.0 mt -74.91 -172.45 1.61 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.276 -0.42 . . . . 1.0 109.948 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -108.13 126.01 52.27 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 120.84 0.352 . . . . 1.0 110.205 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1289 ' ' THR . . . . . . . . . . . . . 18.0 p -62.55 122.56 16.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.052 -0.522 . . . . 1.0 111.392 -179.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 15.8 m -153.25 122.62 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.809 -0.632 . . . . 1.0 109.773 178.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.01 166.67 26.25 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 111.039 -0.824 . . . . 1.0 111.039 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -66.03 -43.46 9.05 Favored 'Trans proline' 0 C--N 1.307 -1.638 0 C-N-CA 122.636 2.224 . . . . 1.0 110.852 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1293 ' ' SER . . . . . . . . . . . . . 30.3 t -89.97 165.26 14.17 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.394 -0.821 . . . . 1.0 110.126 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 71.0 m80 -59.11 -15.37 13.8 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.915 -0.402 . . . . 1.0 109.915 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -63.88 138.66 58.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.929 -0.578 . . . . 1.0 110.783 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 83.5 mtm-85 -101.87 142.41 33.23 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.193 -0.458 . . . . 1.0 110.766 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1297 ' ' THR . . . . . . . . . . . . . 94.6 m -118.73 124.33 47.04 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.958 -0.565 . . . . 1.0 109.8 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -98.51 116.03 29.86 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.362 -0.381 . . . . 1.0 110.491 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1299 ' ' THR . . . . . . . . . . . . . 91.0 m -126.88 132.39 50.93 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.115 -0.493 . . . . 1.0 110.598 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 75.4 t -121.57 131.37 73.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 N-CA-C 109.532 -0.544 . . . . 1.0 109.532 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -129.79 143.74 50.96 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.005 0.431 . . . . 1.0 110.551 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 58.0 t -109.67 129.38 64.64 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 CA-C-N 116.044 -0.526 . . . . 1.0 109.629 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -105.11 133.89 49.14 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.001 0.429 . . . . 1.0 111.332 -179.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 87.7 t80 -147.92 110.37 4.66 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.842 -0.617 . . . . 1.0 110.354 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1305 ' ' LYS . . . . . 0.524 ' NZ ' ' OD2' ' A' 1280 ' ' ASP . 72.4 mmtt 54.58 31.19 14.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.313 -0.403 . . . . 1.0 110.647 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 78.93 6.36 88.71 Favored Glycine 0 CA--C 1.523 0.584 0 N-CA-C 111.068 -0.813 . . . . 1.0 111.068 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -112.11 117.06 31.57 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 109.975 -0.38 . . . . 1.0 109.975 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 42.3 ttm180 -73.37 128.24 34.92 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.732 -0.47 . . . . 1.0 109.732 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 24.3 pt -118.28 19.73 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-N 116.155 -0.475 . . . . 1.0 111.656 -178.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -161.54 147.3 13.57 Favored Glycine 0 CA--C 1.524 0.652 0 C-N-CA 120.499 -0.858 . . . . 1.0 111.418 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 44.9 t -171.11 126.77 0.68 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.719 0.295 . . . . 1.0 110.428 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -177.32 176.15 47.93 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 110.944 -0.862 . . . . 1.0 110.944 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 65.2 mttp -142.39 149.41 39.31 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.804 0.335 . . . . 1.0 110.413 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -164.96 168.5 39.18 Favored Glycine 0 CA--C 1.529 0.949 0 N-CA-C 110.635 -0.986 . . . . 1.0 110.635 179.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -53.92 -69.13 0.06 OUTLIER 'Trans proline' 0 N--CA 1.494 1.516 0 C-N-CA 121.602 1.535 . . . . 1.0 111.878 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1316 ' ' SER . . . . . . . . . . . . . 8.2 p -90.32 169.18 11.31 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.079 -0.509 . . . . 1.0 111.07 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1317 ' ' ILE . . . . . 0.41 HG21 HD11 ' A' 1317 ' ' ILE . 47.5 mm -63.9 -43.89 97.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.893 -0.594 . . . . 1.0 110.353 179.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 93.9 mm-40 -53.8 -40.79 66.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 1.0 110.967 -179.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -61.36 -42.39 98.62 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.392 -0.367 . . . . 1.0 110.621 -179.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -67.37 -37.68 83.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.25 -0.432 . . . . 1.0 110.991 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -64.84 -43.31 93.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.106 -0.497 . . . . 1.0 111.526 -179.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1322 ' ' MET . . . . . . . . . . . . . 78.2 mtm -64.52 -39.28 93.49 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.782 -0.367 . . . . 1.0 111.406 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -63.31 -48.36 79.76 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 111.037 -0.825 . . . . 1.0 111.037 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -69.92 -35.75 74.81 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.785 0.326 . . . . 1.0 111.083 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -59.71 -49.76 76.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.075 -0.511 . . . . 1.0 111.918 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1326 ' ' MET . . . . . . . . . . . . . 87.1 mmm -64.67 -42.39 95.41 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.723 -0.391 . . . . 1.0 111.67 -178.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -66.18 -33.62 76.17 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.329 -0.396 . . . . 1.0 111.312 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1328 ' ' ALA . . . . . . . . . . . . . . . -56.79 -20.83 24.47 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.169 -0.469 . . . . 1.0 112.194 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1329 ' ' LEU . . . . . 0.445 ' N ' ' CD2' ' A' 1329 ' ' LEU . 3.7 mm? -61.32 -42.66 99.05 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.585 -0.446 . . . . 1.0 111.16 -178.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1330 ' ' GLU . . . . . 0.521 ' N ' ' OE1' ' A' 1330 ' ' GLU . 50.4 mp0 -92.94 24.59 3.6 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 121.209 -0.196 . . . . 1.0 111.435 -179.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -128.66 10.32 6.06 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 111.702 0.26 . . . . 1.0 111.702 -178.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1332 ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -77.36 137.75 38.92 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 120.492 -0.483 . . . . 1.0 110.602 179.467 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 5.4 m120 -107.32 -177.0 3.23 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.605 -0.725 . . . . 1.0 110.224 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 1334 ' ' PHE . . . . . 0.454 ' O ' ' O ' ' A' 1335 ' ' PRO . 19.3 m-85 -41.39 151.1 0.3 Allowed Pre-proline 0 CA--C 1.539 0.539 0 CA-C-N 116.215 -0.448 . . . . 1.0 110.438 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1335 ' ' PRO . . . . . 0.454 ' O ' ' O ' ' A' 1334 ' ' PHE . 87.9 Cg_exo -41.49 174.12 0.0 OUTLIER 'Trans proline' 0 N--CA 1.495 1.617 0 C-N-CA 122.433 2.088 . . . . 1.0 112.814 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 1336 ' ' GLN . . . . . 0.515 ' H ' ' CD ' ' A' 1336 ' ' GLN . 2.2 mp0 . . . . . 0 C--N 1.331 -0.221 0 CA-C-N 115.816 -0.629 . . . . 1.0 110.378 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 52.7 pttt . . . . . 0 CA--C 1.528 0.103 0 CA-C-O 121.01 0.433 . . . . 1.0 110.659 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A 1263 ' ' SER . . . . . . . . . . . . . 47.8 m -61.45 -35.7 78.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.12 -0.491 . . . . 1.0 111.017 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -58.46 -52.52 65.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.312 -0.404 . . . . 1.0 111.433 -179.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1265 ' ' LEU . . . . . . . . . . . . . 8.8 mt -65.12 -40.03 93.92 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.902 -0.319 . . . . 1.0 110.784 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 20.2 mm100 -62.29 -43.36 99.01 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 121.033 -0.267 . . . . 1.0 110.89 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -65.63 -31.51 72.57 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.792 0.33 . . . . 1.0 110.814 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1268 ' ' CYS . . . . . 0.432 ' O ' ' OG1' ' A' 1271 ' ' THR . 85.3 m -62.8 -36.5 83.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.378 -0.373 . . . . 1.0 111.119 -179.419 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 93.1 m -60.48 -37.28 80.53 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.88 -0.328 . . . . 1.0 111.036 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 10.9 mp -63.48 -40.42 97.05 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.802 -0.359 . . . . 1.0 110.618 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1271 ' ' THR . . . . . 0.432 ' OG1' ' O ' ' A' 1268 ' ' CYS . 69.2 p -64.67 -31.3 72.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.452 -0.34 . . . . 1.0 111.426 -179.051 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 87.8 mt -69.93 84.04 0.49 Allowed 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.303 -0.559 . . . . 1.0 110.577 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -106.1 136.66 45.39 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.248 -0.433 . . . . 1.0 110.228 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1274 ' ' THR . . . . . . . . . . . . . 7.1 m -127.24 155.65 43.14 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 109.85 -0.426 . . . . 1.0 109.85 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -66.65 90.59 0.17 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.976 0.417 . . . . 1.0 111.469 -178.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 54.62 40.57 70.99 Favored Glycine 0 CA--C 1.525 0.692 0 CA-C-N 115.832 -0.622 . . . . 1.0 112.434 178.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 42.4 mtpt -140.4 178.92 6.96 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.508 0.671 . . . . 1.0 111.885 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -117.74 105.95 46.88 Favored Pre-proline 0 CA--C 1.539 0.538 0 CA-C-N 114.753 -1.112 . . . . 1.0 109.271 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -81.14 163.66 19.95 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 C-N-CA 121.776 1.65 . . . . 1.0 112.203 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1280 ' ' ASP . . . . . 0.5 ' O ' ' NE2' ' A' 1336 ' ' GLN . 97.8 m-20 -79.87 125.82 30.21 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.387 -0.597 . . . . 1.0 109.387 179.472 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -115.91 140.45 26.24 Favored Pre-proline 0 CA--C 1.541 0.627 0 CA-C-N 115.973 -0.558 . . . . 1.0 110.591 -178.371 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo -49.18 137.35 30.04 Favored 'Trans proline' 0 N--CA 1.491 1.381 0 C-N-CA 120.973 1.115 . . . . 1.0 110.96 178.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 55.4 mt -117.7 140.43 49.67 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 110.01 -0.367 . . . . 1.0 110.01 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1284 ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -85.17 137.3 33.1 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.237 -0.438 . . . . 1.0 110.241 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 88.6 tttt -140.67 121.2 14.15 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.911 0.386 . . . . 1.0 110.463 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1286 ' ' THR . . . . . . . . . . . . . 34.3 m -89.31 128.66 35.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.485 . . . . 1.0 110.253 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 54.2 mt -81.12 -172.45 3.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.478 -0.328 . . . . 1.0 110.299 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -108.13 141.05 40.44 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.241 -0.436 . . . . 1.0 110.337 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1289 ' ' THR . . . . . . . . . . . . . 5.6 p -91.04 112.74 24.77 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.238 -0.437 . . . . 1.0 110.748 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 5.6 m -143.27 122.17 7.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.185 -0.461 . . . . 1.0 110.202 179.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.44 166.09 26.56 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.749 -0.94 . . . . 1.0 110.749 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.01 -40.8 67.59 Favored 'Trans proline' 0 C--N 1.306 -1.688 0 C-N-CA 122.382 2.055 . . . . 1.0 110.946 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1293 ' ' SER . . . . . . . . . . . . . 29.5 t -92.95 164.34 13.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.616 -0.72 . . . . 1.0 110.079 178.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 75.7 m-70 -60.36 -9.97 4.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.084 0.468 . . . . 1.0 110.027 179.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -60.17 141.98 55.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.902 -0.59 . . . . 1.0 110.845 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -113.84 141.91 46.74 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.085 -0.507 . . . . 1.0 110.911 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1297 ' ' THR . . . . . . . . . . . . . 89.1 m -124.0 126.01 45.56 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.965 -0.561 . . . . 1.0 109.816 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -103.38 122.57 45.13 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.978 0.418 . . . . 1.0 110.975 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1299 ' ' THR . . . . . 0.501 ' OG1' ' NZ ' ' A' 1313 ' ' LYS . 89.9 m -128.03 132.84 49.08 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.875 -0.602 . . . . 1.0 110.142 179.34 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 55.9 t -118.72 132.82 67.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 N-CA-C 109.671 -0.492 . . . . 1.0 109.671 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -128.82 147.15 50.78 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.089 -0.505 . . . . 1.0 110.7 -179.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 44.4 t -115.21 130.07 70.38 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 N-CA-C 109.513 -0.551 . . . . 1.0 109.513 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -108.93 140.96 41.7 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.092 0.473 . . . . 1.0 111.226 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 92.0 t80 -136.96 103.54 5.19 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.683 -0.69 . . . . 1.0 109.792 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 98.8 mttt 47.84 34.21 3.77 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.756 -0.378 . . . . 1.0 110.511 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 87.55 10.29 70.69 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 121.26 -0.495 . . . . 1.0 111.901 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -116.11 136.39 53.07 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 120.923 0.392 . . . . 1.0 110.622 179.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 72.6 ttp85 -81.44 135.4 35.63 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.95 -0.568 . . . . 1.0 110.885 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 40.3 pt -135.36 18.22 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-N 116.281 -0.418 . . . . 1.0 110.744 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -161.33 147.83 14.84 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 111.305 -0.718 . . . . 1.0 111.305 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 35.5 t -168.58 134.93 1.87 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.902 0.382 . . . . 1.0 110.625 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . 169.68 170.86 34.66 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 110.799 -0.92 . . . . 1.0 110.799 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1313 ' ' LYS . . . . . 0.501 ' NZ ' ' OG1' ' A' 1299 ' ' THR . 24.4 mtpp -138.59 146.75 42.17 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.973 0.415 . . . . 1.0 110.934 -179.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -162.34 172.54 38.47 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 110.356 -1.097 . . . . 1.0 110.356 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -68.01 -73.03 0.02 OUTLIER 'Trans proline' 0 C--N 1.306 -1.66 0 C-N-CA 122.33 2.02 . . . . 1.0 111.984 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1316 ' ' SER . . . . . 0.435 ' HG ' ' H ' ' A' 1319 ' ' GLN . 82.5 p -82.48 161.21 22.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.46 . . . . 1.0 110.769 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 44.1 mm -65.02 -43.99 96.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.996 -0.547 . . . . 1.0 110.697 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -54.96 -45.05 74.9 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.388 -0.369 . . . . 1.0 110.338 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1319 ' ' GLN . . . . . 0.435 ' H ' ' HG ' ' A' 1316 ' ' SER . 1.4 mp0 -64.62 -40.2 95.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.33 -0.396 . . . . 1.0 110.169 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -63.61 -40.06 95.95 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.117 -0.492 . . . . 1.0 111.075 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -67.2 -38.71 85.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.327 -0.397 . . . . 1.0 110.707 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1322 ' ' MET . . . . . . . . . . . . . 78.6 mtp -64.44 -40.56 95.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.469 . . . . 1.0 110.711 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -67.48 -48.43 57.32 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 110.661 -0.976 . . . . 1.0 110.661 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -67.56 -35.13 78.44 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.877 0.37 . . . . 1.0 110.683 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -60.9 -41.24 95.72 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.945 -0.57 . . . . 1.0 111.769 -178.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1326 ' ' MET . . . . . . . . . . . . . 62.6 ttp -63.28 -41.82 99.04 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.877 -0.329 . . . . 1.0 111.316 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -67.48 -29.53 68.99 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.248 -0.433 . . . . 1.0 110.926 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1328 ' ' ALA . . . . . . . . . . . . . . . -61.13 -27.88 68.71 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.125 0.417 . . . . 1.0 112.125 -178.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 3.2 mm? -62.25 -41.26 98.28 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.494 -0.482 . . . . 1.0 110.569 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -88.61 18.71 4.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.354 -0.385 . . . . 1.0 111.24 -179.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 99.5 mttt -135.41 40.11 2.84 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.518 0.562 . . . . 1.0 112.518 -178.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1332 ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -106.04 134.94 48.37 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.215 0.531 . . . . 1.0 110.595 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1333 ' ' ASN . . . . . 0.427 ' O ' ' C ' ' A' 1334 ' ' PHE . 52.0 m-20 -111.43 -175.48 2.71 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.35 -0.841 . . . . 1.0 109.92 179.277 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1334 ' ' PHE . . . . . 0.427 ' C ' ' O ' ' A' 1333 ' ' ASN . 52.3 m-85 -30.39 110.59 0.27 Allowed Pre-proline 0 CA--C 1.543 0.702 0 O-C-N 123.476 0.485 . . . . 1.0 111.524 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -52.35 145.99 33.97 Favored 'Trans proline' 0 N--CA 1.496 1.673 0 C-N-CA 121.661 1.574 . . . . 1.0 112.275 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 1336 ' ' GLN . . . . . 0.5 ' NE2' ' O ' ' A' 1280 ' ' ASP . 15.8 mm100 . . . . . 0 N--CA 1.462 0.149 0 CA-C-N 115.894 -0.594 . . . . 1.0 111.205 -179.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 64.3 pttt . . . . . 0 CA--C 1.53 0.183 0 CA-C-O 120.617 0.246 . . . . 1.0 111.371 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A 1263 ' ' SER . . . . . . . . . . . . . 45.7 m -60.45 -28.05 67.99 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.767 0.318 . . . . 1.0 110.638 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1264 ' ' GLN . . . . . 0.453 ' O ' ' SG ' ' A' 1268 ' ' CYS . 99.1 mm-40 -54.51 -44.17 72.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 1.0 110.636 -179.166 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1265 ' ' LEU . . . . . 0.451 ' O ' ' SG ' ' A' 1269 ' ' CYS . 20.4 mt -63.58 -41.48 98.37 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.505 -0.478 . . . . 1.0 110.474 179.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -63.47 -43.98 95.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.846 0.355 . . . . 1.0 110.492 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -66.58 -40.82 89.13 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.037 -0.529 . . . . 1.0 109.887 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1268 ' ' CYS . . . . . 0.453 ' SG ' ' O ' ' A' 1264 ' ' GLN . 92.9 m -65.14 -35.07 79.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.596 -0.729 . . . . 1.0 110.995 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1269 ' ' CYS . . . . . 0.451 ' SG ' ' O ' ' A' 1265 ' ' LEU . 98.4 m -56.74 -35.54 68.72 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.992 -0.283 . . . . 1.0 111.096 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 82.9 mt -62.92 -40.98 99.27 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.478 -0.328 . . . . 1.0 110.621 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1271 ' ' THR . . . . . 0.43 ' OG1' ' O ' ' A' 1268 ' ' CYS . 70.3 p -66.77 -33.14 74.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.517 -0.31 . . . . 1.0 110.843 -179.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 85.9 mt -68.19 85.95 0.26 Allowed 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.572 -0.451 . . . . 1.0 110.562 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 79.4 mtp85 -119.67 131.09 55.34 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.307 -0.406 . . . . 1.0 110.75 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1274 ' ' THR . . . . . . . . . . . . . 20.8 m -120.94 128.4 52.72 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 109.992 -0.373 . . . . 1.0 109.992 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 48.4 tp10 -98.07 128.77 44.79 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.255 -0.43 . . . . 1.0 110.468 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 97.19 -9.26 65.2 Favored Glycine 0 CA--C 1.524 0.647 0 N-CA-C 111.439 -0.664 . . . . 1.0 111.439 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 52.0 mtpt -137.43 -175.11 3.95 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.207 0.527 . . . . 1.0 111.145 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -95.79 108.22 38.94 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 115.11 -0.95 . . . . 1.0 108.713 178.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -50.67 129.22 26.31 Favored 'Trans proline' 0 N--CA 1.493 1.445 0 C-N-CA 121.154 1.236 . . . . 1.0 112.251 -178.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -98.65 125.33 43.91 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.696 -0.684 . . . . 1.0 109.858 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 11.9 mt -133.73 133.84 22.8 Favored Pre-proline 0 CA--C 1.538 0.494 0 N-CA-C 110.365 -0.235 . . . . 1.0 110.365 -179.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -77.68 120.55 5.19 Favored 'Trans proline' 0 N--CA 1.493 1.471 0 C-N-CA 121.56 1.507 . . . . 1.0 111.531 178.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 9.4 mp -106.91 155.83 19.34 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.193 -0.458 . . . . 1.0 110.383 -179.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1284 ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -77.33 144.71 37.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.921 -0.581 . . . . 1.0 111.155 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 87.7 tttt -146.12 105.73 3.96 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.837 -0.619 . . . . 1.0 109.989 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1286 ' ' THR . . . . . . . . . . . . . 26.2 m -63.44 130.38 44.19 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.123 -0.49 . . . . 1.0 111.2 -179.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 65.7 mt -81.4 -175.1 5.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.047 -0.524 . . . . 1.0 110.406 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -108.76 146.73 33.1 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.161 -0.472 . . . . 1.0 110.292 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1289 ' ' THR . . . . . . . . . . . . . 17.4 p -94.57 114.21 26.15 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.1 -0.5 . . . . 1.0 111.212 -178.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 30.4 m -138.92 121.56 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-N 116.292 -0.413 . . . . 1.0 110.358 178.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.8 157.83 26.91 Favored Glycine 0 CA--C 1.527 0.82 0 N-CA-C 110.19 -1.164 . . . . 1.0 110.19 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -60.26 -40.56 58.11 Favored 'Trans proline' 0 C--N 1.31 -1.487 0 C-N-CA 122.055 1.837 . . . . 1.0 110.975 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1293 ' ' SER . . . . . 0.548 ' HG ' ' H ' ' A' 1295 ' ' ALA . 11.9 t -93.19 164.79 13.11 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.633 -0.712 . . . . 1.0 110.314 179.171 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1294 ' ' HIS . . . . . 0.482 ' N ' ' HG ' ' A' 1293 ' ' SER . 62.1 m170 -58.36 -11.39 2.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.274 -0.421 . . . . 1.0 110.018 179.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1295 ' ' ALA . . . . . 0.548 ' H ' ' HG ' ' A' 1293 ' ' SER . . . -60.3 147.89 38.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.98 -0.554 . . . . 1.0 110.485 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 96.2 mtt-85 -126.89 143.74 51.19 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.164 0.507 . . . . 1.0 111.149 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1297 ' ' THR . . . . . . . . . . . . . 88.4 m -125.24 128.09 47.76 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.57 -0.741 . . . . 1.0 109.366 178.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 95.3 m-85 -99.66 119.32 37.91 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.777 -0.453 . . . . 1.0 109.777 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1299 ' ' THR . . . . . . . . . . . . . 41.1 m -127.24 130.17 49.13 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.939 -0.573 . . . . 1.0 110.427 -179.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 67.2 t -118.31 127.41 75.42 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 N-CA-C 109.189 -0.671 . . . . 1.0 109.189 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -130.83 143.39 50.7 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.351 -0.386 . . . . 1.0 110.894 -179.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 16.9 t -106.55 129.07 60.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 N-CA-C 109.142 -0.688 . . . . 1.0 109.142 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -112.59 144.33 42.26 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.238 0.542 . . . . 1.0 111.671 -178.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1304 ' ' PHE . . . . . 0.432 ' O ' ' N ' ' A' 1307 ' ' GLU . 75.2 t80 -126.69 108.0 10.69 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.388 -0.823 . . . . 1.0 109.234 179.324 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 38.5 mtpt 46.75 32.24 1.69 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.514 -0.474 . . . . 1.0 109.984 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 88.97 17.29 56.52 Favored Glycine 0 CA--C 1.529 0.956 0 N-CA-C 111.83 -0.508 . . . . 1.0 111.83 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1307 ' ' GLU . . . . . 0.432 ' N ' ' O ' ' A' 1304 ' ' PHE . 99.5 mt-10 -119.47 129.71 54.87 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.964 0.382 . . . . 1.0 110.777 179.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1308 ' ' ARG . . . . . 0.642 HH21 ' CB ' ' A' 1311 ' ' CYS . 77.7 ttt180 -66.53 129.25 39.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.772 -0.649 . . . . 1.0 110.97 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 3.4 pt -138.24 13.01 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 116.064 -0.517 . . . . 1.0 110.874 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -173.57 153.19 16.98 Favored Glycine 0 CA--C 1.524 0.623 0 C-N-CA 120.346 -0.93 . . . . 1.0 111.674 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1311 ' ' CYS . . . . . 0.642 ' CB ' HH21 ' A' 1308 ' ' ARG . 52.4 t -169.9 144.08 2.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.877 0.37 . . . . 1.0 110.789 179.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -170.63 156.35 26.61 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.879 -0.888 . . . . 1.0 110.879 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 99.3 mttt -139.07 142.02 38.18 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.929 0.395 . . . . 1.0 110.595 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -167.11 176.9 41.94 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 110.277 -1.129 . . . . 1.0 110.277 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 18.3 Cg_exo -61.53 -63.23 0.1 Allowed 'Trans proline' 0 C--N 1.311 -1.408 0 C-N-CA 121.487 1.458 . . . . 1.0 111.936 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1316 ' ' SER . . . . . . . . . . . . . 9.8 p -90.95 167.25 12.55 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.8 -0.636 . . . . 1.0 111.061 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1317 ' ' ILE . . . . . 0.43 HG21 HD11 ' A' 1317 ' ' ILE . 38.1 mm -67.79 -42.43 86.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.914 -0.584 . . . . 1.0 110.088 179.07 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -54.5 -43.52 71.9 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.961 -0.563 . . . . 1.0 111.204 -178.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -66.94 -40.05 87.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.999 0.428 . . . . 1.0 110.341 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -62.59 -38.92 92.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.046 -0.525 . . . . 1.0 110.367 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -67.35 -38.17 84.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.245 -0.434 . . . . 1.0 111.445 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1322 ' ' MET . . . . . . . . . . . . . 72.1 mmm -64.13 -40.15 95.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.868 0.366 . . . . 1.0 110.547 -179.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -66.41 -47.42 70.58 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 111.574 -0.61 . . . . 1.0 111.574 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -66.09 -38.87 89.35 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.912 -0.315 . . . . 1.0 111.301 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -59.15 -48.3 82.11 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.358 -0.383 . . . . 1.0 111.206 -179.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1326 ' ' MET . . . . . 0.456 ' O ' ' OE1' ' A' 1330 ' ' GLU . 98.0 mmm -62.59 -43.97 97.49 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.729 -0.388 . . . . 1.0 111.085 -179.556 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -68.48 -32.78 73.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.528 -0.306 . . . . 1.0 111.694 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1328 ' ' ALA . . . . . . . . . . . . . . . -62.34 -33.65 75.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.677 0.275 . . . . 1.0 111.641 -178.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 98.7 mt -58.75 -26.49 64.04 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.707 0.289 . . . . 1.0 111.095 -179.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1330 ' ' GLU . . . . . 0.529 ' N ' ' OE1' ' A' 1330 ' ' GLU . 56.1 mp0 -88.84 -2.08 58.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.357 -0.383 . . . . 1.0 111.544 -179.483 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 98.4 mttt -120.41 21.46 11.64 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 112.698 0.629 . . . . 1.0 112.698 -177.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1332 ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -104.38 131.03 52.18 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.092 0.472 . . . . 1.0 110.585 179.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -101.13 -176.28 3.11 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.553 -0.749 . . . . 1.0 109.95 178.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -37.05 154.62 0.09 OUTLIER Pre-proline 0 CA--C 1.538 0.496 0 CA-C-N 116.147 -0.479 . . . . 1.0 110.846 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -52.97 157.43 8.08 Favored 'Trans proline' 0 N--CA 1.493 1.481 0 C-N-CA 121.336 1.357 . . . . 1.0 111.483 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 1336 ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 . . . . . 0 N--CA 1.465 0.288 0 CA-C-O 120.941 0.4 . . . . 1.0 111.095 -179.494 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 52.1 mtpt . . . . . 0 N--CA 1.465 0.317 0 CA-C-O 120.592 0.234 . . . . 1.0 111.371 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A 1263 ' ' SER . . . . . . . . . . . . . 55.7 m -56.73 -45.23 82.08 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.569 -0.452 . . . . 1.0 110.532 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 28.1 mp0 -67.4 -40.91 85.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.993 0.425 . . . . 1.0 110.552 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1265 ' ' LEU . . . . . 0.474 ' N ' ' CD2' ' A' 1265 ' ' LEU . 2.2 mm? -62.96 -42.97 99.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.905 -0.589 . . . . 1.0 110.574 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -65.31 -44.35 88.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.316 -0.402 . . . . 1.0 111.292 -179.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -63.86 -39.27 93.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.454 -0.339 . . . . 1.0 111.267 -179.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1268 ' ' CYS . . . . . 0.429 ' O ' ' OG1' ' A' 1271 ' ' THR . 97.4 m -63.94 -35.92 82.26 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.36 -0.382 . . . . 1.0 110.747 -179.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 77.2 m -60.2 -36.23 77.19 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.121 -0.49 . . . . 1.0 111.341 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 90.2 mt -62.9 -41.04 99.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.447 -0.342 . . . . 1.0 111.086 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1271 ' ' THR . . . . . 0.429 ' OG1' ' O ' ' A' 1268 ' ' CYS . 40.4 p -64.83 -30.36 71.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.503 -0.317 . . . . 1.0 111.55 -179.42 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 70.5 mt -78.71 96.6 5.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.87 0.367 . . . . 1.0 111.175 -179.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 46.8 mmm-85 -119.01 111.22 18.04 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.058 -0.519 . . . . 1.0 110.23 179.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1274 ' ' THR . . . . . . . . . . . . . 27.3 m -129.49 139.36 51.59 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 120.733 0.301 . . . . 1.0 110.458 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 78.8 tt0 -129.2 146.73 51.06 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.214 -0.448 . . . . 1.0 110.186 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 82.48 12.97 79.51 Favored Glycine 0 CA--C 1.524 0.651 0 N-CA-C 111.064 -0.814 . . . . 1.0 111.064 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 23.9 mtpp -136.55 -172.84 3.26 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.184 0.516 . . . . 1.0 110.919 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 87.7 mt-10 -96.37 108.57 42.74 Favored Pre-proline 0 CA--C 1.533 0.321 0 CA-C-N 115.259 -0.882 . . . . 1.0 109.046 179.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -50.21 133.12 35.34 Favored 'Trans proline' 0 N--CA 1.491 1.341 0 C-N-CA 121.173 1.249 . . . . 1.0 112.38 -179.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -139.68 124.18 18.18 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.512 -0.767 . . . . 1.0 109.28 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 7.0 mt -143.93 134.82 12.37 Favored Pre-proline 0 CA--C 1.537 0.461 0 CA-C-O 119.154 -0.45 . . . . 1.0 109.939 -178.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -52.24 131.71 40.89 Favored 'Trans proline' 0 N--CA 1.492 1.39 0 CA-C-N 120.322 1.151 . . . . 1.0 111.132 177.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 69.1 mt -130.13 140.65 50.76 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.918 0.389 . . . . 1.0 110.14 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1284 ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -82.32 141.8 32.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.877 -0.601 . . . . 1.0 111.785 -178.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -143.49 108.46 4.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.31 -0.859 . . . . 1.0 109.447 179.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1286 ' ' THR . . . . . . . . . . . . . 16.6 m -64.09 142.89 58.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.272 0.558 . . . . 1.0 110.779 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1287 ' ' LEU . . . . . 0.591 ' N ' ' CD2' ' A' 1287 ' ' LEU . 1.0 OUTLIER -80.92 -174.14 4.64 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.216 -0.902 . . . . 1.0 110.015 -179.352 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -108.86 130.59 55.42 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 109.695 -0.483 . . . . 1.0 109.695 179.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1289 ' ' THR . . . . . . . . . . . . . 64.9 p -87.46 116.97 25.93 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.927 0.394 . . . . 1.0 111.359 -179.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 24.1 m -149.99 122.14 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.183 0 CA-C-N 116.04 -0.527 . . . . 1.0 109.99 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.14 160.69 27.21 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.516 -1.034 . . . . 1.0 110.516 179.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -59.27 -43.36 41.78 Favored 'Trans proline' 0 C--N 1.308 -1.573 0 C-N-CA 122.214 1.943 . . . . 1.0 111.038 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1293 ' ' SER . . . . . 0.425 ' C ' ' H ' ' A' 1295 ' ' ALA . 46.9 t -92.3 165.16 13.23 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.569 -0.741 . . . . 1.0 110.331 179.499 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 80.8 m80 -59.93 -6.73 1.4 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.334 -0.394 . . . . 1.0 110.389 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1295 ' ' ALA . . . . . 0.425 ' H ' ' C ' ' A' 1293 ' ' SER . . . -66.7 148.46 51.88 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.081 -0.509 . . . . 1.0 110.612 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -129.9 143.73 50.95 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 116.236 -0.438 . . . . 1.0 110.628 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1297 ' ' THR . . . . . . . . . . . . . 84.8 m -123.54 128.7 50.13 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.933 -0.576 . . . . 1.0 109.526 179.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -102.03 118.98 38.05 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.184 0.516 . . . . 1.0 111.567 -178.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1299 ' ' THR . . . . . . . . . . . . . 91.9 m -127.71 130.13 48.32 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.557 -0.747 . . . . 1.0 109.815 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 53.3 t -117.31 129.94 73.01 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 N-CA-C 109.714 -0.476 . . . . 1.0 109.714 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -130.52 143.82 51.01 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.306 -0.407 . . . . 1.0 111.117 -179.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 24.9 t -107.37 126.86 63.56 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 CA-C-N 116.019 -0.537 . . . . 1.0 109.599 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -104.68 130.18 52.76 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.847 0.356 . . . . 1.0 110.539 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 61.8 t80 -142.56 109.03 5.32 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.172 -0.467 . . . . 1.0 110.371 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 68.1 mttm 52.17 27.71 4.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 1.0 110.894 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 80.14 12.22 83.5 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 111.378 -0.689 . . . . 1.0 111.378 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -109.92 120.15 41.56 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 110.023 -0.362 . . . . 1.0 110.023 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 61.6 ttp180 -75.98 126.04 30.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.341 -0.391 . . . . 1.0 110.354 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 31.5 pt -122.26 23.12 4.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-N 116.099 -0.5 . . . . 1.0 110.387 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -156.86 153.4 24.67 Favored Glycine 0 CA--C 1.524 0.639 0 N-CA-C 110.781 -0.928 . . . . 1.0 110.781 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 12.0 t -172.44 105.91 0.17 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.733 0.301 . . . . 1.0 110.557 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -173.48 167.85 40.62 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 111.108 -0.797 . . . . 1.0 111.108 179.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 69.0 mttm -139.61 144.08 37.55 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.811 0.338 . . . . 1.0 110.444 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -157.78 171.95 34.95 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.562 -1.015 . . . . 1.0 110.562 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.78 -76.83 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.66 0 C-N-CA 122.54 2.16 . . . . 1.0 111.759 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1316 ' ' SER . . . . . . . . . . . . . 16.2 p -76.28 162.0 28.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.015 0.436 . . . . 1.0 111.116 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 39.1 mm -63.83 -43.81 97.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.887 -0.597 . . . . 1.0 110.797 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -57.12 -40.27 76.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.305 -0.407 . . . . 1.0 110.877 -179.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 19.0 mm100 -62.85 -42.49 99.77 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.849 0.357 . . . . 1.0 110.66 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -67.08 -37.9 84.79 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.081 -0.508 . . . . 1.0 111.425 -179.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -66.12 -40.02 90.36 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.146 0.424 . . . . 1.0 112.146 -178.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1322 ' ' MET . . . . . . . . . . . . . 74.7 mtm -64.01 -41.35 97.49 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.495 -0.482 . . . . 1.0 111.161 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -64.29 -46.04 91.83 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 120.862 -0.685 . . . . 1.0 111.678 -179.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -66.23 -37.49 85.65 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.891 0.33 . . . . 1.0 111.891 -179.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -62.52 -41.74 99.05 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 111.893 0.331 . . . . 1.0 111.893 -178.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1326 ' ' MET . . . . . . . . . . . . . 74.1 mmm -62.92 -44.39 96.21 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.59 -0.444 . . . . 1.0 111.259 -179.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -68.25 -33.35 74.21 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.858 -0.337 . . . . 1.0 110.278 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1328 ' ' ALA . . . . . . . . . . . . . . . -57.45 -37.33 72.67 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.054 -0.521 . . . . 1.0 111.072 -179.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 76.5 mt -62.03 -36.52 81.84 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.78 0.324 . . . . 1.0 110.685 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -82.98 8.32 13.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.29 -0.414 . . . . 1.0 111.273 -179.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 96.5 mttt -135.81 40.51 2.74 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.395 0.517 . . . . 1.0 112.395 -177.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1332 ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -107.18 151.23 25.69 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.075 0.464 . . . . 1.0 110.181 179.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -123.77 -176.74 3.55 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.552 -0.749 . . . . 1.0 109.982 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -37.86 150.54 0.17 Allowed Pre-proline 0 CA--C 1.535 0.387 0 CA-C-N 116.257 -0.428 . . . . 1.0 110.831 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.93 156.77 64.3 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 122.478 2.118 . . . . 1.0 112.252 -179.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 1336 ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 . . . . . 0 C--N 1.331 -0.205 0 CA-C-N 115.927 -0.579 . . . . 1.0 110.926 -179.864 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 55.7 mtmt . . . . . 0 N--CA 1.46 0.048 0 N-CA-C 111.628 0.233 . . . . 1.0 111.628 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A 1263 ' ' SER . . . . . . . . . . . . . 45.5 m -58.82 -38.51 78.81 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.71 -0.396 . . . . 1.0 110.419 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1264 ' ' GLN . . . . . 0.421 ' O ' ' SG ' ' A' 1268 ' ' CYS . 86.9 mt-30 -63.37 -47.45 82.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.955 -0.566 . . . . 1.0 111.386 -179.54 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1265 ' ' LEU . . . . . 0.425 ' CD1' ' OH ' ' A' 1284 ' ' TYR . 91.7 mt -64.23 -42.59 96.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.526 -0.306 . . . . 1.0 111.099 -179.449 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -63.67 -42.8 98.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.327 -0.397 . . . . 1.0 110.908 -179.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -65.85 -39.68 90.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.813 0.34 . . . . 1.0 110.54 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1268 ' ' CYS . . . . . 0.43 ' O ' ' OG1' ' A' 1271 ' ' THR . 95.4 m -62.82 -34.83 78.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.984 -0.553 . . . . 1.0 111.062 -179.489 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 77.5 m -54.83 -40.21 69.36 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.773 -0.371 . . . . 1.0 110.738 -179.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1270 ' ' LEU . . . . . 0.451 ' CD2' ' N ' ' A' 1270 ' ' LEU . 4.0 mm? -65.02 -39.96 94.15 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.079 -0.509 . . . . 1.0 111.241 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1271 ' ' THR . . . . . 0.43 ' OG1' ' O ' ' A' 1268 ' ' CYS . 80.4 p -63.88 -31.96 73.33 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.83 0.307 . . . . 1.0 111.83 -178.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 71.8 mt -77.19 86.14 3.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.618 0.246 . . . . 1.0 111.056 -179.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -120.02 131.81 55.26 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 120.753 0.311 . . . . 1.0 111.07 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1274 ' ' THR . . . . . . . . . . . . . 9.3 m -128.54 139.68 52.18 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 109.176 -0.676 . . . . 1.0 109.176 178.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -107.85 133.01 52.83 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.208 0.528 . . . . 1.0 111.048 -179.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 80.85 5.17 90.24 Favored Glycine 0 CA--C 1.527 0.797 0 CA-C-N 115.705 -0.679 . . . . 1.0 112.474 178.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 43.3 mtpt -139.95 -174.24 3.86 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.614 0.721 . . . . 1.0 112.054 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -99.01 108.84 51.54 Favored Pre-proline 0 CA--C 1.538 0.491 0 CA-C-N 114.752 -1.113 . . . . 1.0 109.946 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -80.86 113.7 2.81 Favored 'Trans proline' 0 N--CA 1.496 1.668 0 C-N-CA 122.0 1.8 . . . . 1.0 112.798 -179.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -83.21 148.88 27.16 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.867 -0.606 . . . . 1.0 109.956 179.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 3.0 mt -140.85 132.41 13.89 Favored Pre-proline 0 CA--C 1.538 0.498 0 N-CA-C 109.303 -0.628 . . . . 1.0 109.303 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -55.2 139.08 80.62 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 CA-C-N 120.787 1.317 . . . . 1.0 110.983 178.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 97.0 mt -126.35 147.96 49.66 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.474 -0.33 . . . . 1.0 110.242 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1284 ' ' TYR . . . . . 0.425 ' OH ' ' CD1' ' A' 1265 ' ' LEU . 36.0 m-85 -78.0 142.79 38.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.094 -0.503 . . . . 1.0 111.132 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 65.0 tttm -145.23 106.64 4.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.472 -0.785 . . . . 1.0 109.49 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1286 ' ' THR . . . . . . . . . . . . . 41.5 m -69.41 133.93 48.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.062 -0.517 . . . . 1.0 111.267 -179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 67.6 mt -81.23 -172.48 3.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.908 -0.587 . . . . 1.0 110.081 179.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 91.6 mm-40 -109.22 140.91 42.23 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.053 -0.521 . . . . 1.0 110.032 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1289 ' ' THR . . . . . . . . . . . . . 30.1 p -99.35 114.98 28.16 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.166 -0.47 . . . . 1.0 111.085 -179.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 28.0 m -133.09 122.3 45.44 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 N-CA-C 109.927 -0.397 . . . . 1.0 109.927 178.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -143.62 167.51 26.61 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 111.056 -0.817 . . . . 1.0 111.056 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.47 -49.5 0.6 Allowed 'Trans proline' 0 C--N 1.308 -1.596 0 C-N-CA 122.688 2.259 . . . . 1.0 111.214 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1293 ' ' SER . . . . . . . . . . . . . 14.8 t -88.52 164.33 15.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.483 -0.781 . . . . 1.0 110.544 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 40.0 m80 -59.5 -11.35 4.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.315 -0.402 . . . . 1.0 110.416 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -67.14 143.28 56.71 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.544 -0.539 . . . . 1.0 109.544 179.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -127.73 149.01 50.42 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.141 0.496 . . . . 1.0 111.69 -178.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1297 ' ' THR . . . . . . . . . . . . . 88.8 m -121.72 122.0 38.56 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.461 -0.79 . . . . 1.0 109.064 178.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -94.34 126.11 39.39 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.189 0.518 . . . . 1.0 111.212 -179.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1299 ' ' THR . . . . . . . . . . . . . 91.1 m -127.24 130.63 49.98 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.765 -0.652 . . . . 1.0 110.17 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 55.4 t -120.84 130.39 74.67 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 N-CA-C 110.078 -0.341 . . . . 1.0 110.078 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -130.56 145.27 51.84 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.127 -0.488 . . . . 1.0 110.616 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 18.7 t -107.82 128.69 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 N-CA-C 109.432 -0.581 . . . . 1.0 109.432 179.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -106.96 137.65 44.62 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.469 -0.332 . . . . 1.0 110.989 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1304 ' ' PHE . . . . . 0.496 ' O ' ' N ' ' A' 1307 ' ' GLU . 50.6 t80 -139.34 119.33 13.45 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.334 -0.394 . . . . 1.0 110.168 179.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1305 ' ' LYS . . . . . 0.506 ' HZ3' ' NE2' ' A' 1336 ' ' GLN . 51.8 mttp 39.51 39.34 0.48 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.367 -0.379 . . . . 1.0 111.566 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 79.09 20.37 70.24 Favored Glycine 0 CA--C 1.528 0.852 0 C-N-CA 121.127 -0.559 . . . . 1.0 112.221 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1307 ' ' GLU . . . . . 0.496 ' N ' ' O ' ' A' 1304 ' ' PHE . 98.1 mt-10 -125.98 147.79 49.43 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.81 0.338 . . . . 1.0 110.309 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 57.1 ttp180 -91.59 126.15 36.58 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.039 -0.528 . . . . 1.0 110.106 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 45.0 pt -132.38 16.37 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-N 116.461 -0.336 . . . . 1.0 110.856 -179.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -157.47 151.63 22.89 Favored Glycine 0 CA--C 1.523 0.574 0 N-CA-C 111.084 -0.806 . . . . 1.0 111.084 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 30.3 p -173.6 138.5 0.67 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.725 0.298 . . . . 1.0 110.445 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . 179.27 162.01 27.75 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.979 -0.849 . . . . 1.0 110.979 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 59.8 mttp -141.93 142.66 33.03 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.735 0.302 . . . . 1.0 110.341 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -164.11 -178.87 37.97 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 110.701 -0.96 . . . . 1.0 110.701 179.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -63.65 -70.79 0.03 OUTLIER 'Trans proline' 0 C--N 1.311 -1.435 0 C-N-CA 121.689 1.593 . . . . 1.0 111.237 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1316 ' ' SER . . . . . 0.431 ' OG ' ' OE1' ' A' 1319 ' ' GLN . 4.9 p -90.06 171.57 9.45 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.049 -0.523 . . . . 1.0 110.402 179.437 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1317 ' ' ILE . . . . . 0.431 HG21 HD12 ' A' 1317 ' ' ILE . 39.2 mm -64.19 -42.99 97.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.821 -0.627 . . . . 1.0 110.413 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -53.2 -42.0 65.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.776 -0.647 . . . . 1.0 111.833 -178.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1319 ' ' GLN . . . . . 0.431 ' OE1' ' OG ' ' A' 1316 ' ' SER . 13.8 mp0 -67.3 -40.46 86.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.698 0.285 . . . . 1.0 110.459 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -65.69 -37.81 87.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.225 -0.443 . . . . 1.0 111.455 -179.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -65.92 -38.37 88.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.382 -0.372 . . . . 1.0 111.84 -178.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1322 ' ' MET . . . . . . . . . . . . . 61.6 mtt -62.3 -43.62 98.39 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.865 -0.334 . . . . 1.0 111.403 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -67.7 -40.2 90.16 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 111.634 -0.586 . . . . 1.0 111.634 -179.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -65.94 -38.78 89.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.678 0.275 . . . . 1.0 111.618 -179.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -65.82 -39.63 91.05 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.34 0.496 . . . . 1.0 112.34 -178.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1326 ' ' MET . . . . . . . . . . . . . 8.3 ttt -63.08 -38.83 92.76 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.76 -0.376 . . . . 1.0 110.824 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 56.7 m-20 -64.76 -31.93 73.38 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.203 -0.453 . . . . 1.0 110.645 -179.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1328 ' ' ALA . . . . . 0.545 ' O ' ' CD2' ' A' 1332 ' ' TYR . . . -57.31 -26.59 61.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.584 -0.28 . . . . 1.0 111.475 -179.137 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1329 ' ' LEU . . . . . 0.473 ' CD2' ' N ' ' A' 1329 ' ' LEU . 3.7 mm? -61.72 -41.95 98.3 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.84 -0.344 . . . . 1.0 110.946 -179.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -93.16 14.22 18.71 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 121.062 -0.255 . . . . 1.0 111.113 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 64.9 mttm -135.52 42.28 2.7 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 120.685 -0.406 . . . . 1.0 111.706 -178.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1332 ' ' TYR . . . . . 0.545 ' CD2' ' O ' ' A' 1328 ' ' ALA . 8.7 m-85 -108.7 145.5 34.94 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.303 0.573 . . . . 1.0 110.712 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 15.9 m120 -127.08 -176.07 3.61 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.209 -0.905 . . . . 1.0 109.404 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -41.26 141.04 1.13 Allowed Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 121.075 -0.25 . . . . 1.0 110.766 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -75.77 172.64 15.91 Favored 'Trans proline' 0 N--CA 1.498 1.739 0 C-N-CA 122.72 2.28 . . . . 1.0 112.245 179.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 1336 ' ' GLN . . . . . 0.506 ' NE2' ' HZ3' ' A' 1305 ' ' LYS . 14.0 mm100 . . . . . 0 C--N 1.331 -0.223 0 N-CA-C 109.782 -0.451 . . . . 1.0 109.782 179.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 98.8 mttt . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.915 0.388 . . . . 1.0 110.536 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A 1263 ' ' SER . . . . . . . . . . . . . 51.0 m -58.92 -36.88 75.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.134 -0.485 . . . . 1.0 110.616 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 14.3 mp0 -61.15 -42.68 98.99 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.819 -0.352 . . . . 1.0 110.265 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1265 ' ' LEU . . . . . 0.419 ' CD2' ' OH ' ' A' 1332 ' ' TYR . 83.4 mt -62.89 -41.52 99.44 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.742 -0.383 . . . . 1.0 110.031 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -63.82 -43.23 96.85 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.801 -0.36 . . . . 1.0 110.798 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -65.32 -39.52 92.56 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.854 0.359 . . . . 1.0 110.819 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1268 ' ' CYS . . . . . 0.445 ' O ' ' OG1' ' A' 1271 ' ' THR . 88.5 m -64.5 -37.36 87.26 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.016 -0.538 . . . . 1.0 111.178 -179.351 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 70.9 m -51.14 -41.38 60.06 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 120.55 -0.46 . . . . 1.0 110.865 -178.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1270 ' ' LEU . . . . . 0.493 ' CD2' ' N ' ' A' 1270 ' ' LEU . 3.6 mm? -64.39 -41.25 96.77 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.809 0.338 . . . . 1.0 110.801 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1271 ' ' THR . . . . . 0.445 ' OG1' ' O ' ' A' 1268 ' ' CYS . 48.0 p -66.56 -30.19 70.43 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.276 -0.42 . . . . 1.0 111.477 -179.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 92.5 mt -76.34 102.67 6.0 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.435 -0.506 . . . . 1.0 110.725 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 78.3 mtp85 -119.96 142.64 48.57 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.126 -0.488 . . . . 1.0 109.913 179.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1274 ' ' THR . . . . . . . . . . . . . 8.4 m -113.67 128.02 56.27 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 120.808 0.337 . . . . 1.0 110.188 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -129.54 112.06 13.37 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.408 -0.36 . . . . 1.0 110.861 -179.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 74.03 24.63 73.34 Favored Glycine 0 CA--C 1.527 0.823 0 CA-C-N 115.98 -0.555 . . . . 1.0 112.203 178.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 4.1 mtpp -136.58 -163.48 1.42 Allowed 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.335 0.588 . . . . 1.0 110.61 -179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -95.11 108.24 37.19 Favored Pre-proline 0 CA--C 1.541 0.623 0 CA-C-N 114.865 -1.061 . . . . 1.0 109.277 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1279 ' ' PRO . . . . . 0.437 ' O ' ' OD1' ' A' 1280 ' ' ASP . 50.4 Cg_exo -49.79 122.84 9.63 Favored 'Trans proline' 0 N--CA 1.494 1.524 0 C-N-CA 121.506 1.471 . . . . 1.0 112.657 -179.326 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1280 ' ' ASP . . . . . 0.437 ' OD1' ' O ' ' A' 1279 ' ' PRO . 96.0 m-20 -143.82 124.26 13.94 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.656 -0.702 . . . . 1.0 109.392 178.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 1.5 mp -137.77 135.57 19.09 Favored Pre-proline 0 CA--C 1.541 0.605 0 CA-C-N 116.242 -0.436 . . . . 1.0 110.424 -178.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -54.77 139.65 77.62 Favored 'Trans proline' 0 N--CA 1.496 1.64 0 CA-C-N 120.345 1.159 . . . . 1.0 111.213 178.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 87.4 mt -138.46 153.81 48.83 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.231 -0.44 . . . . 1.0 110.157 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1284 ' ' TYR . . . . . . . . . . . . . 81.9 m-85 -81.66 136.04 35.51 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.438 -0.346 . . . . 1.0 110.814 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 12.3 ttmm -138.83 126.02 21.42 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.204 -0.453 . . . . 1.0 109.869 178.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1286 ' ' THR . . . . . . . . . . . . . 92.3 m -99.15 125.7 44.76 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.967 0.413 . . . . 1.0 110.428 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 82.0 mt -77.54 -169.7 1.54 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.626 -0.716 . . . . 1.0 110.419 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -107.93 141.19 39.93 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.449 -0.341 . . . . 1.0 110.466 -179.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1289 ' ' THR . . . . . . . . . . . . . 16.9 p -87.84 114.47 24.49 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.082 -0.508 . . . . 1.0 110.858 -179.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 17.4 m -131.71 122.1 49.08 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-O 120.968 0.413 . . . . 1.0 110.38 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -144.52 157.71 27.3 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 110.569 -1.013 . . . . 1.0 110.569 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.74 -38.51 7.74 Favored 'Trans proline' 0 C--N 1.308 -1.563 0 C-N-CA 121.886 1.724 . . . . 1.0 110.691 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1293 ' ' SER . . . . . . . . . . . . . 26.7 t -92.74 165.22 13.05 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.503 -0.771 . . . . 1.0 110.211 179.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 78.9 m80 -57.61 -12.93 3.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.055 0.455 . . . . 1.0 109.839 179.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -63.37 145.16 56.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.805 -0.634 . . . . 1.0 110.554 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -128.41 140.13 52.0 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.03 0.443 . . . . 1.0 110.958 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1297 ' ' THR . . . . . . . . . . . . . 80.6 m -123.03 130.25 52.55 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.789 -0.642 . . . . 1.0 109.648 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 92.7 m-85 -100.07 131.46 46.01 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.148 0.499 . . . . 1.0 111.331 -178.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1299 ' ' THR . . . . . . . . . . . . . 90.1 m -127.42 131.91 50.18 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.61 -0.723 . . . . 1.0 110.017 179.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 55.8 t -118.42 129.48 74.66 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 109.963 -0.384 . . . . 1.0 109.963 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -129.69 144.42 51.28 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.09 -0.505 . . . . 1.0 110.589 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 24.3 t -111.61 128.24 68.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 N-CA-C 109.015 -0.735 . . . . 1.0 109.015 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -106.95 139.98 40.48 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.22 0.533 . . . . 1.0 111.622 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 75.5 t80 -140.99 106.64 5.1 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.429 -0.805 . . . . 1.0 110.118 179.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 55.6 mtpt 50.19 34.35 8.49 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.806 0.336 . . . . 1.0 110.736 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 83.81 18.71 62.95 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 121.343 -0.456 . . . . 1.0 111.994 179.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -121.68 144.07 48.98 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 109.887 -0.412 . . . . 1.0 109.887 179.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1308 ' ' ARG . . . . . 0.51 ' NE ' ' O ' ' A' 1310 ' ' GLY . 75.5 ttt180 -96.84 122.06 39.4 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.84 0.352 . . . . 1.0 110.144 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 35.4 pt -118.48 22.93 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-N 116.149 -0.478 . . . . 1.0 110.66 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1310 ' ' GLY . . . . . 0.51 ' O ' ' NE ' ' A' 1308 ' ' ARG . . . -159.38 153.99 25.05 Favored Glycine 0 CA--C 1.524 0.609 0 N-CA-C 110.659 -0.977 . . . . 1.0 110.659 179.833 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 8.7 p -174.17 121.42 0.29 Allowed 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.712 -0.395 . . . . 1.0 111.068 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -174.33 168.28 40.96 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.945 -0.862 . . . . 1.0 110.945 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 61.7 mttp -138.95 149.41 44.73 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.918 0.389 . . . . 1.0 110.607 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -169.06 167.74 40.69 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.438 -1.065 . . . . 1.0 110.438 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.67 -53.74 0.42 Allowed 'Trans proline' 0 C--N 1.307 -1.654 0 C-N-CA 122.449 2.099 . . . . 1.0 111.545 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1316 ' ' SER . . . . . . . . . . . . . 82.6 p -97.08 161.47 13.81 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.111 0.481 . . . . 1.0 110.98 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 40.3 mm -67.12 -42.6 88.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.655 -0.702 . . . . 1.0 111.317 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -53.06 -47.08 68.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.314 -0.403 . . . . 1.0 111.575 -178.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -67.29 -37.81 84.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.466 -0.333 . . . . 1.0 111.265 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -62.25 -37.5 85.69 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.251 -0.431 . . . . 1.0 111.202 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -67.15 -38.58 85.72 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.288 -0.415 . . . . 1.0 111.901 -179.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1322 ' ' MET . . . . . . . . . . . . . 57.2 mtt -61.59 -43.07 99.53 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.634 -0.426 . . . . 1.0 111.049 -179.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -63.92 -46.99 90.15 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.857 -0.897 . . . . 1.0 110.857 -179.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -65.14 -43.13 92.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.817 0.341 . . . . 1.0 110.561 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -68.29 -41.51 80.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.073 -0.512 . . . . 1.0 111.229 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1326 ' ' MET . . . . . . . . . . . . . 48.2 ttp -63.1 -43.68 97.81 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.011 0.434 . . . . 1.0 110.253 -179.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -68.9 -29.56 67.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.771 -0.65 . . . . 1.0 110.602 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1328 ' ' ALA . . . . . 0.53 ' O ' ' CD2' ' A' 1332 ' ' TYR . . . -59.63 -25.31 64.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.105 -0.498 . . . . 1.0 111.777 -178.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 96.2 mt -61.17 -41.52 96.93 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.943 -0.303 . . . . 1.0 110.967 -179.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -89.29 11.22 19.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.565 -0.289 . . . . 1.0 111.352 -178.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 64.1 mttm -129.52 40.69 3.56 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 112.084 0.402 . . . . 1.0 112.084 -178.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 1332 ' ' TYR . . . . . 0.53 ' CD2' ' O ' ' A' 1328 ' ' ALA . 16.0 m-85 -116.01 137.32 52.22 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 120.95 0.405 . . . . 1.0 110.298 179.202 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1333 ' ' ASN . . . . . 0.425 ' O ' ' C ' ' A' 1334 ' ' PHE . 97.1 m-20 -137.12 167.51 21.41 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.866 -0.607 . . . . 1.0 109.397 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1334 ' ' PHE . . . . . 0.425 ' C ' ' O ' ' A' 1333 ' ' ASN . 75.0 m-85 -30.68 94.06 0.06 OUTLIER Pre-proline 0 N--CA 1.47 0.532 0 O-C-N 123.518 0.511 . . . . 1.0 111.592 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1335 ' ' PRO . . . . . 0.436 ' O ' ' O ' ' A' 1336 ' ' GLN . 44.5 Cg_endo -91.4 -163.98 0.13 Allowed 'Trans proline' 0 N--CA 1.488 1.159 0 C-N-CA 122.942 2.428 . . . . 1.0 112.431 -179.086 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 1336 ' ' GLN . . . . . 0.436 ' O ' ' O ' ' A' 1335 ' ' PRO . 13.5 mm100 . . . . . 0 N--CA 1.465 0.305 0 CA-C-N 115.817 -0.629 . . . . 1.0 110.793 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1259 ' ' ASN . . . . . . . . . . . . . 94.9 m-20 . . . . . 0 N--CA 1.489 1.514 0 N-CA-C 109.461 -0.57 . . . . 1.0 109.461 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A 1260 ' ' ASP . . . . . 0.573 ' H ' ' CD ' ' A' 1261 ' ' PRO . 0.7 OUTLIER -172.71 -40.83 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.294 0 CA-C-N 116.286 -0.416 . . . . 1.0 110.946 179.557 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A 1261 ' ' PRO . . . . . 0.573 ' CD ' ' H ' ' A' 1260 ' ' ASP . 15.8 Cg_exo -67.41 153.97 75.21 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 C-N-CA 122.401 2.067 . . . . 1.0 111.782 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 34.6 tptt -60.92 138.56 58.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.01 0.433 . . . . 1.0 110.423 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1263 ' ' SER . . . . . . . . . . . . . 68.3 m -57.5 -41.39 80.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.706 -0.679 . . . . 1.0 111.112 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 25.0 mp0 -58.97 -43.99 91.46 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.703 -0.399 . . . . 1.0 110.209 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1265 ' ' LEU . . . . . 0.482 ' CD2' ' OH ' ' A' 1332 ' ' TYR . 36.9 mt -63.61 -41.95 98.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 1.0 110.505 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -63.46 -44.73 93.63 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.346 -0.388 . . . . 1.0 110.718 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -64.02 -39.76 94.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.127 -0.488 . . . . 1.0 110.689 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1268 ' ' CYS . . . . . 0.437 ' O ' ' OG1' ' A' 1271 ' ' THR . 98.3 m -64.92 -35.74 82.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.02 -0.536 . . . . 1.0 110.859 -179.522 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 79.1 m -60.44 -37.51 81.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.443 -0.344 . . . . 1.0 110.771 -179.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 89.1 mt -63.86 -39.31 93.9 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.214 -0.448 . . . . 1.0 111.106 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1271 ' ' THR . . . . . 0.437 ' OG1' ' O ' ' A' 1268 ' ' CYS . 68.7 p -65.06 -30.06 71.0 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.504 -0.316 . . . . 1.0 111.478 -179.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 77.6 mt -77.67 84.48 4.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.496 -0.32 . . . . 1.0 111.492 -178.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -119.74 130.09 54.81 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 110.139 -0.319 . . . . 1.0 110.139 178.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1274 ' ' THR . . . . . . . . . . . . . 21.4 m -129.65 133.4 47.09 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 120.773 0.32 . . . . 1.0 110.434 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 39.9 tp10 -111.54 142.72 43.47 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.356 -0.384 . . . . 1.0 110.202 179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 88.2 7.11 73.82 Favored Glycine 0 CA--C 1.527 0.815 0 N-CA-C 111.201 -0.76 . . . . 1.0 111.201 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 49.4 mtpt -138.63 -164.71 1.69 Allowed 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 110.239 -0.282 . . . . 1.0 110.239 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -92.43 151.05 41.01 Favored Pre-proline 0 CA--C 1.531 0.238 0 N-CA-C 109.87 -0.418 . . . . 1.0 109.87 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.09 76.13 1.29 Allowed 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.278 1.986 . . . . 1.0 112.22 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -90.83 121.5 32.75 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.815 -0.439 . . . . 1.0 109.815 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 13.1 mt -148.67 133.51 9.12 Favored Pre-proline 0 CA--C 1.535 0.398 0 N-CA-C 109.953 -0.388 . . . . 1.0 109.953 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.09 111.82 3.27 Favored 'Trans proline' 0 N--CA 1.495 1.597 0 C-N-CA 121.323 1.349 . . . . 1.0 111.514 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 89.5 mt -121.59 154.47 36.69 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.033 0.444 . . . . 1.0 110.867 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1284 ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -79.0 140.45 37.97 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.876 -0.602 . . . . 1.0 110.892 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 79.7 tttt -145.97 115.13 7.04 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.515 -0.766 . . . . 1.0 109.575 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 27.2 m -63.83 131.88 49.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.843 0.354 . . . . 1.0 110.686 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 72.8 mt -87.74 -172.2 3.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.046 -0.525 . . . . 1.0 110.302 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -107.67 137.61 45.39 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.285 -0.416 . . . . 1.0 110.052 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1289 ' ' THR . . . . . . . . . . . . . 19.0 p -75.49 115.95 15.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.095 -0.502 . . . . 1.0 111.286 -178.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 16.6 m -136.11 122.15 30.31 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-N 116.051 -0.522 . . . . 1.0 109.836 178.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.86 159.25 27.33 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 110.947 -0.861 . . . . 1.0 110.947 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -63.67 -38.91 37.71 Favored 'Trans proline' 0 C--N 1.308 -1.593 0 C-N-CA 122.371 2.047 . . . . 1.0 111.132 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1293 ' ' SER . . . . . . . . . . . . . 14.3 t -91.86 165.13 13.4 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.728 -0.669 . . . . 1.0 110.55 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -61.38 -9.5 5.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.172 0.511 . . . . 1.0 109.75 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -62.91 144.98 56.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.481 -0.782 . . . . 1.0 111.11 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -103.01 130.35 50.08 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.097 -0.501 . . . . 1.0 110.685 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1297 ' ' THR . . . . . . . . . . . . . 92.3 m -125.92 127.65 46.33 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.923 -0.58 . . . . 1.0 110.093 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -101.44 127.2 48.21 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.001 0.429 . . . . 1.0 110.819 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1299 ' ' THR . . . . . . . . . . . . . 64.0 m -127.56 130.56 49.3 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.86 -0.609 . . . . 1.0 110.313 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 54.3 t -116.77 128.0 74.26 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 N-CA-C 109.139 -0.689 . . . . 1.0 109.139 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -130.49 142.35 50.49 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.13 0.49 . . . . 1.0 111.657 -179.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 2.7 t -112.28 127.43 69.49 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 N-CA-C 108.801 -0.814 . . . . 1.0 108.801 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -115.98 139.54 50.15 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.146 0.498 . . . . 1.0 111.449 -178.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 52.7 t80 -128.38 102.31 6.59 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.6 -0.727 . . . . 1.0 110.212 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 64.4 mttp 47.01 36.58 4.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.108 -0.497 . . . . 1.0 111.05 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 90.99 4.34 69.22 Favored Glycine 0 CA--C 1.527 0.815 0 N-CA-C 111.946 -0.462 . . . . 1.0 111.946 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -110.05 119.77 40.36 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 120.992 0.425 . . . . 1.0 110.356 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 62.0 ttp180 -76.08 136.43 39.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.931 -0.577 . . . . 1.0 110.634 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 42.1 pt -138.56 20.17 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-N 116.36 -0.382 . . . . 1.0 110.169 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -151.03 148.35 19.37 Favored Glycine 0 CA--C 1.523 0.587 0 N-CA-C 111.062 -0.815 . . . . 1.0 111.062 -179.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 25.0 p -171.35 116.37 0.42 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.804 0.335 . . . . 1.0 110.185 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -175.57 131.05 1.83 Allowed Glycine 0 CA--C 1.523 0.583 0 N-CA-C 111.018 -0.833 . . . . 1.0 111.018 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 68.8 mttm -109.95 146.0 35.97 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.778 0.323 . . . . 1.0 110.373 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -167.16 173.2 42.36 Favored Glycine 0 CA--C 1.524 0.634 0 N-CA-C 111.139 -0.785 . . . . 1.0 111.139 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -69.41 -75.08 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.677 0 C-N-CA 122.592 2.195 . . . . 1.0 111.918 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1316 ' ' SER . . . . . . . . . . . . . 95.5 p -79.0 158.2 27.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.926 0.393 . . . . 1.0 110.943 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 47.5 mm -63.88 -44.66 98.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.0 -0.545 . . . . 1.0 111.209 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -54.48 -46.34 73.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.536 -0.302 . . . . 1.0 111.125 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -62.89 -38.77 92.24 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.842 -0.343 . . . . 1.0 110.865 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -64.63 -38.49 91.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.425 -0.352 . . . . 1.0 111.08 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -66.41 -36.46 82.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.299 -0.41 . . . . 1.0 111.404 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1322 ' ' MET . . . . . . . . . . . . . 95.1 mmm -62.74 -42.65 99.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.323 -0.399 . . . . 1.0 111.469 -179.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -66.7 -49.68 53.69 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 120.711 -0.757 . . . . 1.0 111.528 -179.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -70.27 -36.22 74.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.792 0.329 . . . . 1.0 111.534 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -56.01 -50.27 71.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.23 -0.441 . . . . 1.0 111.729 -178.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1326 ' ' MET . . . . . . . . . . . . . 66.4 mtt -65.57 -38.56 89.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.744 0.307 . . . . 1.0 111.484 -179.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -63.52 -36.98 85.58 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.348 -0.387 . . . . 1.0 111.549 -179.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1328 ' ' ALA . . . . . 0.524 ' O ' ' CD2' ' A' 1332 ' ' TYR . . . -58.69 -25.76 63.19 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.188 0.44 . . . . 1.0 112.188 -178.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 1.9 mm? -62.05 -41.45 98.14 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.679 -0.408 . . . . 1.0 111.148 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -93.62 4.57 53.75 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.142 0.423 . . . . 1.0 112.142 -178.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 67.5 mttm -117.7 20.65 13.35 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.269 0.47 . . . . 1.0 112.269 -178.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1332 ' ' TYR . . . . . 0.524 ' CD2' ' O ' ' A' 1328 ' ' ALA . 11.4 m-85 -83.54 137.76 33.71 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.122 0.487 . . . . 1.0 110.502 179.249 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -117.33 -175.98 2.91 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.521 -0.763 . . . . 1.0 110.17 179.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 53.8 m-85 -34.99 151.05 0.07 OUTLIER Pre-proline 0 CA--C 1.538 0.484 0 CA-C-N 115.977 -0.556 . . . . 1.0 111.115 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -69.61 -178.9 2.5 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 C-N-CA 122.419 2.079 . . . . 1.0 112.133 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1336 ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -38.1 100.83 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.175 0 CA-C-O 121.168 0.509 . . . . 1.0 111.205 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 1337 ' ' MET . . . . . . . . . . . . . 27.7 ttt . . . . . 0 C--O 1.219 -0.52 0 CA-C-O 117.978 -1.011 . . . . 1.0 110.56 -179.836 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A 1259 ' ' ASN . . . . . . . . . . . . . 24.7 m120 . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.481 -0.563 . . . . 1.0 109.481 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A 1260 ' ' ASP . . . . . 0.433 ' O ' ' OD1' ' A' 1260 ' ' ASP . 2.3 p30 41.75 59.23 9.5 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.025 -0.534 . . . . 1.0 111.037 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1261 ' ' PRO . . . . . 0.529 ' C ' ' H ' ' A' 1263 ' ' SER . 72.6 Cg_endo -72.99 141.3 32.86 Favored 'Trans proline' 0 C--N 1.308 -1.571 0 C-N-CA 122.575 2.184 . . . . 1.0 111.722 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 55.0 mtpt 47.38 9.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 1.0 111.156 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1263 ' ' SER . . . . . 0.529 ' H ' ' C ' ' A' 1261 ' ' PRO . 50.4 m -61.0 -42.66 98.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.891 0.376 . . . . 1.0 110.701 -179.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1264 ' ' GLN . . . . . 0.431 ' O ' ' SG ' ' A' 1268 ' ' CYS . 28.0 mm100 -65.08 -46.88 79.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.102 -0.499 . . . . 1.0 111.497 -179.451 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1265 ' ' LEU . . . . . 0.475 ' O ' ' SG ' ' A' 1269 ' ' CYS . 92.7 mt -64.66 -42.03 95.69 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.35 -0.386 . . . . 1.0 111.59 -179.256 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -64.9 -43.54 92.52 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.47 -0.492 . . . . 1.0 110.575 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 17.5 mm100 -68.19 -38.61 82.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.087 -0.506 . . . . 1.0 110.944 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1268 ' ' CYS . . . . . 0.44 ' O ' ' OG1' ' A' 1271 ' ' THR . 93.5 m -64.9 -36.48 84.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.45 -0.341 . . . . 1.0 111.047 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1269 ' ' CYS . . . . . 0.475 ' SG ' ' O ' ' A' 1265 ' ' LEU . 84.0 m -56.5 -36.69 69.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.753 0.311 . . . . 1.0 110.839 -179.393 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 97.2 mt -63.25 -40.87 98.64 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.329 -0.396 . . . . 1.0 111.042 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1271 ' ' THR . . . . . 0.44 ' OG1' ' O ' ' A' 1268 ' ' CYS . 68.3 p -67.76 -26.31 66.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.195 -0.457 . . . . 1.0 111.369 -179.345 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 82.2 mt -85.68 86.65 7.35 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.823 0.344 . . . . 1.0 111.382 -178.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -119.19 117.98 30.09 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.071 -0.513 . . . . 1.0 110.112 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1274 ' ' THR . . . . . 0.427 ' OG1' ' OE1' ' A' 1336 ' ' GLN . 6.8 m -129.04 131.24 47.32 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 120.844 0.355 . . . . 1.0 110.268 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -113.03 134.97 54.28 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.207 -0.451 . . . . 1.0 110.304 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 89.67 7.11 69.32 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 111.38 -0.688 . . . . 1.0 111.38 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 50.6 mtpt -138.41 -168.75 2.44 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.79 0.329 . . . . 1.0 110.613 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -93.38 136.02 24.77 Favored Pre-proline 0 CA--C 1.536 0.409 0 CA-C-N 116.11 -0.495 . . . . 1.0 110.104 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -76.49 87.74 1.42 Allowed 'Trans proline' 0 N--CA 1.493 1.461 0 C-N-CA 121.869 1.713 . . . . 1.0 112.353 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1280 ' ' ASP . . . . . 0.5 ' OD2' ' NZ ' ' A' 1305 ' ' LYS . 78.3 m-20 -86.49 124.39 32.76 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.726 -0.472 . . . . 1.0 109.726 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 2.5 mt -148.02 124.08 5.34 Favored Pre-proline 0 CA--C 1.54 0.579 0 N-CA-C 109.972 -0.381 . . . . 1.0 109.972 -179.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 45.0 Cg_exo -51.79 131.44 37.97 Favored 'Trans proline' 0 N--CA 1.494 1.501 0 CA-C-N 120.246 1.123 . . . . 1.0 111.828 179.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 55.6 mt -134.74 152.49 51.8 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.028 -0.533 . . . . 1.0 109.871 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1284 ' ' TYR . . . . . 0.465 ' CD1' ' OE1' ' A' 1321 ' ' GLU . 84.6 m-85 -78.46 137.8 38.14 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.043 0.449 . . . . 1.0 111.152 -179.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 85.7 tttt -139.01 104.81 5.13 Favored 'General case' 0 N--CA 1.462 0.175 0 N-CA-C 108.918 -0.771 . . . . 1.0 108.918 178.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 24.0 m -63.17 134.93 56.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.406 0.622 . . . . 1.0 112.174 -178.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 70.3 mt -87.0 -169.22 2.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.179 -0.919 . . . . 1.0 109.998 179.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -106.44 136.88 45.43 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 109.593 -0.521 . . . . 1.0 109.593 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1289 ' ' THR . . . . . . . . . . . . . 3.5 p -88.87 115.09 26.16 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.156 -0.475 . . . . 1.0 111.452 -178.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 7.1 m -133.55 123.56 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 121.034 0.445 . . . . 1.0 110.153 178.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.29 166.42 26.41 Favored Glycine 0 CA--C 1.524 0.644 0 N-CA-C 110.674 -0.97 . . . . 1.0 110.674 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -67.9 -42.89 5.73 Favored 'Trans proline' 0 C--N 1.306 -1.667 0 C-N-CA 122.467 2.112 . . . . 1.0 111.125 179.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1293 ' ' SER . . . . . 0.613 ' HG ' ' N ' ' A' 1294 ' ' HIS . 31.4 t -90.3 165.51 13.85 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.621 -0.718 . . . . 1.0 110.484 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1294 ' ' HIS . . . . . 0.613 ' N ' ' HG ' ' A' 1293 ' ' SER . 95.9 m-70 -58.11 -14.49 6.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.281 -0.418 . . . . 1.0 110.207 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -65.92 142.0 58.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.922 -0.581 . . . . 1.0 110.72 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -110.53 145.19 38.19 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.211 -0.45 . . . . 1.0 110.837 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1297 ' ' THR . . . . . . . . . . . . . 94.9 m -116.25 124.31 49.88 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.264 -0.643 . . . . 1.0 109.264 178.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -96.37 119.83 35.58 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.057 0.456 . . . . 1.0 110.786 -179.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1299 ' ' THR . . . . . 0.415 ' CG2' ' HZ2' ' A' 1313 ' ' LYS . 88.8 m -127.35 127.97 45.11 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.777 -0.647 . . . . 1.0 110.321 179.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 25.3 t -118.26 128.43 75.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 N-CA-C 109.58 -0.526 . . . . 1.0 109.58 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -130.69 148.7 52.51 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.3 -0.409 . . . . 1.0 110.228 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 3.0 t -105.91 125.95 61.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 N-CA-C 109.54 -0.541 . . . . 1.0 109.54 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -107.3 129.0 54.94 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.904 0.383 . . . . 1.0 110.878 -179.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 88.7 t80 -139.08 119.73 14.1 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 115.886 -0.597 . . . . 1.0 109.698 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1305 ' ' LYS . . . . . 0.5 ' NZ ' ' OD2' ' A' 1280 ' ' ASP . 72.7 mmtt 49.25 32.51 4.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.388 -0.369 . . . . 1.0 110.115 -179.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 78.35 21.48 69.89 Favored Glycine 0 CA--C 1.526 0.74 0 C-N-CA 121.076 -0.583 . . . . 1.0 111.816 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -121.08 130.86 53.94 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 116.987 0.393 . . . . 1.0 110.865 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 44.5 ttm180 -87.44 90.92 8.55 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.241 -0.651 . . . . 1.0 109.241 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 34.7 pt -81.35 -17.29 12.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 112.715 0.635 . . . . 1.0 112.715 -178.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -147.51 156.8 27.14 Favored Glycine 0 CA--C 1.525 0.669 0 C-N-CA 120.389 -0.91 . . . . 1.0 112.089 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 2.6 p -177.0 144.5 0.44 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.395 -0.403 . . . . 1.0 109.99 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -165.57 158.86 31.9 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 111.093 -0.803 . . . . 1.0 111.093 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1313 ' ' LYS . . . . . 0.415 ' HZ2' ' CG2' ' A' 1299 ' ' THR . 68.2 mttm -129.02 141.2 51.32 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.678 0.275 . . . . 1.0 110.269 179.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -164.33 -179.76 38.68 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.812 -0.915 . . . . 1.0 110.812 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -58.93 -59.82 0.42 Allowed 'Trans proline' 0 N--CA 1.494 1.521 0 C-N-CA 122.132 1.888 . . . . 1.0 112.017 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1316 ' ' SER . . . . . 0.443 ' OG ' ' OE1' ' A' 1319 ' ' GLN . 6.5 p -103.33 168.97 8.82 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.114 -0.494 . . . . 1.0 110.658 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 43.4 mt -67.05 -41.54 87.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.874 -0.603 . . . . 1.0 110.955 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -51.57 -41.41 61.12 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.463 -0.335 . . . . 1.0 111.215 -178.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1319 ' ' GLN . . . . . 0.443 ' OE1' ' OG ' ' A' 1316 ' ' SER . 7.3 mp0 -64.54 -39.77 94.36 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.753 -0.379 . . . . 1.0 110.052 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -65.88 -37.4 86.04 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.169 -0.469 . . . . 1.0 110.99 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1321 ' ' GLU . . . . . 0.465 ' OE1' ' CD1' ' A' 1284 ' ' TYR . 80.5 mm-40 -61.08 -50.22 74.16 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.452 -0.34 . . . . 1.0 110.862 -179.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1322 ' ' MET . . . . . . . . . . . . . 63.7 mtm -66.51 -38.95 88.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.137 -0.483 . . . . 1.0 111.553 -179.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -62.42 -48.28 83.29 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.891 -0.884 . . . . 1.0 110.891 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -66.12 -35.33 80.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.926 0.393 . . . . 1.0 110.601 179.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -57.69 -48.64 78.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.903 -0.589 . . . . 1.0 112.031 -179.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1326 ' ' MET . . . . . . . . . . . . . 93.8 mmm -63.67 -40.57 97.17 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.809 -0.356 . . . . 1.0 111.598 -179.014 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -67.7 -28.79 67.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.731 0.3 . . . . 1.0 111.173 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1328 ' ' ALA . . . . . . . . . . . . . . . -62.04 -35.45 78.63 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.414 0.524 . . . . 1.0 112.414 -178.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.93 -40.47 93.35 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 120.923 -0.311 . . . . 1.0 111.329 -178.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -75.09 15.07 0.45 Allowed 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.258 0.466 . . . . 1.0 112.258 -178.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 97.0 mttt -146.24 45.39 1.24 Allowed 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 113.061 0.763 . . . . 1.0 113.061 -178.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1332 ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -101.96 153.32 19.99 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.145 0.497 . . . . 1.0 110.342 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 9.1 m120 -127.74 -177.47 4.12 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.508 -0.769 . . . . 1.0 110.629 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 1334 ' ' PHE . . . . . 0.477 ' O ' ' O ' ' A' 1335 ' ' PRO . 61.7 m-85 -42.48 153.98 0.29 Allowed Pre-proline 0 CA--C 1.534 0.355 0 CA-C-N 115.815 -0.63 . . . . 1.0 110.662 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1335 ' ' PRO . . . . . 0.477 ' O ' ' O ' ' A' 1334 ' ' PHE . 77.3 Cg_exo -39.73 174.77 0.0 OUTLIER 'Trans proline' 0 N--CA 1.496 1.66 0 C-N-CA 122.826 2.351 . . . . 1.0 113.56 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1336 ' ' GLN . . . . . 0.427 ' OE1' ' OG1' ' A' 1274 ' ' THR . 11.2 mt-30 -36.89 117.49 0.51 Allowed 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.382 -0.826 . . . . 1.0 110.99 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 1337 ' ' MET . . . . . . . . . . . . . 27.3 ttt . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 117.989 -1.005 . . . . 1.0 110.677 -179.524 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A 1259 ' ' ASN . . . . . . . . . . . . . 54.5 t30 . . . . . 0 N--CA 1.491 1.62 0 N-CA-C 109.319 -0.622 . . . . 1.0 109.319 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A 1260 ' ' ASP . . . . . . . . . . . . . 47.1 t0 -173.07 63.62 0.3 Allowed Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.229 -0.441 . . . . 1.0 110.581 -179.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1261 ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.89 -95.14 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.591 0 C-N-CA 122.484 2.123 . . . . 1.0 112.366 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 87.7 mttt -92.01 1.99 56.84 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.975 0.417 . . . . 1.0 110.508 -179.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1263 ' ' SER . . . . . . . . . . . . . 35.9 m -59.16 -31.23 68.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.697 -0.683 . . . . 1.0 111.681 -179.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -56.75 -53.01 62.67 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.705 -0.398 . . . . 1.0 111.49 -178.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1265 ' ' LEU . . . . . 0.489 ' O ' ' SG ' ' A' 1269 ' ' CYS . 15.9 mt -67.87 -39.29 83.75 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.671 -0.411 . . . . 1.0 111.037 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -57.72 -43.9 85.61 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.543 -0.299 . . . . 1.0 111.175 -179.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -64.06 -42.48 97.0 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.502 -0.479 . . . . 1.0 110.522 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1268 ' ' CYS . . . . . . . . . . . . . 91.5 m -70.7 -36.59 73.33 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.176 -0.466 . . . . 1.0 110.936 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1269 ' ' CYS . . . . . 0.489 ' SG ' ' O ' ' A' 1265 ' ' LEU . 87.9 m -62.43 -35.23 78.62 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.092 -0.503 . . . . 1.0 112.018 -178.724 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 81.5 mt -61.96 -39.43 92.11 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.889 -0.324 . . . . 1.0 110.738 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1271 ' ' THR . . . . . . . . . . . . . 58.0 p -65.36 -29.19 69.89 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.969 -0.292 . . . . 1.0 111.15 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 87.2 mt -74.66 86.88 2.15 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.798 -0.361 . . . . 1.0 110.59 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 100.0 mtt180 -118.41 116.04 25.89 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.269 -0.423 . . . . 1.0 110.131 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1274 ' ' THR . . . . . . . . . . . . . 3.0 m -124.28 124.64 42.85 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.875 0.369 . . . . 1.0 110.162 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -112.71 138.18 49.91 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.024 -0.535 . . . . 1.0 110.194 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 90.38 0.62 76.23 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.677 -0.969 . . . . 1.0 110.677 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 21.5 mtpp -135.31 -167.5 2.02 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.11 0.481 . . . . 1.0 110.589 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -94.28 130.17 34.83 Favored Pre-proline 0 CA--C 1.536 0.423 0 CA-C-N 115.713 -0.676 . . . . 1.0 109.606 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -78.15 110.24 2.84 Favored 'Trans proline' 0 N--CA 1.493 1.466 0 C-N-CA 121.798 1.666 . . . . 1.0 112.683 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -104.24 129.73 52.04 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.887 -0.597 . . . . 1.0 109.584 178.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 4.8 mt -147.31 121.95 5.14 Favored Pre-proline 0 CA--C 1.54 0.571 0 CA-C-O 119.303 -0.38 . . . . 1.0 110.308 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -56.27 141.89 88.13 Favored 'Trans proline' 0 N--CA 1.494 1.532 0 CA-C-N 120.337 1.156 . . . . 1.0 111.129 178.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 89.9 mt -139.12 160.67 39.24 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.724 0.297 . . . . 1.0 110.393 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1284 ' ' TYR . . . . . 0.531 ' CD1' ' OE1' ' A' 1321 ' ' GLU . 62.8 m-85 -78.52 139.73 38.62 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.123 0.487 . . . . 1.0 111.46 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -151.34 107.56 3.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.588 -0.733 . . . . 1.0 109.998 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 18.5 m -74.78 140.59 44.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.11 0.481 . . . . 1.0 111.063 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 73.3 mt -81.73 -169.93 2.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.637 -0.711 . . . . 1.0 110.672 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -107.08 136.4 47.0 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.9 -0.591 . . . . 1.0 109.561 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1289 ' ' THR . . . . . . . . . . . . . 57.3 p -83.27 115.05 21.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.982 0.42 . . . . 1.0 111.701 -178.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 9.4 m -143.9 122.19 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 115.682 -0.69 . . . . 1.0 109.449 178.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.46 172.37 24.33 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 111.113 -0.795 . . . . 1.0 111.113 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -72.14 -46.49 0.52 Allowed 'Trans proline' 0 C--N 1.307 -1.646 0 C-N-CA 122.494 2.129 . . . . 1.0 111.143 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1293 ' ' SER . . . . . . . . . . . . . 11.3 t -89.85 165.34 14.18 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.656 -0.702 . . . . 1.0 110.046 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 28.2 m170 -59.73 -18.96 46.9 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.621 -0.511 . . . . 1.0 109.621 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -59.76 144.15 49.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.812 -0.631 . . . . 1.0 109.963 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 85.2 mtm-85 -117.54 143.51 46.01 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.014 0.435 . . . . 1.0 111.038 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1297 ' ' THR . . . . . . . . . . . . . 91.8 m -120.17 127.28 52.33 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.734 -0.666 . . . . 1.0 109.808 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -99.82 116.41 31.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.026 0.441 . . . . 1.0 110.721 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1299 ' ' THR . . . . . 0.642 ' HG1' ' NZ ' ' A' 1313 ' ' LYS . 91.8 m -127.11 130.31 49.6 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.743 -0.662 . . . . 1.0 110.092 179.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 83.2 t -111.44 129.86 66.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 N-CA-C 109.734 -0.469 . . . . 1.0 109.734 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -129.25 140.91 51.28 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.077 0.465 . . . . 1.0 110.93 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 43.7 t -113.25 128.36 70.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 N-CA-C 108.65 -0.87 . . . . 1.0 108.65 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -113.66 141.37 47.31 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.029 0.443 . . . . 1.0 110.934 -178.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 79.1 t80 -149.43 109.08 4.02 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.593 -0.731 . . . . 1.0 110.159 -179.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 49.87 30.07 3.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.281 -0.418 . . . . 1.0 110.808 179.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 86.04 1.97 86.33 Favored Glycine 0 CA--C 1.525 0.69 0 C-N-CA 121.317 -0.468 . . . . 1.0 112.06 178.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -106.5 115.95 31.09 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 110.132 -0.322 . . . . 1.0 110.132 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -72.52 130.16 40.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.466 . . . . 1.0 110.302 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 30.5 pt -122.46 23.23 4.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-N 116.484 -0.325 . . . . 1.0 110.906 -179.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -155.96 153.28 24.62 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 111.354 -0.699 . . . . 1.0 111.354 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1311 ' ' CYS . . . . . 0.412 ' SG ' ' OD2' ' A' 1327 ' ' ASP . 31.3 p -167.65 164.23 14.51 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.21 -0.293 . . . . 1.0 110.21 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . 121.92 157.64 10.07 Favored Glycine 0 N--CA 1.468 0.801 0 N-CA-C 110.939 -0.864 . . . . 1.0 110.939 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1313 ' ' LYS . . . . . 0.642 ' NZ ' ' HG1' ' A' 1299 ' ' THR . 68.6 mttm -129.61 151.3 50.37 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.93 0.395 . . . . 1.0 110.758 -179.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -159.49 163.72 33.64 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 110.434 -1.067 . . . . 1.0 110.434 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -64.58 -67.13 0.04 OUTLIER 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 122.408 2.072 . . . . 1.0 111.697 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1316 ' ' SER . . . . . . . . . . . . . 13.6 p -83.89 164.27 19.53 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.361 -0.381 . . . . 1.0 110.328 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 36.7 mm -65.29 -44.31 94.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.12 -0.491 . . . . 1.0 110.836 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -55.36 -42.99 74.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.085 -0.507 . . . . 1.0 111.712 -178.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -60.01 -41.75 92.83 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.593 -0.443 . . . . 1.0 110.708 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -68.55 -37.76 80.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.307 -0.406 . . . . 1.0 110.998 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1321 ' ' GLU . . . . . 0.531 ' OE1' ' CD1' ' A' 1284 ' ' TYR . 64.8 mm-40 -61.58 -45.35 94.51 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.305 -0.407 . . . . 1.0 111.821 -179.11 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1322 ' ' MET . . . . . 0.579 ' N ' ' SD ' ' A' 1322 ' ' MET . 0.1 OUTLIER -64.2 -41.08 97.23 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.805 -0.358 . . . . 1.0 111.366 -179.259 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -64.97 -43.39 95.98 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 120.799 -0.715 . . . . 1.0 111.847 -179.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -66.35 -38.21 87.08 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.737 0.273 . . . . 1.0 111.737 -179.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -61.03 -42.69 98.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.477 -0.328 . . . . 1.0 111.862 -178.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1326 ' ' MET . . . . . . . . . . . . . 2.0 tpt -62.74 -41.83 99.37 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.471 -0.492 . . . . 1.0 110.064 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1327 ' ' ASP . . . . . 0.412 ' OD2' ' SG ' ' A' 1311 ' ' CYS . 64.7 m-20 -65.04 -34.7 79.05 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.965 -0.561 . . . . 1.0 110.544 -179.383 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1328 ' ' ALA . . . . . 0.499 ' O ' ' CD2' ' A' 1332 ' ' TYR . . . -58.83 -23.75 61.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.307 -0.406 . . . . 1.0 111.45 -179.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 92.6 mt -62.48 -42.48 99.52 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.727 -0.389 . . . . 1.0 110.838 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -95.11 23.98 5.27 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.357 -0.383 . . . . 1.0 111.955 -178.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 97.3 mttt -137.82 42.55 2.29 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 120.697 -0.401 . . . . 1.0 111.072 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1332 ' ' TYR . . . . . 0.499 ' CD2' ' O ' ' A' 1328 ' ' ALA . 14.0 m-85 -115.15 145.98 41.83 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.285 0.564 . . . . 1.0 110.977 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -117.76 -176.71 3.09 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.368 -0.833 . . . . 1.0 108.819 178.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -41.8 148.7 0.44 Allowed Pre-proline 0 CA--C 1.536 0.405 0 C-N-CA 120.711 -0.396 . . . . 1.0 110.475 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -68.46 154.63 71.4 Favored 'Trans proline' 0 N--CA 1.497 1.72 0 C-N-CA 122.292 1.995 . . . . 1.0 111.763 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1336 ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -43.43 114.96 0.7 Allowed 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 120.772 0.32 . . . . 1.0 110.26 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1337 ' ' MET . . . . . . . . . . . . . 94.8 mmm . . . . . 0 C--O 1.22 -0.486 0 CA-C-O 117.78 -1.105 . . . . 1.0 110.652 -179.308 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A 1259 ' ' ASN . . . . . 0.435 ' O ' ' OG ' ' A' 1263 ' ' SER . 61.1 t30 . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.504 -0.554 . . . . 1.0 109.504 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1260 ' ' ASP . . . . . 0.577 ' N ' ' CD ' ' A' 1261 ' ' PRO . 0.2 OUTLIER -104.45 -43.27 0.17 Allowed Pre-proline 0 CA--C 1.537 0.471 0 CA-C-N 116.36 -0.382 . . . . 1.0 110.612 -179.773 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A 1261 ' ' PRO . . . . . 0.577 ' CD ' ' N ' ' A' 1260 ' ' ASP . 45.0 Cg_exo -55.59 -37.87 94.74 Favored 'Trans proline' 0 N--CA 1.499 1.812 0 C-N-CA 122.481 2.121 . . . . 1.0 112.727 -179.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 56.8 mttp -94.04 -8.03 41.0 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.428 -0.351 . . . . 1.0 111.731 -178.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1263 ' ' SER . . . . . 0.435 ' OG ' ' O ' ' A' 1259 ' ' ASN . 64.8 m -52.09 -39.86 60.39 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.532 -0.467 . . . . 1.0 110.807 -179.398 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -63.26 -47.89 80.49 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.878 0.37 . . . . 1.0 110.495 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1265 ' ' LEU . . . . . . . . . . . . . 88.2 mt -65.71 -39.76 91.54 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.114 -0.494 . . . . 1.0 111.413 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -54.1 -40.27 67.14 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 121.043 -0.263 . . . . 1.0 111.007 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -62.95 -42.41 99.81 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.728 -0.389 . . . . 1.0 110.425 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1268 ' ' CYS . . . . . 0.43 ' O ' ' OG1' ' A' 1271 ' ' THR . 90.4 m -66.28 -37.2 84.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.296 -0.411 . . . . 1.0 110.747 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 99.8 m -59.18 -35.38 73.48 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.261 -0.427 . . . . 1.0 110.964 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 86.2 mt -62.61 -40.89 98.38 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.335 -0.393 . . . . 1.0 110.991 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1271 ' ' THR . . . . . 0.43 ' OG1' ' O ' ' A' 1268 ' ' CYS . 74.3 p -65.68 -31.68 72.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.339 -0.391 . . . . 1.0 111.562 -179.131 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 72.1 mt -74.28 83.69 1.89 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.599 -0.44 . . . . 1.0 110.578 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 7.3 mmp_? -119.51 110.76 17.27 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.244 -0.435 . . . . 1.0 110.842 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1274 ' ' THR . . . . . . . . . . . . . 21.6 m -129.29 129.89 45.46 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 109.94 -0.393 . . . . 1.0 109.94 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -112.42 136.52 51.81 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.937 0.399 . . . . 1.0 110.705 -179.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 88.37 8.27 71.41 Favored Glycine 0 CA--C 1.526 0.747 0 CA-C-N 116.06 -0.518 . . . . 1.0 111.894 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 50.4 mtpt -138.91 -172.27 3.28 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.212 0.529 . . . . 1.0 111.113 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -94.5 108.95 40.29 Favored Pre-proline 0 CA--C 1.537 0.47 0 CA-C-N 115.275 -0.875 . . . . 1.0 109.41 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -80.97 92.95 1.03 Allowed 'Trans proline' 0 N--CA 1.491 1.33 0 C-N-CA 121.769 1.646 . . . . 1.0 112.476 -179.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -80.94 141.43 34.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.163 -0.471 . . . . 1.0 109.742 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 10.5 mt -141.51 133.0 13.48 Favored Pre-proline 0 CA--C 1.536 0.417 0 N-CA-C 110.066 -0.346 . . . . 1.0 110.066 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -76.12 120.0 5.54 Favored 'Trans proline' 0 N--CA 1.491 1.342 0 C-N-CA 121.538 1.492 . . . . 1.0 111.466 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 11.0 mp -106.11 153.22 22.39 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.147 -0.479 . . . . 1.0 109.759 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1284 ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -77.14 141.26 40.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.289 0.566 . . . . 1.0 111.042 -179.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 64.3 tttm -136.57 124.89 23.27 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.313 -0.858 . . . . 1.0 109.471 179.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 59.3 m -85.65 129.87 34.71 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.918 0.389 . . . . 1.0 111.087 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 77.2 mt -82.95 -170.49 3.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.919 -0.582 . . . . 1.0 110.128 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -107.99 152.73 24.08 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.097 -0.502 . . . . 1.0 109.909 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1289 ' ' THR . . . . . . . . . . . . . 73.3 p -86.53 113.21 22.25 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.896 0.379 . . . . 1.0 111.427 -179.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 3.4 m -149.43 122.57 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.916 -0.584 . . . . 1.0 109.915 178.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -141.85 166.85 26.14 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.123 -0.791 . . . . 1.0 111.123 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -63.27 -47.22 8.29 Favored 'Trans proline' 0 C--N 1.307 -1.609 0 C-N-CA 122.761 2.308 . . . . 1.0 111.077 179.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1293 ' ' SER . . . . . . . . . . . . . 31.2 t -85.49 165.36 17.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.537 -0.756 . . . . 1.0 110.416 179.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 17.9 m170 -59.45 -14.91 14.21 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.876 -0.416 . . . . 1.0 109.876 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -65.33 144.49 57.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.835 -0.62 . . . . 1.0 111.317 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -105.67 136.46 45.24 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.059 -0.519 . . . . 1.0 110.409 179.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1297 ' ' THR . . . . . . . . . . . . . 55.5 m -124.33 127.91 48.31 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 109.871 -0.418 . . . . 1.0 109.871 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -96.95 123.5 40.69 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.928 0.395 . . . . 1.0 110.251 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1299 ' ' THR . . . . . . . . . . . . . 99.6 m -126.76 130.5 50.44 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.012 -0.54 . . . . 1.0 110.722 -179.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 56.5 t -117.59 129.88 73.35 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.19 0 N-CA-C 109.076 -0.713 . . . . 1.0 109.076 179.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -129.01 147.73 50.9 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.146 0.498 . . . . 1.0 111.104 -179.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 29.5 t -114.16 129.84 69.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.555 -0.748 . . . . 1.0 109.055 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -113.59 141.44 47.17 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.212 0.53 . . . . 1.0 111.825 -178.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1304 ' ' PHE . . . . . 0.618 ' CE1' ' NE2' ' A' 1336 ' ' GLN . 80.1 t80 -137.58 100.58 4.25 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.242 -0.89 . . . . 1.0 109.355 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 50.7 mtmt 43.75 39.81 2.71 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.233 -0.439 . . . . 1.0 110.883 -178.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 88.53 6.37 73.7 Favored Glycine 0 CA--C 1.528 0.902 0 CA-C-N 116.266 -0.425 . . . . 1.0 112.361 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -112.45 121.47 44.92 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.854 0.359 . . . . 1.0 110.288 179.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 37.5 ttm180 -80.37 134.24 36.01 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.126 -0.488 . . . . 1.0 110.699 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 36.2 pt -131.25 9.71 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-N 116.152 -0.476 . . . . 1.0 110.442 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -159.27 151.7 22.6 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.897 -0.881 . . . . 1.0 110.897 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 9.2 t -170.8 47.1 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.76 0.314 . . . . 1.0 110.723 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -75.77 149.61 38.4 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 111.231 -0.748 . . . . 1.0 111.231 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -136.2 149.14 48.44 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 110.137 -0.32 . . . . 1.0 110.137 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -177.94 163.47 31.74 Favored Glycine 0 CA--C 1.53 1.018 0 N-CA-C 110.663 -0.975 . . . . 1.0 110.663 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -53.7 -45.8 38.4 Favored 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 121.551 1.501 . . . . 1.0 112.16 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1316 ' ' SER . . . . . . . . . . . . . 91.1 p -105.32 161.99 13.82 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.005 0.431 . . . . 1.0 111.189 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 46.2 mm -64.97 -44.7 96.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.712 -0.677 . . . . 1.0 110.9 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -55.75 -44.04 77.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.146 -0.479 . . . . 1.0 111.124 -178.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -66.77 -39.38 87.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.509 -0.314 . . . . 1.0 110.881 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -65.21 -39.68 93.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 1.0 111.405 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -66.8 -35.54 80.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.588 -0.278 . . . . 1.0 111.291 -179.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1322 ' ' MET . . . . . . . . . . . . . 59.7 mtt -62.38 -42.17 99.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.515 -0.311 . . . . 1.0 110.769 -179.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -67.35 -43.32 88.38 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 111.196 -0.762 . . . . 1.0 111.196 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -67.48 -39.47 85.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.725 0.298 . . . . 1.0 111.31 -179.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -64.66 -41.22 96.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.438 -0.346 . . . . 1.0 111.599 -179.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1326 ' ' MET . . . . . . . . . . . . . 22.3 tpp -61.37 -48.56 80.72 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.87 -0.332 . . . . 1.0 110.436 -179.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -65.49 -37.46 86.87 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.998 -0.546 . . . . 1.0 111.186 -179.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1328 ' ' ALA . . . . . 0.531 ' O ' ' CD2' ' A' 1332 ' ' TYR . . . -56.47 -25.05 49.83 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 111.973 0.361 . . . . 1.0 111.973 -178.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 78.3 mt -62.61 -42.23 99.46 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.98 0.363 . . . . 1.0 111.98 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -95.19 23.89 5.4 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 111.994 0.368 . . . . 1.0 111.994 -178.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -132.44 34.46 3.72 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 121.197 -0.201 . . . . 1.0 110.973 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1332 ' ' TYR . . . . . 0.531 ' CD2' ' O ' ' A' 1328 ' ' ALA . 29.2 m-85 -111.5 139.38 46.98 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.325 0.583 . . . . 1.0 110.956 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1333 ' ' ASN . . . . . 0.451 ' O ' ' O ' ' A' 1334 ' ' PHE . 11.4 m120 -102.78 -175.46 2.82 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 115.141 -0.936 . . . . 1.0 110.187 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1334 ' ' PHE . . . . . 0.451 ' O ' ' O ' ' A' 1333 ' ' ASN . 0.5 OUTLIER -49.27 -179.56 0.03 OUTLIER Pre-proline 0 CA--C 1.539 0.542 0 N-CA-C 109.024 -0.732 . . . . 1.0 109.024 179.408 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -59.34 145.11 98.88 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 121.704 1.603 . . . . 1.0 111.693 -179.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1336 ' ' GLN . . . . . 0.618 ' NE2' ' CE1' ' A' 1304 ' ' PHE . 1.3 mm100 -63.05 125.99 25.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.056 -0.52 . . . . 1.0 110.53 -179.293 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 1337 ' ' MET . . . . . . . . . . . . . 98.7 mtp . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.971 -1.014 . . . . 1.0 110.406 -179.935 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A 1259 ' ' ASN . . . . . . . . . . . . . 56.4 m-20 . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.003 -0.74 . . . . 1.0 109.003 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A 1260 ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -177.02 74.28 0.24 Allowed Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.422 -0.354 . . . . 1.0 110.824 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1261 ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -53.33 -41.12 75.17 Favored 'Trans proline' 0 C--N 1.307 -1.657 0 C-N-CA 122.645 2.23 . . . . 1.0 112.104 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 18.7 pttp -162.29 31.69 0.11 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.303 -0.408 . . . . 1.0 110.773 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1263 ' ' SER . . . . . . . . . . . . . 58.2 m -61.13 -32.13 71.83 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.133 -0.485 . . . . 1.0 110.623 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1264 ' ' GLN . . . . . 0.507 ' O ' ' SG ' ' A' 1268 ' ' CYS . 28.3 mp0 -57.04 -49.55 75.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.22 -0.446 . . . . 1.0 110.986 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1265 ' ' LEU . . . . . 0.466 ' O ' ' SG ' ' A' 1269 ' ' CYS . 34.4 mt -63.39 -40.6 97.67 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.762 -0.375 . . . . 1.0 110.605 179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -63.71 -45.45 89.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.352 -0.386 . . . . 1.0 110.789 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -70.51 -39.61 74.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.447 -0.342 . . . . 1.0 111.236 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1268 ' ' CYS . . . . . 0.507 ' SG ' ' O ' ' A' 1264 ' ' GLN . 89.2 m -60.93 -35.57 77.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.46 -0.336 . . . . 1.0 111.376 -179.317 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1269 ' ' CYS . . . . . 0.466 ' SG ' ' O ' ' A' 1265 ' ' LEU . 83.9 m -54.71 -37.95 66.46 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.864 -0.335 . . . . 1.0 111.005 -179.434 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1270 ' ' LEU . . . . . 0.45 ' CD2' ' N ' ' A' 1270 ' ' LEU . 3.6 mm? -64.89 -39.86 94.2 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.931 -0.308 . . . . 1.0 111.07 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1271 ' ' THR . . . . . 0.441 ' OG1' ' O ' ' A' 1268 ' ' CYS . 76.6 p -66.06 -31.11 71.79 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.979 0.363 . . . . 1.0 111.979 -178.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 60.4 mt -81.09 89.54 5.98 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 120.626 -0.43 . . . . 1.0 110.83 -179.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -119.19 151.76 37.79 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.088 -0.506 . . . . 1.0 110.57 179.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1274 ' ' THR . . . . . . . . . . . . . 1.3 m -126.91 162.03 26.91 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 109.866 -0.42 . . . . 1.0 109.866 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1275 ' ' GLU . . . . . 0.586 ' C ' ' H ' ' A' 1277 ' ' LYS . 79.0 tt0 -87.97 100.18 12.71 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 112.273 0.472 . . . . 1.0 112.273 -178.603 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 57.83 -13.97 0.02 OUTLIER Glycine 0 CA--C 1.529 0.92 0 CA-C-N 115.729 -0.669 . . . . 1.0 113.353 178.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1277 ' ' LYS . . . . . 0.586 ' H ' ' C ' ' A' 1275 ' ' GLU . 48.9 mtpt -79.17 -166.25 0.9 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 117.694 0.747 . . . . 1.0 110.474 -179.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -93.45 110.14 44.96 Favored Pre-proline 0 CA--C 1.538 0.5 0 CA-C-N 116.039 -0.528 . . . . 1.0 109.813 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -80.65 114.85 3.03 Favored 'Trans proline' 0 N--CA 1.492 1.403 0 C-N-CA 121.867 1.712 . . . . 1.0 112.171 -179.099 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1280 ' ' ASP . . . . . 0.524 ' OD2' ' NZ ' ' A' 1305 ' ' LYS . 66.0 m-20 -83.82 133.54 34.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.001 -0.545 . . . . 1.0 109.982 179.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 1.8 mt -144.76 127.89 8.51 Favored Pre-proline 0 CA--C 1.538 0.501 0 CA-C-O 118.991 -0.528 . . . . 1.0 110.138 -179.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 43.3 Cg_exo -52.95 135.57 58.62 Favored 'Trans proline' 0 N--CA 1.493 1.469 0 CA-C-N 120.482 1.208 . . . . 1.0 111.31 177.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 80.5 mt -122.32 152.63 39.91 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 109.596 -0.52 . . . . 1.0 109.596 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1284 ' ' TYR . . . . . 0.434 ' HH ' ' CB ' ' A' 1265 ' ' LEU . 94.5 m-85 -81.1 136.41 35.92 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.95 0.405 . . . . 1.0 110.914 -179.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 62.9 tttm -141.17 113.74 8.22 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.922 -0.581 . . . . 1.0 109.92 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 97.3 m -92.14 127.05 37.47 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.321 -0.399 . . . . 1.0 110.87 -179.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 60.0 mt -74.91 -172.45 1.61 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.276 -0.42 . . . . 1.0 109.948 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -108.13 126.01 52.27 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 120.84 0.352 . . . . 1.0 110.205 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1289 ' ' THR . . . . . . . . . . . . . 18.0 p -62.55 122.56 16.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.052 -0.522 . . . . 1.0 111.392 -179.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 15.8 m -153.25 122.62 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.809 -0.632 . . . . 1.0 109.773 178.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.01 166.67 26.25 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 111.039 -0.824 . . . . 1.0 111.039 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -66.03 -43.46 9.05 Favored 'Trans proline' 0 C--N 1.307 -1.638 0 C-N-CA 122.636 2.224 . . . . 1.0 110.852 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1293 ' ' SER . . . . . . . . . . . . . 30.3 t -89.97 165.26 14.17 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.394 -0.821 . . . . 1.0 110.126 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 71.0 m80 -59.11 -15.37 13.8 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.915 -0.402 . . . . 1.0 109.915 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -63.88 138.66 58.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.929 -0.578 . . . . 1.0 110.783 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 83.5 mtm-85 -101.87 142.41 33.23 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.193 -0.458 . . . . 1.0 110.766 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1297 ' ' THR . . . . . . . . . . . . . 94.6 m -118.73 124.33 47.04 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.958 -0.565 . . . . 1.0 109.8 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -98.51 116.03 29.86 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.362 -0.381 . . . . 1.0 110.491 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1299 ' ' THR . . . . . . . . . . . . . 91.0 m -126.88 132.39 50.93 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.115 -0.493 . . . . 1.0 110.598 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 75.4 t -121.57 131.37 73.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 N-CA-C 109.532 -0.544 . . . . 1.0 109.532 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -129.79 143.74 50.96 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.005 0.431 . . . . 1.0 110.551 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 58.0 t -109.67 129.38 64.64 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 CA-C-N 116.044 -0.526 . . . . 1.0 109.629 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -105.11 133.89 49.14 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.001 0.429 . . . . 1.0 111.332 -179.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 87.7 t80 -147.92 110.37 4.66 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.842 -0.617 . . . . 1.0 110.354 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1305 ' ' LYS . . . . . 0.524 ' NZ ' ' OD2' ' A' 1280 ' ' ASP . 72.4 mmtt 54.58 31.19 14.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.313 -0.403 . . . . 1.0 110.647 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 78.93 6.36 88.71 Favored Glycine 0 CA--C 1.523 0.584 0 N-CA-C 111.068 -0.813 . . . . 1.0 111.068 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -112.11 117.06 31.57 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 109.975 -0.38 . . . . 1.0 109.975 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 42.3 ttm180 -73.37 128.24 34.92 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.732 -0.47 . . . . 1.0 109.732 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 24.3 pt -118.28 19.73 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-N 116.155 -0.475 . . . . 1.0 111.656 -178.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -161.54 147.3 13.57 Favored Glycine 0 CA--C 1.524 0.652 0 C-N-CA 120.499 -0.858 . . . . 1.0 111.418 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 44.9 t -171.11 126.77 0.68 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.719 0.295 . . . . 1.0 110.428 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -177.32 176.15 47.93 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 110.944 -0.862 . . . . 1.0 110.944 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 65.2 mttp -142.39 149.41 39.31 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.804 0.335 . . . . 1.0 110.413 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -164.96 168.5 39.18 Favored Glycine 0 CA--C 1.529 0.949 0 N-CA-C 110.635 -0.986 . . . . 1.0 110.635 179.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -53.92 -69.13 0.06 OUTLIER 'Trans proline' 0 N--CA 1.494 1.516 0 C-N-CA 121.602 1.535 . . . . 1.0 111.878 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1316 ' ' SER . . . . . . . . . . . . . 8.2 p -90.32 169.18 11.31 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.079 -0.509 . . . . 1.0 111.07 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1317 ' ' ILE . . . . . 0.41 HG21 HD11 ' A' 1317 ' ' ILE . 47.5 mm -63.9 -43.89 97.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.893 -0.594 . . . . 1.0 110.353 179.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 93.9 mm-40 -53.8 -40.79 66.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 1.0 110.967 -179.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -61.36 -42.39 98.62 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.392 -0.367 . . . . 1.0 110.621 -179.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -67.37 -37.68 83.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.25 -0.432 . . . . 1.0 110.991 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -64.84 -43.31 93.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.106 -0.497 . . . . 1.0 111.526 -179.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1322 ' ' MET . . . . . . . . . . . . . 78.2 mtm -64.52 -39.28 93.49 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.782 -0.367 . . . . 1.0 111.406 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -63.31 -48.36 79.76 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 111.037 -0.825 . . . . 1.0 111.037 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -69.92 -35.75 74.81 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.785 0.326 . . . . 1.0 111.083 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -59.71 -49.76 76.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.075 -0.511 . . . . 1.0 111.918 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1326 ' ' MET . . . . . . . . . . . . . 87.1 mmm -64.67 -42.39 95.41 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.723 -0.391 . . . . 1.0 111.67 -178.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -66.18 -33.62 76.17 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.329 -0.396 . . . . 1.0 111.312 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1328 ' ' ALA . . . . . . . . . . . . . . . -56.79 -20.83 24.47 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.169 -0.469 . . . . 1.0 112.194 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1329 ' ' LEU . . . . . 0.445 ' N ' ' CD2' ' A' 1329 ' ' LEU . 3.7 mm? -61.32 -42.66 99.05 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.585 -0.446 . . . . 1.0 111.16 -178.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1330 ' ' GLU . . . . . 0.521 ' N ' ' OE1' ' A' 1330 ' ' GLU . 50.4 mp0 -92.94 24.59 3.6 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 121.209 -0.196 . . . . 1.0 111.435 -179.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -128.66 10.32 6.06 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 111.702 0.26 . . . . 1.0 111.702 -178.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1332 ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -77.36 137.75 38.92 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 120.492 -0.483 . . . . 1.0 110.602 179.467 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 5.4 m120 -107.32 -177.0 3.23 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.605 -0.725 . . . . 1.0 110.224 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 1334 ' ' PHE . . . . . 0.454 ' O ' ' O ' ' A' 1335 ' ' PRO . 19.3 m-85 -41.39 151.1 0.3 Allowed Pre-proline 0 CA--C 1.539 0.539 0 CA-C-N 116.215 -0.448 . . . . 1.0 110.438 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1335 ' ' PRO . . . . . 0.454 ' O ' ' O ' ' A' 1334 ' ' PHE . 87.9 Cg_exo -41.49 174.12 0.0 OUTLIER 'Trans proline' 0 N--CA 1.495 1.617 0 C-N-CA 122.433 2.088 . . . . 1.0 112.814 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1336 ' ' GLN . . . . . 0.515 ' H ' ' CD ' ' A' 1336 ' ' GLN . 2.2 mp0 -55.93 122.58 11.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.816 -0.629 . . . . 1.0 110.378 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 1337 ' ' MET . . . . . . . . . . . . . 98.8 mtp . . . . . 0 C--O 1.22 -0.497 0 CA-C-O 117.909 -1.043 . . . . 1.0 110.591 179.913 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A 1259 ' ' ASN . . . . . . . . . . . . . 42.9 p-10 . . . . . 0 N--CA 1.491 1.597 0 N-CA-C 109.785 -0.45 . . . . 1.0 109.785 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A 1260 ' ' ASP . . . . . . . . . . . . . 14.6 m-20 55.67 66.47 3.67 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 115.803 -0.635 . . . . 1.0 110.99 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1261 ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -55.17 -39.6 90.11 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 122.484 2.123 . . . . 1.0 111.551 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 52.7 pttt -162.36 59.42 0.23 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.019 -0.537 . . . . 1.0 110.659 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1263 ' ' SER . . . . . . . . . . . . . 47.8 m -61.45 -35.7 78.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.12 -0.491 . . . . 1.0 111.017 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -58.46 -52.52 65.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.312 -0.404 . . . . 1.0 111.433 -179.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1265 ' ' LEU . . . . . . . . . . . . . 8.8 mt -65.12 -40.03 93.92 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.902 -0.319 . . . . 1.0 110.784 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 20.2 mm100 -62.29 -43.36 99.01 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 121.033 -0.267 . . . . 1.0 110.89 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -65.63 -31.51 72.57 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.792 0.33 . . . . 1.0 110.814 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1268 ' ' CYS . . . . . 0.432 ' O ' ' OG1' ' A' 1271 ' ' THR . 85.3 m -62.8 -36.5 83.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.378 -0.373 . . . . 1.0 111.119 -179.419 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 93.1 m -60.48 -37.28 80.53 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.88 -0.328 . . . . 1.0 111.036 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 10.9 mp -63.48 -40.42 97.05 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.802 -0.359 . . . . 1.0 110.618 -179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1271 ' ' THR . . . . . 0.432 ' OG1' ' O ' ' A' 1268 ' ' CYS . 69.2 p -64.67 -31.3 72.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.452 -0.34 . . . . 1.0 111.426 -179.051 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 87.8 mt -69.93 84.04 0.49 Allowed 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.303 -0.559 . . . . 1.0 110.577 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -106.1 136.66 45.39 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.248 -0.433 . . . . 1.0 110.228 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1274 ' ' THR . . . . . . . . . . . . . 7.1 m -127.24 155.65 43.14 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 109.85 -0.426 . . . . 1.0 109.85 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -66.65 90.59 0.17 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.976 0.417 . . . . 1.0 111.469 -178.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 54.62 40.57 70.99 Favored Glycine 0 CA--C 1.525 0.692 0 CA-C-N 115.832 -0.622 . . . . 1.0 112.434 178.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 42.4 mtpt -140.4 178.92 6.96 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.508 0.671 . . . . 1.0 111.885 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -117.74 105.95 46.88 Favored Pre-proline 0 CA--C 1.539 0.538 0 CA-C-N 114.753 -1.112 . . . . 1.0 109.271 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -81.14 163.66 19.95 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 C-N-CA 121.776 1.65 . . . . 1.0 112.203 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1280 ' ' ASP . . . . . 0.5 ' O ' ' NE2' ' A' 1336 ' ' GLN . 97.8 m-20 -79.87 125.82 30.21 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.387 -0.597 . . . . 1.0 109.387 179.472 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -115.91 140.45 26.24 Favored Pre-proline 0 CA--C 1.541 0.627 0 CA-C-N 115.973 -0.558 . . . . 1.0 110.591 -178.371 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo -49.18 137.35 30.04 Favored 'Trans proline' 0 N--CA 1.491 1.381 0 C-N-CA 120.973 1.115 . . . . 1.0 110.96 178.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 55.4 mt -117.7 140.43 49.67 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 110.01 -0.367 . . . . 1.0 110.01 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1284 ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -85.17 137.3 33.1 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.237 -0.438 . . . . 1.0 110.241 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 88.6 tttt -140.67 121.2 14.15 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.911 0.386 . . . . 1.0 110.463 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 34.3 m -89.31 128.66 35.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.485 . . . . 1.0 110.253 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 54.2 mt -81.12 -172.45 3.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.478 -0.328 . . . . 1.0 110.299 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -108.13 141.05 40.44 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.241 -0.436 . . . . 1.0 110.337 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1289 ' ' THR . . . . . . . . . . . . . 5.6 p -91.04 112.74 24.77 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.238 -0.437 . . . . 1.0 110.748 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 5.6 m -143.27 122.17 7.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.185 -0.461 . . . . 1.0 110.202 179.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.44 166.09 26.56 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.749 -0.94 . . . . 1.0 110.749 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.01 -40.8 67.59 Favored 'Trans proline' 0 C--N 1.306 -1.688 0 C-N-CA 122.382 2.055 . . . . 1.0 110.946 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1293 ' ' SER . . . . . . . . . . . . . 29.5 t -92.95 164.34 13.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.616 -0.72 . . . . 1.0 110.079 178.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 75.7 m-70 -60.36 -9.97 4.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.084 0.468 . . . . 1.0 110.027 179.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -60.17 141.98 55.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.902 -0.59 . . . . 1.0 110.845 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -113.84 141.91 46.74 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.085 -0.507 . . . . 1.0 110.911 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1297 ' ' THR . . . . . . . . . . . . . 89.1 m -124.0 126.01 45.56 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.965 -0.561 . . . . 1.0 109.816 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -103.38 122.57 45.13 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.978 0.418 . . . . 1.0 110.975 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1299 ' ' THR . . . . . 0.501 ' OG1' ' NZ ' ' A' 1313 ' ' LYS . 89.9 m -128.03 132.84 49.08 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.875 -0.602 . . . . 1.0 110.142 179.34 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 55.9 t -118.72 132.82 67.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 N-CA-C 109.671 -0.492 . . . . 1.0 109.671 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -128.82 147.15 50.78 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.089 -0.505 . . . . 1.0 110.7 -179.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 44.4 t -115.21 130.07 70.38 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 N-CA-C 109.513 -0.551 . . . . 1.0 109.513 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -108.93 140.96 41.7 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.092 0.473 . . . . 1.0 111.226 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 92.0 t80 -136.96 103.54 5.19 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.683 -0.69 . . . . 1.0 109.792 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 98.8 mttt 47.84 34.21 3.77 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.756 -0.378 . . . . 1.0 110.511 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 87.55 10.29 70.69 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 121.26 -0.495 . . . . 1.0 111.901 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -116.11 136.39 53.07 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 120.923 0.392 . . . . 1.0 110.622 179.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 72.6 ttp85 -81.44 135.4 35.63 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.95 -0.568 . . . . 1.0 110.885 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 40.3 pt -135.36 18.22 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-N 116.281 -0.418 . . . . 1.0 110.744 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -161.33 147.83 14.84 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 111.305 -0.718 . . . . 1.0 111.305 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 35.5 t -168.58 134.93 1.87 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.902 0.382 . . . . 1.0 110.625 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . 169.68 170.86 34.66 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 110.799 -0.92 . . . . 1.0 110.799 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1313 ' ' LYS . . . . . 0.501 ' NZ ' ' OG1' ' A' 1299 ' ' THR . 24.4 mtpp -138.59 146.75 42.17 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.973 0.415 . . . . 1.0 110.934 -179.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -162.34 172.54 38.47 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 110.356 -1.097 . . . . 1.0 110.356 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -68.01 -73.03 0.02 OUTLIER 'Trans proline' 0 C--N 1.306 -1.66 0 C-N-CA 122.33 2.02 . . . . 1.0 111.984 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1316 ' ' SER . . . . . 0.435 ' HG ' ' H ' ' A' 1319 ' ' GLN . 82.5 p -82.48 161.21 22.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.46 . . . . 1.0 110.769 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 44.1 mm -65.02 -43.99 96.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.996 -0.547 . . . . 1.0 110.697 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -54.96 -45.05 74.9 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.388 -0.369 . . . . 1.0 110.338 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1319 ' ' GLN . . . . . 0.435 ' H ' ' HG ' ' A' 1316 ' ' SER . 1.4 mp0 -64.62 -40.2 95.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.33 -0.396 . . . . 1.0 110.169 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -63.61 -40.06 95.95 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.117 -0.492 . . . . 1.0 111.075 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -67.2 -38.71 85.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.327 -0.397 . . . . 1.0 110.707 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1322 ' ' MET . . . . . . . . . . . . . 78.6 mtp -64.44 -40.56 95.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.469 . . . . 1.0 110.711 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -67.48 -48.43 57.32 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 110.661 -0.976 . . . . 1.0 110.661 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -67.56 -35.13 78.44 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.877 0.37 . . . . 1.0 110.683 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -60.9 -41.24 95.72 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.945 -0.57 . . . . 1.0 111.769 -178.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1326 ' ' MET . . . . . . . . . . . . . 62.6 ttp -63.28 -41.82 99.04 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.877 -0.329 . . . . 1.0 111.316 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -67.48 -29.53 68.99 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.248 -0.433 . . . . 1.0 110.926 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1328 ' ' ALA . . . . . . . . . . . . . . . -61.13 -27.88 68.71 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.125 0.417 . . . . 1.0 112.125 -178.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 3.2 mm? -62.25 -41.26 98.28 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.494 -0.482 . . . . 1.0 110.569 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -88.61 18.71 4.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.354 -0.385 . . . . 1.0 111.24 -179.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 99.5 mttt -135.41 40.11 2.84 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.518 0.562 . . . . 1.0 112.518 -178.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1332 ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -106.04 134.94 48.37 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.215 0.531 . . . . 1.0 110.595 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1333 ' ' ASN . . . . . 0.427 ' O ' ' C ' ' A' 1334 ' ' PHE . 52.0 m-20 -111.43 -175.48 2.71 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.35 -0.841 . . . . 1.0 109.92 179.277 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1334 ' ' PHE . . . . . 0.427 ' C ' ' O ' ' A' 1333 ' ' ASN . 52.3 m-85 -30.39 110.59 0.27 Allowed Pre-proline 0 CA--C 1.543 0.702 0 O-C-N 123.476 0.485 . . . . 1.0 111.524 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -52.35 145.99 33.97 Favored 'Trans proline' 0 N--CA 1.496 1.673 0 C-N-CA 121.661 1.574 . . . . 1.0 112.275 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 1336 ' ' GLN . . . . . 0.5 ' NE2' ' O ' ' A' 1280 ' ' ASP . 15.8 mm100 -38.35 117.27 0.61 Allowed 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 115.894 -0.594 . . . . 1.0 111.205 -179.375 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 1337 ' ' MET . . . . . . . . . . . . . 65.9 mtt . . . . . 0 C--O 1.219 -0.517 0 CA-C-O 117.907 -1.044 . . . . 1.0 110.602 179.782 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A 1259 ' ' ASN . . . . . . . . . . . . . 43.4 t-20 . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.525 -0.546 . . . . 1.0 109.525 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A 1260 ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -138.72 79.08 29.5 Favored Pre-proline 0 N--CA 1.465 0.278 0 CA-C-N 116.068 -0.515 . . . . 1.0 109.963 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1261 ' ' PRO . . . . . 0.604 ' C ' ' H ' ' A' 1263 ' ' SER . 16.9 Cg_exo -65.22 154.1 75.13 Favored 'Trans proline' 0 C--N 1.308 -1.569 0 C-N-CA 122.668 2.246 . . . . 1.0 112.486 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 64.3 pttt -62.25 11.42 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.812 -0.631 . . . . 1.0 111.371 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1263 ' ' SER . . . . . 0.604 ' H ' ' C ' ' A' 1261 ' ' PRO . 45.7 m -60.45 -28.05 67.99 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.767 0.318 . . . . 1.0 110.638 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1264 ' ' GLN . . . . . 0.453 ' O ' ' SG ' ' A' 1268 ' ' CYS . 99.1 mm-40 -54.51 -44.17 72.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 1.0 110.636 -179.166 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1265 ' ' LEU . . . . . 0.451 ' O ' ' SG ' ' A' 1269 ' ' CYS . 20.4 mt -63.58 -41.48 98.37 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.505 -0.478 . . . . 1.0 110.474 179.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -63.47 -43.98 95.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.846 0.355 . . . . 1.0 110.492 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -66.58 -40.82 89.13 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.037 -0.529 . . . . 1.0 109.887 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1268 ' ' CYS . . . . . 0.453 ' SG ' ' O ' ' A' 1264 ' ' GLN . 92.9 m -65.14 -35.07 79.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.596 -0.729 . . . . 1.0 110.995 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1269 ' ' CYS . . . . . 0.451 ' SG ' ' O ' ' A' 1265 ' ' LEU . 98.4 m -56.74 -35.54 68.72 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.992 -0.283 . . . . 1.0 111.096 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 82.9 mt -62.92 -40.98 99.27 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.478 -0.328 . . . . 1.0 110.621 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1271 ' ' THR . . . . . 0.43 ' OG1' ' O ' ' A' 1268 ' ' CYS . 70.3 p -66.77 -33.14 74.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.517 -0.31 . . . . 1.0 110.843 -179.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 85.9 mt -68.19 85.95 0.26 Allowed 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.572 -0.451 . . . . 1.0 110.562 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 79.4 mtp85 -119.67 131.09 55.34 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.307 -0.406 . . . . 1.0 110.75 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1274 ' ' THR . . . . . . . . . . . . . 20.8 m -120.94 128.4 52.72 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 109.992 -0.373 . . . . 1.0 109.992 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 48.4 tp10 -98.07 128.77 44.79 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.255 -0.43 . . . . 1.0 110.468 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 97.19 -9.26 65.2 Favored Glycine 0 CA--C 1.524 0.647 0 N-CA-C 111.439 -0.664 . . . . 1.0 111.439 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 52.0 mtpt -137.43 -175.11 3.95 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.207 0.527 . . . . 1.0 111.145 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -95.79 108.22 38.94 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 115.11 -0.95 . . . . 1.0 108.713 178.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -50.67 129.22 26.31 Favored 'Trans proline' 0 N--CA 1.493 1.445 0 C-N-CA 121.154 1.236 . . . . 1.0 112.251 -178.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -98.65 125.33 43.91 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.696 -0.684 . . . . 1.0 109.858 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 11.9 mt -133.73 133.84 22.8 Favored Pre-proline 0 CA--C 1.538 0.494 0 N-CA-C 110.365 -0.235 . . . . 1.0 110.365 -179.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -77.68 120.55 5.19 Favored 'Trans proline' 0 N--CA 1.493 1.471 0 C-N-CA 121.56 1.507 . . . . 1.0 111.531 178.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 9.4 mp -106.91 155.83 19.34 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.193 -0.458 . . . . 1.0 110.383 -179.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1284 ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -77.33 144.71 37.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.921 -0.581 . . . . 1.0 111.155 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 87.7 tttt -146.12 105.73 3.96 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.837 -0.619 . . . . 1.0 109.989 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 26.2 m -63.44 130.38 44.19 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.123 -0.49 . . . . 1.0 111.2 -179.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 65.7 mt -81.4 -175.1 5.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.047 -0.524 . . . . 1.0 110.406 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -108.76 146.73 33.1 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.161 -0.472 . . . . 1.0 110.292 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1289 ' ' THR . . . . . . . . . . . . . 17.4 p -94.57 114.21 26.15 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.1 -0.5 . . . . 1.0 111.212 -178.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 30.4 m -138.92 121.56 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-N 116.292 -0.413 . . . . 1.0 110.358 178.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.8 157.83 26.91 Favored Glycine 0 CA--C 1.527 0.82 0 N-CA-C 110.19 -1.164 . . . . 1.0 110.19 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -60.26 -40.56 58.11 Favored 'Trans proline' 0 C--N 1.31 -1.487 0 C-N-CA 122.055 1.837 . . . . 1.0 110.975 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1293 ' ' SER . . . . . 0.548 ' HG ' ' H ' ' A' 1295 ' ' ALA . 11.9 t -93.19 164.79 13.11 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.633 -0.712 . . . . 1.0 110.314 179.171 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1294 ' ' HIS . . . . . 0.482 ' N ' ' HG ' ' A' 1293 ' ' SER . 62.1 m170 -58.36 -11.39 2.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.274 -0.421 . . . . 1.0 110.018 179.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1295 ' ' ALA . . . . . 0.548 ' H ' ' HG ' ' A' 1293 ' ' SER . . . -60.3 147.89 38.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.98 -0.554 . . . . 1.0 110.485 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 96.2 mtt-85 -126.89 143.74 51.19 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.164 0.507 . . . . 1.0 111.149 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1297 ' ' THR . . . . . . . . . . . . . 88.4 m -125.24 128.09 47.76 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.57 -0.741 . . . . 1.0 109.366 178.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 95.3 m-85 -99.66 119.32 37.91 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.777 -0.453 . . . . 1.0 109.777 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1299 ' ' THR . . . . . . . . . . . . . 41.1 m -127.24 130.17 49.13 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.939 -0.573 . . . . 1.0 110.427 -179.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 67.2 t -118.31 127.41 75.42 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 N-CA-C 109.189 -0.671 . . . . 1.0 109.189 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -130.83 143.39 50.7 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.351 -0.386 . . . . 1.0 110.894 -179.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 16.9 t -106.55 129.07 60.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 N-CA-C 109.142 -0.688 . . . . 1.0 109.142 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -112.59 144.33 42.26 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.238 0.542 . . . . 1.0 111.671 -178.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1304 ' ' PHE . . . . . 0.432 ' O ' ' N ' ' A' 1307 ' ' GLU . 75.2 t80 -126.69 108.0 10.69 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.388 -0.823 . . . . 1.0 109.234 179.324 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 38.5 mtpt 46.75 32.24 1.69 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.514 -0.474 . . . . 1.0 109.984 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 88.97 17.29 56.52 Favored Glycine 0 CA--C 1.529 0.956 0 N-CA-C 111.83 -0.508 . . . . 1.0 111.83 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1307 ' ' GLU . . . . . 0.432 ' N ' ' O ' ' A' 1304 ' ' PHE . 99.5 mt-10 -119.47 129.71 54.87 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.964 0.382 . . . . 1.0 110.777 179.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1308 ' ' ARG . . . . . 0.642 HH21 ' CB ' ' A' 1311 ' ' CYS . 77.7 ttt180 -66.53 129.25 39.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.772 -0.649 . . . . 1.0 110.97 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 3.4 pt -138.24 13.01 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 116.064 -0.517 . . . . 1.0 110.874 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -173.57 153.19 16.98 Favored Glycine 0 CA--C 1.524 0.623 0 C-N-CA 120.346 -0.93 . . . . 1.0 111.674 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1311 ' ' CYS . . . . . 0.642 ' CB ' HH21 ' A' 1308 ' ' ARG . 52.4 t -169.9 144.08 2.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.877 0.37 . . . . 1.0 110.789 179.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -170.63 156.35 26.61 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.879 -0.888 . . . . 1.0 110.879 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 99.3 mttt -139.07 142.02 38.18 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.929 0.395 . . . . 1.0 110.595 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -167.11 176.9 41.94 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 110.277 -1.129 . . . . 1.0 110.277 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 18.3 Cg_exo -61.53 -63.23 0.1 Allowed 'Trans proline' 0 C--N 1.311 -1.408 0 C-N-CA 121.487 1.458 . . . . 1.0 111.936 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1316 ' ' SER . . . . . . . . . . . . . 9.8 p -90.95 167.25 12.55 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.8 -0.636 . . . . 1.0 111.061 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1317 ' ' ILE . . . . . 0.43 HG21 HD11 ' A' 1317 ' ' ILE . 38.1 mm -67.79 -42.43 86.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.914 -0.584 . . . . 1.0 110.088 179.07 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -54.5 -43.52 71.9 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.961 -0.563 . . . . 1.0 111.204 -178.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -66.94 -40.05 87.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.999 0.428 . . . . 1.0 110.341 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -62.59 -38.92 92.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.046 -0.525 . . . . 1.0 110.367 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -67.35 -38.17 84.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.245 -0.434 . . . . 1.0 111.445 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1322 ' ' MET . . . . . . . . . . . . . 72.1 mmm -64.13 -40.15 95.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.868 0.366 . . . . 1.0 110.547 -179.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -66.41 -47.42 70.58 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 111.574 -0.61 . . . . 1.0 111.574 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -66.09 -38.87 89.35 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.912 -0.315 . . . . 1.0 111.301 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -59.15 -48.3 82.11 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.358 -0.383 . . . . 1.0 111.206 -179.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1326 ' ' MET . . . . . 0.456 ' O ' ' OE1' ' A' 1330 ' ' GLU . 98.0 mmm -62.59 -43.97 97.49 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.729 -0.388 . . . . 1.0 111.085 -179.556 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -68.48 -32.78 73.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.528 -0.306 . . . . 1.0 111.694 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1328 ' ' ALA . . . . . . . . . . . . . . . -62.34 -33.65 75.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.677 0.275 . . . . 1.0 111.641 -178.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 98.7 mt -58.75 -26.49 64.04 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.707 0.289 . . . . 1.0 111.095 -179.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1330 ' ' GLU . . . . . 0.529 ' N ' ' OE1' ' A' 1330 ' ' GLU . 56.1 mp0 -88.84 -2.08 58.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.357 -0.383 . . . . 1.0 111.544 -179.483 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 98.4 mttt -120.41 21.46 11.64 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 112.698 0.629 . . . . 1.0 112.698 -177.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1332 ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -104.38 131.03 52.18 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.092 0.472 . . . . 1.0 110.585 179.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -101.13 -176.28 3.11 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.553 -0.749 . . . . 1.0 109.95 178.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -37.05 154.62 0.09 OUTLIER Pre-proline 0 CA--C 1.538 0.496 0 CA-C-N 116.147 -0.479 . . . . 1.0 110.846 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -52.97 157.43 8.08 Favored 'Trans proline' 0 N--CA 1.493 1.481 0 C-N-CA 121.336 1.357 . . . . 1.0 111.483 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1336 ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 -37.17 109.9 0.11 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 120.941 0.4 . . . . 1.0 111.095 -179.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 1337 ' ' MET . . . . . . . . . . . . . 94.1 mmm . . . . . 0 C--O 1.219 -0.518 0 CA-C-O 117.847 -1.073 . . . . 1.0 110.659 179.785 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A 1259 ' ' ASN . . . . . . . . . . . . . 91.4 m-20 . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.301 -0.629 . . . . 1.0 109.301 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A 1260 ' ' ASP . . . . . 0.615 ' H ' ' CD ' ' A' 1261 ' ' PRO . 0.0 OUTLIER -154.66 -43.49 0.0 OUTLIER Pre-proline 0 CA--C 1.537 0.448 0 CA-C-N 116.416 -0.356 . . . . 1.0 111.319 -179.966 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A 1261 ' ' PRO . . . . . 0.615 ' CD ' ' H ' ' A' 1260 ' ' ASP . 45.7 Cg_exo -58.62 -31.55 94.87 Favored 'Trans proline' 0 N--CA 1.499 1.84 0 C-N-CA 122.33 2.02 . . . . 1.0 112.811 -179.108 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -94.42 8.25 42.69 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.497 -0.32 . . . . 1.0 111.371 -179.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1263 ' ' SER . . . . . . . . . . . . . 55.7 m -56.73 -45.23 82.08 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.569 -0.452 . . . . 1.0 110.532 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 28.1 mp0 -67.4 -40.91 85.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.993 0.425 . . . . 1.0 110.552 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1265 ' ' LEU . . . . . 0.474 ' N ' ' CD2' ' A' 1265 ' ' LEU . 2.2 mm? -62.96 -42.97 99.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.905 -0.589 . . . . 1.0 110.574 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -65.31 -44.35 88.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.316 -0.402 . . . . 1.0 111.292 -179.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -63.86 -39.27 93.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.454 -0.339 . . . . 1.0 111.267 -179.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1268 ' ' CYS . . . . . 0.429 ' O ' ' OG1' ' A' 1271 ' ' THR . 97.4 m -63.94 -35.92 82.26 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.36 -0.382 . . . . 1.0 110.747 -179.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 77.2 m -60.2 -36.23 77.19 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.121 -0.49 . . . . 1.0 111.341 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 90.2 mt -62.9 -41.04 99.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.447 -0.342 . . . . 1.0 111.086 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1271 ' ' THR . . . . . 0.429 ' OG1' ' O ' ' A' 1268 ' ' CYS . 40.4 p -64.83 -30.36 71.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.503 -0.317 . . . . 1.0 111.55 -179.42 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 70.5 mt -78.71 96.6 5.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.87 0.367 . . . . 1.0 111.175 -179.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 46.8 mmm-85 -119.01 111.22 18.04 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.058 -0.519 . . . . 1.0 110.23 179.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1274 ' ' THR . . . . . . . . . . . . . 27.3 m -129.49 139.36 51.59 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 120.733 0.301 . . . . 1.0 110.458 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 78.8 tt0 -129.2 146.73 51.06 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.214 -0.448 . . . . 1.0 110.186 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 82.48 12.97 79.51 Favored Glycine 0 CA--C 1.524 0.651 0 N-CA-C 111.064 -0.814 . . . . 1.0 111.064 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 23.9 mtpp -136.55 -172.84 3.26 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.184 0.516 . . . . 1.0 110.919 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 87.7 mt-10 -96.37 108.57 42.74 Favored Pre-proline 0 CA--C 1.533 0.321 0 CA-C-N 115.259 -0.882 . . . . 1.0 109.046 179.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -50.21 133.12 35.34 Favored 'Trans proline' 0 N--CA 1.491 1.341 0 C-N-CA 121.173 1.249 . . . . 1.0 112.38 -179.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -139.68 124.18 18.18 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.512 -0.767 . . . . 1.0 109.28 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 7.0 mt -143.93 134.82 12.37 Favored Pre-proline 0 CA--C 1.537 0.461 0 CA-C-O 119.154 -0.45 . . . . 1.0 109.939 -178.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -52.24 131.71 40.89 Favored 'Trans proline' 0 N--CA 1.492 1.39 0 CA-C-N 120.322 1.151 . . . . 1.0 111.132 177.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 69.1 mt -130.13 140.65 50.76 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.918 0.389 . . . . 1.0 110.14 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1284 ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -82.32 141.8 32.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.877 -0.601 . . . . 1.0 111.785 -178.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -143.49 108.46 4.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.31 -0.859 . . . . 1.0 109.447 179.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 16.6 m -64.09 142.89 58.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.272 0.558 . . . . 1.0 110.779 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1287 ' ' LEU . . . . . 0.591 ' N ' ' CD2' ' A' 1287 ' ' LEU . 1.0 OUTLIER -80.92 -174.14 4.64 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.216 -0.902 . . . . 1.0 110.015 -179.352 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -108.86 130.59 55.42 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 109.695 -0.483 . . . . 1.0 109.695 179.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1289 ' ' THR . . . . . . . . . . . . . 64.9 p -87.46 116.97 25.93 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.927 0.394 . . . . 1.0 111.359 -179.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 24.1 m -149.99 122.14 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.183 0 CA-C-N 116.04 -0.527 . . . . 1.0 109.99 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.14 160.69 27.21 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.516 -1.034 . . . . 1.0 110.516 179.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -59.27 -43.36 41.78 Favored 'Trans proline' 0 C--N 1.308 -1.573 0 C-N-CA 122.214 1.943 . . . . 1.0 111.038 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1293 ' ' SER . . . . . 0.425 ' C ' ' H ' ' A' 1295 ' ' ALA . 46.9 t -92.3 165.16 13.23 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.569 -0.741 . . . . 1.0 110.331 179.499 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 80.8 m80 -59.93 -6.73 1.4 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.334 -0.394 . . . . 1.0 110.389 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1295 ' ' ALA . . . . . 0.425 ' H ' ' C ' ' A' 1293 ' ' SER . . . -66.7 148.46 51.88 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.081 -0.509 . . . . 1.0 110.612 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -129.9 143.73 50.95 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 116.236 -0.438 . . . . 1.0 110.628 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1297 ' ' THR . . . . . . . . . . . . . 84.8 m -123.54 128.7 50.13 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.933 -0.576 . . . . 1.0 109.526 179.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -102.03 118.98 38.05 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.184 0.516 . . . . 1.0 111.567 -178.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1299 ' ' THR . . . . . . . . . . . . . 91.9 m -127.71 130.13 48.32 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.557 -0.747 . . . . 1.0 109.815 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 53.3 t -117.31 129.94 73.01 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 N-CA-C 109.714 -0.476 . . . . 1.0 109.714 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -130.52 143.82 51.01 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.306 -0.407 . . . . 1.0 111.117 -179.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 24.9 t -107.37 126.86 63.56 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 CA-C-N 116.019 -0.537 . . . . 1.0 109.599 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -104.68 130.18 52.76 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.847 0.356 . . . . 1.0 110.539 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 61.8 t80 -142.56 109.03 5.32 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.172 -0.467 . . . . 1.0 110.371 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 68.1 mttm 52.17 27.71 4.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 1.0 110.894 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 80.14 12.22 83.5 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 111.378 -0.689 . . . . 1.0 111.378 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -109.92 120.15 41.56 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 110.023 -0.362 . . . . 1.0 110.023 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 61.6 ttp180 -75.98 126.04 30.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.341 -0.391 . . . . 1.0 110.354 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 31.5 pt -122.26 23.12 4.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-N 116.099 -0.5 . . . . 1.0 110.387 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -156.86 153.4 24.67 Favored Glycine 0 CA--C 1.524 0.639 0 N-CA-C 110.781 -0.928 . . . . 1.0 110.781 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 12.0 t -172.44 105.91 0.17 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.733 0.301 . . . . 1.0 110.557 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -173.48 167.85 40.62 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 111.108 -0.797 . . . . 1.0 111.108 179.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 69.0 mttm -139.61 144.08 37.55 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.811 0.338 . . . . 1.0 110.444 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -157.78 171.95 34.95 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.562 -1.015 . . . . 1.0 110.562 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.78 -76.83 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.66 0 C-N-CA 122.54 2.16 . . . . 1.0 111.759 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1316 ' ' SER . . . . . . . . . . . . . 16.2 p -76.28 162.0 28.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.015 0.436 . . . . 1.0 111.116 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 39.1 mm -63.83 -43.81 97.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.887 -0.597 . . . . 1.0 110.797 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -57.12 -40.27 76.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.305 -0.407 . . . . 1.0 110.877 -179.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 19.0 mm100 -62.85 -42.49 99.77 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.849 0.357 . . . . 1.0 110.66 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -67.08 -37.9 84.79 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.081 -0.508 . . . . 1.0 111.425 -179.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -66.12 -40.02 90.36 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.146 0.424 . . . . 1.0 112.146 -178.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1322 ' ' MET . . . . . . . . . . . . . 74.7 mtm -64.01 -41.35 97.49 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.495 -0.482 . . . . 1.0 111.161 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -64.29 -46.04 91.83 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 120.862 -0.685 . . . . 1.0 111.678 -179.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -66.23 -37.49 85.65 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.891 0.33 . . . . 1.0 111.891 -179.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -62.52 -41.74 99.05 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 111.893 0.331 . . . . 1.0 111.893 -178.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1326 ' ' MET . . . . . . . . . . . . . 74.1 mmm -62.92 -44.39 96.21 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.59 -0.444 . . . . 1.0 111.259 -179.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -68.25 -33.35 74.21 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.858 -0.337 . . . . 1.0 110.278 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1328 ' ' ALA . . . . . . . . . . . . . . . -57.45 -37.33 72.67 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.054 -0.521 . . . . 1.0 111.072 -179.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 76.5 mt -62.03 -36.52 81.84 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.78 0.324 . . . . 1.0 110.685 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -82.98 8.32 13.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.29 -0.414 . . . . 1.0 111.273 -179.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 96.5 mttt -135.81 40.51 2.74 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.395 0.517 . . . . 1.0 112.395 -177.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1332 ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -107.18 151.23 25.69 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.075 0.464 . . . . 1.0 110.181 179.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -123.77 -176.74 3.55 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.552 -0.749 . . . . 1.0 109.982 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -37.86 150.54 0.17 Allowed Pre-proline 0 CA--C 1.535 0.387 0 CA-C-N 116.257 -0.428 . . . . 1.0 110.831 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.93 156.77 64.3 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 122.478 2.118 . . . . 1.0 112.252 -179.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1336 ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 -39.22 117.82 0.73 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.927 -0.579 . . . . 1.0 110.926 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 1337 ' ' MET . . . . . . . . . . . . . 3.3 ttt . . . . . 0 C--O 1.22 -0.472 0 CA-C-O 117.959 -1.02 . . . . 1.0 110.477 -179.76 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A 1259 ' ' ASN . . . . . . . . . . . . . 23.8 t-20 . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.477 -0.564 . . . . 1.0 109.477 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A 1260 ' ' ASP . . . . . 0.402 ' CG ' ' HG ' ' A' 1263 ' ' SER . 5.6 t70 59.83 55.55 4.52 Favored Pre-proline 0 CA--C 1.533 0.292 0 CA-C-N 116.179 -0.464 . . . . 1.0 110.602 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1261 ' ' PRO . . . . . 0.471 ' C ' ' H ' ' A' 1263 ' ' SER . 91.9 Cg_endo -75.99 153.2 37.0 Favored 'Trans proline' 0 N--CA 1.496 1.627 0 C-N-CA 123.006 2.471 . . . . 1.0 113.037 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 55.7 mtmt 52.55 8.52 0.08 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.972 -0.558 . . . . 1.0 111.628 178.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1263 ' ' SER . . . . . 0.471 ' H ' ' C ' ' A' 1261 ' ' PRO . 45.5 m -58.82 -38.51 78.81 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.71 -0.396 . . . . 1.0 110.419 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1264 ' ' GLN . . . . . 0.421 ' O ' ' SG ' ' A' 1268 ' ' CYS . 86.9 mt-30 -63.37 -47.45 82.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.955 -0.566 . . . . 1.0 111.386 -179.54 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1265 ' ' LEU . . . . . 0.425 ' CD1' ' OH ' ' A' 1284 ' ' TYR . 91.7 mt -64.23 -42.59 96.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.526 -0.306 . . . . 1.0 111.099 -179.449 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -63.67 -42.8 98.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.327 -0.397 . . . . 1.0 110.908 -179.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -65.85 -39.68 90.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.813 0.34 . . . . 1.0 110.54 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1268 ' ' CYS . . . . . 0.43 ' O ' ' OG1' ' A' 1271 ' ' THR . 95.4 m -62.82 -34.83 78.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.984 -0.553 . . . . 1.0 111.062 -179.489 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 77.5 m -54.83 -40.21 69.36 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.773 -0.371 . . . . 1.0 110.738 -179.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1270 ' ' LEU . . . . . 0.451 ' CD2' ' N ' ' A' 1270 ' ' LEU . 4.0 mm? -65.02 -39.96 94.15 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.079 -0.509 . . . . 1.0 111.241 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1271 ' ' THR . . . . . 0.43 ' OG1' ' O ' ' A' 1268 ' ' CYS . 80.4 p -63.88 -31.96 73.33 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.83 0.307 . . . . 1.0 111.83 -178.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 71.8 mt -77.19 86.14 3.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.618 0.246 . . . . 1.0 111.056 -179.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -120.02 131.81 55.26 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 120.753 0.311 . . . . 1.0 111.07 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1274 ' ' THR . . . . . . . . . . . . . 9.3 m -128.54 139.68 52.18 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 109.176 -0.676 . . . . 1.0 109.176 178.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -107.85 133.01 52.83 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.208 0.528 . . . . 1.0 111.048 -179.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 80.85 5.17 90.24 Favored Glycine 0 CA--C 1.527 0.797 0 CA-C-N 115.705 -0.679 . . . . 1.0 112.474 178.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 43.3 mtpt -139.95 -174.24 3.86 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.614 0.721 . . . . 1.0 112.054 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -99.01 108.84 51.54 Favored Pre-proline 0 CA--C 1.538 0.491 0 CA-C-N 114.752 -1.113 . . . . 1.0 109.946 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -80.86 113.7 2.81 Favored 'Trans proline' 0 N--CA 1.496 1.668 0 C-N-CA 122.0 1.8 . . . . 1.0 112.798 -179.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -83.21 148.88 27.16 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.867 -0.606 . . . . 1.0 109.956 179.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 3.0 mt -140.85 132.41 13.89 Favored Pre-proline 0 CA--C 1.538 0.498 0 N-CA-C 109.303 -0.628 . . . . 1.0 109.303 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -55.2 139.08 80.62 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 CA-C-N 120.787 1.317 . . . . 1.0 110.983 178.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 97.0 mt -126.35 147.96 49.66 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.474 -0.33 . . . . 1.0 110.242 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1284 ' ' TYR . . . . . 0.425 ' OH ' ' CD1' ' A' 1265 ' ' LEU . 36.0 m-85 -78.0 142.79 38.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.094 -0.503 . . . . 1.0 111.132 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 65.0 tttm -145.23 106.64 4.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.472 -0.785 . . . . 1.0 109.49 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 41.5 m -69.41 133.93 48.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.062 -0.517 . . . . 1.0 111.267 -179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 67.6 mt -81.23 -172.48 3.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.908 -0.587 . . . . 1.0 110.081 179.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 91.6 mm-40 -109.22 140.91 42.23 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.053 -0.521 . . . . 1.0 110.032 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1289 ' ' THR . . . . . . . . . . . . . 30.1 p -99.35 114.98 28.16 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.166 -0.47 . . . . 1.0 111.085 -179.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 28.0 m -133.09 122.3 45.44 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 N-CA-C 109.927 -0.397 . . . . 1.0 109.927 178.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -143.62 167.51 26.61 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 111.056 -0.817 . . . . 1.0 111.056 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.47 -49.5 0.6 Allowed 'Trans proline' 0 C--N 1.308 -1.596 0 C-N-CA 122.688 2.259 . . . . 1.0 111.214 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1293 ' ' SER . . . . . . . . . . . . . 14.8 t -88.52 164.33 15.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.483 -0.781 . . . . 1.0 110.544 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 40.0 m80 -59.5 -11.35 4.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.315 -0.402 . . . . 1.0 110.416 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -67.14 143.28 56.71 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.544 -0.539 . . . . 1.0 109.544 179.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -127.73 149.01 50.42 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.141 0.496 . . . . 1.0 111.69 -178.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1297 ' ' THR . . . . . . . . . . . . . 88.8 m -121.72 122.0 38.56 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.461 -0.79 . . . . 1.0 109.064 178.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -94.34 126.11 39.39 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.189 0.518 . . . . 1.0 111.212 -179.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1299 ' ' THR . . . . . . . . . . . . . 91.1 m -127.24 130.63 49.98 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.765 -0.652 . . . . 1.0 110.17 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 55.4 t -120.84 130.39 74.67 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 N-CA-C 110.078 -0.341 . . . . 1.0 110.078 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -130.56 145.27 51.84 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.127 -0.488 . . . . 1.0 110.616 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 18.7 t -107.82 128.69 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 N-CA-C 109.432 -0.581 . . . . 1.0 109.432 179.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -106.96 137.65 44.62 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.469 -0.332 . . . . 1.0 110.989 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1304 ' ' PHE . . . . . 0.496 ' O ' ' N ' ' A' 1307 ' ' GLU . 50.6 t80 -139.34 119.33 13.45 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.334 -0.394 . . . . 1.0 110.168 179.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1305 ' ' LYS . . . . . 0.506 ' HZ3' ' NE2' ' A' 1336 ' ' GLN . 51.8 mttp 39.51 39.34 0.48 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.367 -0.379 . . . . 1.0 111.566 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 79.09 20.37 70.24 Favored Glycine 0 CA--C 1.528 0.852 0 C-N-CA 121.127 -0.559 . . . . 1.0 112.221 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1307 ' ' GLU . . . . . 0.496 ' N ' ' O ' ' A' 1304 ' ' PHE . 98.1 mt-10 -125.98 147.79 49.43 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.81 0.338 . . . . 1.0 110.309 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 57.1 ttp180 -91.59 126.15 36.58 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.039 -0.528 . . . . 1.0 110.106 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 45.0 pt -132.38 16.37 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-N 116.461 -0.336 . . . . 1.0 110.856 -179.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -157.47 151.63 22.89 Favored Glycine 0 CA--C 1.523 0.574 0 N-CA-C 111.084 -0.806 . . . . 1.0 111.084 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 30.3 p -173.6 138.5 0.67 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.725 0.298 . . . . 1.0 110.445 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . 179.27 162.01 27.75 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.979 -0.849 . . . . 1.0 110.979 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 59.8 mttp -141.93 142.66 33.03 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.735 0.302 . . . . 1.0 110.341 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -164.11 -178.87 37.97 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 110.701 -0.96 . . . . 1.0 110.701 179.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -63.65 -70.79 0.03 OUTLIER 'Trans proline' 0 C--N 1.311 -1.435 0 C-N-CA 121.689 1.593 . . . . 1.0 111.237 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1316 ' ' SER . . . . . 0.431 ' OG ' ' OE1' ' A' 1319 ' ' GLN . 4.9 p -90.06 171.57 9.45 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.049 -0.523 . . . . 1.0 110.402 179.437 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1317 ' ' ILE . . . . . 0.431 HG21 HD12 ' A' 1317 ' ' ILE . 39.2 mm -64.19 -42.99 97.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.821 -0.627 . . . . 1.0 110.413 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -53.2 -42.0 65.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.776 -0.647 . . . . 1.0 111.833 -178.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1319 ' ' GLN . . . . . 0.431 ' OE1' ' OG ' ' A' 1316 ' ' SER . 13.8 mp0 -67.3 -40.46 86.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.698 0.285 . . . . 1.0 110.459 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -65.69 -37.81 87.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.225 -0.443 . . . . 1.0 111.455 -179.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -65.92 -38.37 88.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.382 -0.372 . . . . 1.0 111.84 -178.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1322 ' ' MET . . . . . . . . . . . . . 61.6 mtt -62.3 -43.62 98.39 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.865 -0.334 . . . . 1.0 111.403 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -67.7 -40.2 90.16 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 111.634 -0.586 . . . . 1.0 111.634 -179.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -65.94 -38.78 89.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.678 0.275 . . . . 1.0 111.618 -179.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -65.82 -39.63 91.05 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.34 0.496 . . . . 1.0 112.34 -178.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1326 ' ' MET . . . . . . . . . . . . . 8.3 ttt -63.08 -38.83 92.76 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.76 -0.376 . . . . 1.0 110.824 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 56.7 m-20 -64.76 -31.93 73.38 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.203 -0.453 . . . . 1.0 110.645 -179.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1328 ' ' ALA . . . . . 0.545 ' O ' ' CD2' ' A' 1332 ' ' TYR . . . -57.31 -26.59 61.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.584 -0.28 . . . . 1.0 111.475 -179.137 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1329 ' ' LEU . . . . . 0.473 ' CD2' ' N ' ' A' 1329 ' ' LEU . 3.7 mm? -61.72 -41.95 98.3 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.84 -0.344 . . . . 1.0 110.946 -179.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -93.16 14.22 18.71 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 121.062 -0.255 . . . . 1.0 111.113 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 64.9 mttm -135.52 42.28 2.7 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 120.685 -0.406 . . . . 1.0 111.706 -178.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1332 ' ' TYR . . . . . 0.545 ' CD2' ' O ' ' A' 1328 ' ' ALA . 8.7 m-85 -108.7 145.5 34.94 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.303 0.573 . . . . 1.0 110.712 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 15.9 m120 -127.08 -176.07 3.61 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.209 -0.905 . . . . 1.0 109.404 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -41.26 141.04 1.13 Allowed Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 121.075 -0.25 . . . . 1.0 110.766 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -75.77 172.64 15.91 Favored 'Trans proline' 0 N--CA 1.498 1.739 0 C-N-CA 122.72 2.28 . . . . 1.0 112.245 179.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 1336 ' ' GLN . . . . . 0.506 ' NE2' ' HZ3' ' A' 1305 ' ' LYS . 14.0 mm100 -50.41 115.1 1.31 Allowed 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.782 -0.451 . . . . 1.0 109.782 179.385 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 1337 ' ' MET . . . . . . . . . . . . . 1.5 tpt . . . . . 0 C--O 1.22 -0.483 0 CA-C-O 118.026 -0.988 . . . . 1.0 110.167 -179.692 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A 1259 ' ' ASN . . . . . 0.431 ' O ' ' OD1' ' A' 1259 ' ' ASN . 27.0 p30 . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 109.631 -0.507 . . . . 1.0 109.631 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1260 ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -79.59 151.04 74.02 Favored Pre-proline 0 CA--C 1.534 0.356 0 CA-C-N 116.021 -0.536 . . . . 1.0 110.188 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1261 ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -66.55 -20.92 53.44 Favored 'Trans proline' 0 N--CA 1.497 1.688 0 C-N-CA 122.421 2.081 . . . . 1.0 111.784 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 98.8 mttt -63.47 -41.85 98.61 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.045 -0.525 . . . . 1.0 110.536 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1263 ' ' SER . . . . . . . . . . . . . 51.0 m -58.92 -36.88 75.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.134 -0.485 . . . . 1.0 110.616 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 14.3 mp0 -61.15 -42.68 98.99 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.819 -0.352 . . . . 1.0 110.265 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1265 ' ' LEU . . . . . 0.419 ' CD2' ' OH ' ' A' 1332 ' ' TYR . 83.4 mt -62.89 -41.52 99.44 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.742 -0.383 . . . . 1.0 110.031 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -63.82 -43.23 96.85 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.801 -0.36 . . . . 1.0 110.798 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -65.32 -39.52 92.56 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.854 0.359 . . . . 1.0 110.819 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1268 ' ' CYS . . . . . 0.445 ' O ' ' OG1' ' A' 1271 ' ' THR . 88.5 m -64.5 -37.36 87.26 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.016 -0.538 . . . . 1.0 111.178 -179.351 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 70.9 m -51.14 -41.38 60.06 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 120.55 -0.46 . . . . 1.0 110.865 -178.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1270 ' ' LEU . . . . . 0.493 ' CD2' ' N ' ' A' 1270 ' ' LEU . 3.6 mm? -64.39 -41.25 96.77 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.809 0.338 . . . . 1.0 110.801 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1271 ' ' THR . . . . . 0.445 ' OG1' ' O ' ' A' 1268 ' ' CYS . 48.0 p -66.56 -30.19 70.43 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.276 -0.42 . . . . 1.0 111.477 -179.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 92.5 mt -76.34 102.67 6.0 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.435 -0.506 . . . . 1.0 110.725 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 78.3 mtp85 -119.96 142.64 48.57 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.126 -0.488 . . . . 1.0 109.913 179.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1274 ' ' THR . . . . . . . . . . . . . 8.4 m -113.67 128.02 56.27 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 120.808 0.337 . . . . 1.0 110.188 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -129.54 112.06 13.37 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.408 -0.36 . . . . 1.0 110.861 -179.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 74.03 24.63 73.34 Favored Glycine 0 CA--C 1.527 0.823 0 CA-C-N 115.98 -0.555 . . . . 1.0 112.203 178.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 4.1 mtpp -136.58 -163.48 1.42 Allowed 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.335 0.588 . . . . 1.0 110.61 -179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -95.11 108.24 37.19 Favored Pre-proline 0 CA--C 1.541 0.623 0 CA-C-N 114.865 -1.061 . . . . 1.0 109.277 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1279 ' ' PRO . . . . . 0.437 ' O ' ' OD1' ' A' 1280 ' ' ASP . 50.4 Cg_exo -49.79 122.84 9.63 Favored 'Trans proline' 0 N--CA 1.494 1.524 0 C-N-CA 121.506 1.471 . . . . 1.0 112.657 -179.326 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1280 ' ' ASP . . . . . 0.437 ' OD1' ' O ' ' A' 1279 ' ' PRO . 96.0 m-20 -143.82 124.26 13.94 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.656 -0.702 . . . . 1.0 109.392 178.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 1.5 mp -137.77 135.57 19.09 Favored Pre-proline 0 CA--C 1.541 0.605 0 CA-C-N 116.242 -0.436 . . . . 1.0 110.424 -178.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -54.77 139.65 77.62 Favored 'Trans proline' 0 N--CA 1.496 1.64 0 CA-C-N 120.345 1.159 . . . . 1.0 111.213 178.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 87.4 mt -138.46 153.81 48.83 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.231 -0.44 . . . . 1.0 110.157 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1284 ' ' TYR . . . . . . . . . . . . . 81.9 m-85 -81.66 136.04 35.51 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.438 -0.346 . . . . 1.0 110.814 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 12.3 ttmm -138.83 126.02 21.42 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.204 -0.453 . . . . 1.0 109.869 178.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 92.3 m -99.15 125.7 44.76 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.967 0.413 . . . . 1.0 110.428 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 82.0 mt -77.54 -169.7 1.54 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.626 -0.716 . . . . 1.0 110.419 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -107.93 141.19 39.93 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.449 -0.341 . . . . 1.0 110.466 -179.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1289 ' ' THR . . . . . . . . . . . . . 16.9 p -87.84 114.47 24.49 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.082 -0.508 . . . . 1.0 110.858 -179.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 17.4 m -131.71 122.1 49.08 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-O 120.968 0.413 . . . . 1.0 110.38 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -144.52 157.71 27.3 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 110.569 -1.013 . . . . 1.0 110.569 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.74 -38.51 7.74 Favored 'Trans proline' 0 C--N 1.308 -1.563 0 C-N-CA 121.886 1.724 . . . . 1.0 110.691 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1293 ' ' SER . . . . . . . . . . . . . 26.7 t -92.74 165.22 13.05 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.503 -0.771 . . . . 1.0 110.211 179.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 78.9 m80 -57.61 -12.93 3.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.055 0.455 . . . . 1.0 109.839 179.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -63.37 145.16 56.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.805 -0.634 . . . . 1.0 110.554 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -128.41 140.13 52.0 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.03 0.443 . . . . 1.0 110.958 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1297 ' ' THR . . . . . . . . . . . . . 80.6 m -123.03 130.25 52.55 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.789 -0.642 . . . . 1.0 109.648 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 92.7 m-85 -100.07 131.46 46.01 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.148 0.499 . . . . 1.0 111.331 -178.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1299 ' ' THR . . . . . . . . . . . . . 90.1 m -127.42 131.91 50.18 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.61 -0.723 . . . . 1.0 110.017 179.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 55.8 t -118.42 129.48 74.66 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 109.963 -0.384 . . . . 1.0 109.963 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -129.69 144.42 51.28 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.09 -0.505 . . . . 1.0 110.589 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 24.3 t -111.61 128.24 68.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 N-CA-C 109.015 -0.735 . . . . 1.0 109.015 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -106.95 139.98 40.48 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.22 0.533 . . . . 1.0 111.622 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 75.5 t80 -140.99 106.64 5.1 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.429 -0.805 . . . . 1.0 110.118 179.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 55.6 mtpt 50.19 34.35 8.49 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.806 0.336 . . . . 1.0 110.736 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 83.81 18.71 62.95 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 121.343 -0.456 . . . . 1.0 111.994 179.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -121.68 144.07 48.98 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 109.887 -0.412 . . . . 1.0 109.887 179.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1308 ' ' ARG . . . . . 0.51 ' NE ' ' O ' ' A' 1310 ' ' GLY . 75.5 ttt180 -96.84 122.06 39.4 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.84 0.352 . . . . 1.0 110.144 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 35.4 pt -118.48 22.93 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-N 116.149 -0.478 . . . . 1.0 110.66 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1310 ' ' GLY . . . . . 0.51 ' O ' ' NE ' ' A' 1308 ' ' ARG . . . -159.38 153.99 25.05 Favored Glycine 0 CA--C 1.524 0.609 0 N-CA-C 110.659 -0.977 . . . . 1.0 110.659 179.833 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 8.7 p -174.17 121.42 0.29 Allowed 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.712 -0.395 . . . . 1.0 111.068 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -174.33 168.28 40.96 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.945 -0.862 . . . . 1.0 110.945 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 61.7 mttp -138.95 149.41 44.73 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.918 0.389 . . . . 1.0 110.607 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -169.06 167.74 40.69 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.438 -1.065 . . . . 1.0 110.438 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.67 -53.74 0.42 Allowed 'Trans proline' 0 C--N 1.307 -1.654 0 C-N-CA 122.449 2.099 . . . . 1.0 111.545 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1316 ' ' SER . . . . . . . . . . . . . 82.6 p -97.08 161.47 13.81 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.111 0.481 . . . . 1.0 110.98 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 40.3 mm -67.12 -42.6 88.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.655 -0.702 . . . . 1.0 111.317 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -53.06 -47.08 68.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.314 -0.403 . . . . 1.0 111.575 -178.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -67.29 -37.81 84.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.466 -0.333 . . . . 1.0 111.265 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -62.25 -37.5 85.69 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.251 -0.431 . . . . 1.0 111.202 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -67.15 -38.58 85.72 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.288 -0.415 . . . . 1.0 111.901 -179.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1322 ' ' MET . . . . . . . . . . . . . 57.2 mtt -61.59 -43.07 99.53 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.634 -0.426 . . . . 1.0 111.049 -179.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -63.92 -46.99 90.15 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.857 -0.897 . . . . 1.0 110.857 -179.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -65.14 -43.13 92.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.817 0.341 . . . . 1.0 110.561 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -68.29 -41.51 80.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.073 -0.512 . . . . 1.0 111.229 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1326 ' ' MET . . . . . . . . . . . . . 48.2 ttp -63.1 -43.68 97.81 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.011 0.434 . . . . 1.0 110.253 -179.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -68.9 -29.56 67.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.771 -0.65 . . . . 1.0 110.602 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1328 ' ' ALA . . . . . 0.53 ' O ' ' CD2' ' A' 1332 ' ' TYR . . . -59.63 -25.31 64.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.105 -0.498 . . . . 1.0 111.777 -178.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 96.2 mt -61.17 -41.52 96.93 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.943 -0.303 . . . . 1.0 110.967 -179.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -89.29 11.22 19.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.565 -0.289 . . . . 1.0 111.352 -178.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 64.1 mttm -129.52 40.69 3.56 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 112.084 0.402 . . . . 1.0 112.084 -178.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 1332 ' ' TYR . . . . . 0.53 ' CD2' ' O ' ' A' 1328 ' ' ALA . 16.0 m-85 -116.01 137.32 52.22 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 120.95 0.405 . . . . 1.0 110.298 179.202 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1333 ' ' ASN . . . . . 0.425 ' O ' ' C ' ' A' 1334 ' ' PHE . 97.1 m-20 -137.12 167.51 21.41 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.866 -0.607 . . . . 1.0 109.397 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1334 ' ' PHE . . . . . 0.425 ' C ' ' O ' ' A' 1333 ' ' ASN . 75.0 m-85 -30.68 94.06 0.06 OUTLIER Pre-proline 0 N--CA 1.47 0.532 0 O-C-N 123.518 0.511 . . . . 1.0 111.592 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1335 ' ' PRO . . . . . 0.436 ' O ' ' O ' ' A' 1336 ' ' GLN . 44.5 Cg_endo -91.4 -163.98 0.13 Allowed 'Trans proline' 0 N--CA 1.488 1.159 0 C-N-CA 122.942 2.428 . . . . 1.0 112.431 -179.086 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1336 ' ' GLN . . . . . 0.436 ' O ' ' O ' ' A' 1335 ' ' PRO . 13.5 mm100 -37.49 159.33 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.817 -0.629 . . . . 1.0 110.793 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 1337 ' ' MET . . . . . . . . . . . . . 27.4 ttt . . . . . 0 C--O 1.22 -0.476 0 CA-C-O 117.884 -1.055 . . . . 1.0 110.625 -179.665 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 34.6 tptt . . . . . 0 CA--C 1.526 0.048 0 CA-C-O 121.01 0.433 . . . . 1.0 110.423 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A 1263 ' ' SER . . . . . . . . . . . . . 68.3 m -57.5 -41.39 80.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.706 -0.679 . . . . 1.0 111.112 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 25.0 mp0 -58.97 -43.99 91.46 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.703 -0.399 . . . . 1.0 110.209 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1265 ' ' LEU . . . . . 0.482 ' CD2' ' OH ' ' A' 1332 ' ' TYR . 36.9 mt -63.61 -41.95 98.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 1.0 110.505 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -63.46 -44.73 93.63 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.346 -0.388 . . . . 1.0 110.718 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -64.02 -39.76 94.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.127 -0.488 . . . . 1.0 110.689 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1268 ' ' CYS . . . . . . . . . . . . . 98.3 m -64.92 -35.74 82.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.02 -0.536 . . . . 1.0 110.859 -179.522 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 79.1 m -60.44 -37.51 81.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.443 -0.344 . . . . 1.0 110.771 -179.284 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 89.1 mt -63.86 -39.31 93.9 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.214 -0.448 . . . . 1.0 111.106 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1271 ' ' THR . . . . . . . . . . . . . 68.7 p -65.06 -30.06 71.0 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.504 -0.316 . . . . 1.0 111.478 -179.162 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 77.6 mt -77.67 84.48 4.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.496 -0.32 . . . . 1.0 111.492 -178.826 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -119.74 130.09 54.81 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 110.139 -0.319 . . . . 1.0 110.139 178.696 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1274 ' ' THR . . . . . . . . . . . . . 21.4 m -129.65 133.4 47.09 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 120.773 0.32 . . . . 1.0 110.434 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 39.9 tp10 -111.54 142.72 43.47 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.356 -0.384 . . . . 1.0 110.202 179.814 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 88.2 7.11 73.82 Favored Glycine 0 CA--C 1.527 0.815 0 N-CA-C 111.201 -0.76 . . . . 1.0 111.201 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 49.4 mtpt -138.63 -164.71 1.69 Allowed 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 110.239 -0.282 . . . . 1.0 110.239 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -92.43 151.05 41.01 Favored Pre-proline 0 CA--C 1.531 0.238 0 N-CA-C 109.87 -0.418 . . . . 1.0 109.87 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.09 76.13 1.29 Allowed 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.278 1.986 . . . . 1.0 112.22 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -90.83 121.5 32.75 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.815 -0.439 . . . . 1.0 109.815 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 13.1 mt -148.67 133.51 9.12 Favored Pre-proline 0 CA--C 1.535 0.398 0 N-CA-C 109.953 -0.388 . . . . 1.0 109.953 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.09 111.82 3.27 Favored 'Trans proline' 0 N--CA 1.495 1.597 0 C-N-CA 121.323 1.349 . . . . 1.0 111.514 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 89.5 mt -121.59 154.47 36.69 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.033 0.444 . . . . 1.0 110.867 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1284 ' ' TYR . . . . . 0.443 ' CE1' HD13 ' A' 1265 ' ' LEU . 4.2 m-85 -79.0 140.45 37.97 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.876 -0.602 . . . . 1.0 110.892 -179.692 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 79.7 tttt -145.97 115.13 7.04 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.515 -0.766 . . . . 1.0 109.575 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1286 ' ' THR . . . . . . . . . . . . . 27.2 m -63.83 131.88 49.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.843 0.354 . . . . 1.0 110.686 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 72.8 mt -87.74 -172.2 3.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.046 -0.525 . . . . 1.0 110.302 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -107.67 137.61 45.39 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.285 -0.416 . . . . 1.0 110.052 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1289 ' ' THR . . . . . . . . . . . . . 19.0 p -75.49 115.95 15.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.095 -0.502 . . . . 1.0 111.286 -178.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 16.6 m -136.11 122.15 30.31 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-N 116.051 -0.522 . . . . 1.0 109.836 178.78 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.86 159.25 27.33 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 110.947 -0.861 . . . . 1.0 110.947 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -63.67 -38.91 37.71 Favored 'Trans proline' 0 C--N 1.308 -1.593 0 C-N-CA 122.371 2.047 . . . . 1.0 111.132 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1293 ' ' SER . . . . . . . . . . . . . 14.3 t -91.86 165.13 13.4 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.728 -0.669 . . . . 1.0 110.55 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -61.38 -9.5 5.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.172 0.511 . . . . 1.0 109.75 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -62.91 144.98 56.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.481 -0.782 . . . . 1.0 111.11 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -103.01 130.35 50.08 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.097 -0.501 . . . . 1.0 110.685 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1297 ' ' THR . . . . . . . . . . . . . 92.3 m -125.92 127.65 46.33 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.923 -0.58 . . . . 1.0 110.093 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -101.44 127.2 48.21 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.001 0.429 . . . . 1.0 110.819 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1299 ' ' THR . . . . . . . . . . . . . 64.0 m -127.56 130.56 49.3 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.86 -0.609 . . . . 1.0 110.313 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 54.3 t -116.77 128.0 74.26 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 N-CA-C 109.139 -0.689 . . . . 1.0 109.139 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -130.49 142.35 50.49 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.13 0.49 . . . . 1.0 111.657 -179.065 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 2.7 t -112.28 127.43 69.49 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 N-CA-C 108.801 -0.814 . . . . 1.0 108.801 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -115.98 139.54 50.15 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.146 0.498 . . . . 1.0 111.449 -178.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 52.7 t80 -128.38 102.31 6.59 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.6 -0.727 . . . . 1.0 110.212 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 64.4 mttp 47.01 36.58 4.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.108 -0.497 . . . . 1.0 111.05 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 90.99 4.34 69.22 Favored Glycine 0 CA--C 1.527 0.815 0 N-CA-C 111.946 -0.462 . . . . 1.0 111.946 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -110.05 119.77 40.36 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 120.992 0.425 . . . . 1.0 110.356 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 62.0 ttp180 -76.08 136.43 39.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.931 -0.577 . . . . 1.0 110.634 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 42.1 pt -138.56 20.17 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-N 116.36 -0.382 . . . . 1.0 110.169 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -151.03 148.35 19.37 Favored Glycine 0 CA--C 1.523 0.587 0 N-CA-C 111.062 -0.815 . . . . 1.0 111.062 -179.724 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 25.0 p -171.35 116.37 0.42 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.804 0.335 . . . . 1.0 110.185 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -175.57 131.05 1.83 Allowed Glycine 0 CA--C 1.523 0.583 0 N-CA-C 111.018 -0.833 . . . . 1.0 111.018 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 68.8 mttm -109.95 146.0 35.97 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.778 0.323 . . . . 1.0 110.373 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -167.16 173.2 42.36 Favored Glycine 0 CA--C 1.524 0.634 0 N-CA-C 111.139 -0.785 . . . . 1.0 111.139 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -69.41 -75.08 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.677 0 C-N-CA 122.592 2.195 . . . . 1.0 111.918 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1316 ' ' SER . . . . . . . . . . . . . 95.5 p -79.0 158.2 27.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.926 0.393 . . . . 1.0 110.943 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 47.5 mm -63.88 -44.66 98.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.0 -0.545 . . . . 1.0 111.209 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -54.48 -46.34 73.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.536 -0.302 . . . . 1.0 111.125 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -62.89 -38.77 92.24 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.842 -0.343 . . . . 1.0 110.865 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -64.63 -38.49 91.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.425 -0.352 . . . . 1.0 111.08 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1321 ' ' GLU . . . . . 0.413 ' O ' ' HB2' ' A' 1325 ' ' ALA . 98.2 mt-10 -66.41 -36.46 82.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.299 -0.41 . . . . 1.0 111.404 -179.381 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1322 ' ' MET . . . . . . . . . . . . . 95.1 mmm -62.74 -42.65 99.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.323 -0.399 . . . . 1.0 111.469 -179.109 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -66.7 -49.68 53.69 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 120.711 -0.757 . . . . 1.0 111.528 -179.195 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -70.27 -36.22 74.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.792 0.329 . . . . 1.0 111.534 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1325 ' ' ALA . . . . . 0.413 ' HB2' ' O ' ' A' 1321 ' ' GLU . . . -56.01 -50.27 71.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.23 -0.441 . . . . 1.0 111.729 -178.547 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1326 ' ' MET . . . . . . . . . . . . . 66.4 mtt -65.57 -38.56 89.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.744 0.307 . . . . 1.0 111.484 -179.473 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -63.52 -36.98 85.58 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.348 -0.387 . . . . 1.0 111.549 -179.053 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1328 ' ' ALA . . . . . 0.524 ' O ' ' CD2' ' A' 1332 ' ' TYR . . . -58.69 -25.76 63.19 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.188 0.44 . . . . 1.0 112.188 -178.757 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 1.9 mm? -62.05 -41.45 98.14 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.679 -0.408 . . . . 1.0 111.148 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -93.62 4.57 53.75 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.142 0.423 . . . . 1.0 112.142 -178.524 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 67.5 mttm -117.7 20.65 13.35 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.269 0.47 . . . . 1.0 112.269 -178.215 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1332 ' ' TYR . . . . . 0.524 ' CD2' ' O ' ' A' 1328 ' ' ALA . 11.4 m-85 -83.54 137.76 33.71 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.122 0.487 . . . . 1.0 110.502 179.249 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -117.33 -175.98 2.91 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.521 -0.763 . . . . 1.0 110.17 179.645 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 53.8 m-85 -34.99 151.05 0.07 OUTLIER Pre-proline 0 CA--C 1.538 0.484 0 CA-C-N 115.977 -0.556 . . . . 1.0 111.115 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -69.61 -178.9 2.5 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 C-N-CA 122.419 2.079 . . . . 1.0 112.133 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 1336 ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 . . . . . 0 N--CA 1.462 0.175 0 CA-C-O 121.168 0.509 . . . . 1.0 111.205 -179.911 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 55.0 mtpt . . . . . 0 CA--C 1.53 0.18 0 CA-C-O 120.565 0.221 . . . . 1.0 111.156 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A 1263 ' ' SER . . . . . . . . . . . . . 50.4 m -61.0 -42.66 98.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.891 0.376 . . . . 1.0 110.701 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1264 ' ' GLN . . . . . 0.431 ' O ' ' SG ' ' A' 1268 ' ' CYS . 28.0 mm100 -65.08 -46.88 79.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.102 -0.499 . . . . 1.0 111.497 -179.451 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1265 ' ' LEU . . . . . . . . . . . . . 92.7 mt -64.66 -42.03 95.69 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.35 -0.386 . . . . 1.0 111.59 -179.256 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -64.9 -43.54 92.52 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.47 -0.492 . . . . 1.0 110.575 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 -68.19 -38.61 82.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.087 -0.506 . . . . 1.0 110.944 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1268 ' ' CYS . . . . . 0.431 ' SG ' ' O ' ' A' 1264 ' ' GLN . 93.5 m -64.9 -36.48 84.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.45 -0.341 . . . . 1.0 111.047 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 84.0 m -56.5 -36.69 69.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.753 0.311 . . . . 1.0 110.839 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 97.2 mt -63.25 -40.87 98.64 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.329 -0.396 . . . . 1.0 111.042 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1271 ' ' THR . . . . . 0.409 ' OG1' ' O ' ' A' 1268 ' ' CYS . 68.3 p -67.76 -26.31 66.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.195 -0.457 . . . . 1.0 111.369 -179.345 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 82.2 mt -85.68 86.65 7.35 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.823 0.344 . . . . 1.0 111.382 -178.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -119.19 117.98 30.09 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.071 -0.513 . . . . 1.0 110.112 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1274 ' ' THR . . . . . 0.427 ' OG1' ' OE1' ' A' 1336 ' ' GLN . 6.8 m -129.04 131.24 47.32 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 120.844 0.355 . . . . 1.0 110.268 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -113.03 134.97 54.28 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.207 -0.451 . . . . 1.0 110.304 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 89.67 7.11 69.32 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 111.38 -0.688 . . . . 1.0 111.38 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 50.6 mtpt -138.41 -168.75 2.44 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.79 0.329 . . . . 1.0 110.613 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -93.38 136.02 24.77 Favored Pre-proline 0 CA--C 1.536 0.409 0 CA-C-N 116.11 -0.495 . . . . 1.0 110.104 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -76.49 87.74 1.42 Allowed 'Trans proline' 0 N--CA 1.493 1.461 0 C-N-CA 121.869 1.713 . . . . 1.0 112.353 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1280 ' ' ASP . . . . . 0.48 ' OD2' ' NZ ' ' A' 1305 ' ' LYS . 78.3 m-20 -86.49 124.39 32.76 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.726 -0.472 . . . . 1.0 109.726 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1281 ' ' ILE . . . . . 0.426 HD13 HG21 ' A' 1281 ' ' ILE . 2.5 mt -148.02 124.08 5.34 Favored Pre-proline 0 CA--C 1.54 0.579 0 N-CA-C 109.972 -0.381 . . . . 1.0 109.972 -179.177 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 45.0 Cg_exo -51.79 131.44 37.97 Favored 'Trans proline' 0 N--CA 1.494 1.501 0 CA-C-N 120.246 1.123 . . . . 1.0 111.828 179.142 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 55.6 mt -134.74 152.49 51.8 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.028 -0.533 . . . . 1.0 109.871 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1284 ' ' TYR . . . . . 0.465 ' CD1' ' OE1' ' A' 1321 ' ' GLU . 84.6 m-85 -78.46 137.8 38.14 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.043 0.449 . . . . 1.0 111.152 -179.655 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 85.7 tttt -139.01 104.81 5.13 Favored 'General case' 0 N--CA 1.462 0.175 0 N-CA-C 108.918 -0.771 . . . . 1.0 108.918 178.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1286 ' ' THR . . . . . . . . . . . . . 24.0 m -63.17 134.93 56.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.406 0.622 . . . . 1.0 112.174 -178.218 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 70.3 mt -87.0 -169.22 2.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.179 -0.919 . . . . 1.0 109.998 179.602 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -106.44 136.88 45.43 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 109.593 -0.521 . . . . 1.0 109.593 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1289 ' ' THR . . . . . . . . . . . . . 3.5 p -88.87 115.09 26.16 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.156 -0.475 . . . . 1.0 111.452 -178.776 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 7.1 m -133.55 123.56 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 121.034 0.445 . . . . 1.0 110.153 178.728 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.29 166.42 26.41 Favored Glycine 0 CA--C 1.524 0.644 0 N-CA-C 110.674 -0.97 . . . . 1.0 110.674 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -67.9 -42.89 5.73 Favored 'Trans proline' 0 C--N 1.306 -1.667 0 C-N-CA 122.467 2.112 . . . . 1.0 111.125 179.217 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1293 ' ' SER . . . . . . . . . . . . . 31.4 t -90.3 165.51 13.85 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.621 -0.718 . . . . 1.0 110.484 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -58.11 -14.49 6.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.281 -0.418 . . . . 1.0 110.207 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -65.92 142.0 58.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.922 -0.581 . . . . 1.0 110.72 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -110.53 145.19 38.19 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.211 -0.45 . . . . 1.0 110.837 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1297 ' ' THR . . . . . . . . . . . . . 94.9 m -116.25 124.31 49.88 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.264 -0.643 . . . . 1.0 109.264 178.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -96.37 119.83 35.58 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.057 0.456 . . . . 1.0 110.786 -179.509 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1299 ' ' THR . . . . . . . . . . . . . 88.8 m -127.35 127.97 45.11 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.777 -0.647 . . . . 1.0 110.321 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1300 ' ' VAL . . . . . 0.548 HG11 ' OE2' ' A' 1321 ' ' GLU . 25.3 t -118.26 128.43 75.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 N-CA-C 109.58 -0.526 . . . . 1.0 109.58 179.636 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -130.69 148.7 52.51 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.3 -0.409 . . . . 1.0 110.228 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 3.0 t -105.91 125.95 61.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 N-CA-C 109.54 -0.541 . . . . 1.0 109.54 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -107.3 129.0 54.94 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.904 0.383 . . . . 1.0 110.878 -179.708 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 88.7 t80 -139.08 119.73 14.1 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 115.886 -0.597 . . . . 1.0 109.698 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1305 ' ' LYS . . . . . 0.48 ' NZ ' ' OD2' ' A' 1280 ' ' ASP . 72.7 mmtt 49.25 32.51 4.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.388 -0.369 . . . . 1.0 110.115 -179.637 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 78.35 21.48 69.89 Favored Glycine 0 CA--C 1.526 0.74 0 C-N-CA 121.076 -0.583 . . . . 1.0 111.816 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -121.08 130.86 53.94 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 116.987 0.393 . . . . 1.0 110.865 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 44.5 ttm180 -87.44 90.92 8.55 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.241 -0.651 . . . . 1.0 109.241 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 34.7 pt -81.35 -17.29 12.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 112.715 0.635 . . . . 1.0 112.715 -178.064 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -147.51 156.8 27.14 Favored Glycine 0 CA--C 1.525 0.669 0 C-N-CA 120.389 -0.91 . . . . 1.0 112.089 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 2.6 p -177.0 144.5 0.44 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.395 -0.403 . . . . 1.0 109.99 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -165.57 158.86 31.9 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 111.093 -0.803 . . . . 1.0 111.093 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 68.2 mttm -129.02 141.2 51.32 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.678 0.275 . . . . 1.0 110.269 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -164.33 -179.76 38.68 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.812 -0.915 . . . . 1.0 110.812 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -58.93 -59.82 0.42 Allowed 'Trans proline' 0 N--CA 1.494 1.521 0 C-N-CA 122.132 1.888 . . . . 1.0 112.017 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1316 ' ' SER . . . . . 0.438 ' OG ' ' OE1' ' A' 1319 ' ' GLN . 6.5 p -103.33 168.97 8.82 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.114 -0.494 . . . . 1.0 110.658 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 43.4 mt -67.05 -41.54 87.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.874 -0.603 . . . . 1.0 110.955 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -51.57 -41.41 61.12 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.463 -0.335 . . . . 1.0 111.215 -178.772 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1319 ' ' GLN . . . . . 0.438 ' OE1' ' OG ' ' A' 1316 ' ' SER . 7.3 mp0 -64.54 -39.77 94.36 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.753 -0.379 . . . . 1.0 110.052 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -65.88 -37.4 86.04 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.169 -0.469 . . . . 1.0 110.99 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1321 ' ' GLU . . . . . 0.548 ' OE2' HG11 ' A' 1300 ' ' VAL . 80.5 mm-40 -61.08 -50.22 74.16 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.452 -0.34 . . . . 1.0 110.862 -179.67 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1322 ' ' MET . . . . . . . . . . . . . 63.7 mtm -66.51 -38.95 88.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.137 -0.483 . . . . 1.0 111.553 -179.337 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -62.42 -48.28 83.29 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.891 -0.884 . . . . 1.0 110.891 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -66.12 -35.33 80.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.926 0.393 . . . . 1.0 110.601 179.494 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -57.69 -48.64 78.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.903 -0.589 . . . . 1.0 112.031 -179.03 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1326 ' ' MET . . . . . . . . . . . . . 93.8 mmm -63.67 -40.57 97.17 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.809 -0.356 . . . . 1.0 111.598 -179.014 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -67.7 -28.79 67.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.731 0.3 . . . . 1.0 111.173 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1328 ' ' ALA . . . . . . . . . . . . . . . -62.04 -35.45 78.63 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.414 0.524 . . . . 1.0 112.414 -178.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.93 -40.47 93.35 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 120.923 -0.311 . . . . 1.0 111.329 -178.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -75.09 15.07 0.45 Allowed 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.258 0.466 . . . . 1.0 112.258 -178.584 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 97.0 mttt -146.24 45.39 1.24 Allowed 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 113.061 0.763 . . . . 1.0 113.061 -178.565 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1332 ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -101.96 153.32 19.99 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.145 0.497 . . . . 1.0 110.342 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -127.74 -177.47 4.12 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.508 -0.769 . . . . 1.0 110.629 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 1334 ' ' PHE . . . . . 0.477 ' O ' ' O ' ' A' 1335 ' ' PRO . 61.7 m-85 -42.48 153.98 0.29 Allowed Pre-proline 0 CA--C 1.534 0.355 0 CA-C-N 115.815 -0.63 . . . . 1.0 110.662 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1335 ' ' PRO . . . . . 0.477 ' O ' ' O ' ' A' 1334 ' ' PHE . 77.3 Cg_exo -39.73 174.77 0.0 OUTLIER 'Trans proline' 0 N--CA 1.496 1.66 0 C-N-CA 122.826 2.351 . . . . 1.0 113.56 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 1336 ' ' GLN . . . . . 0.427 ' OE1' ' OG1' ' A' 1274 ' ' THR . 11.2 mt-30 . . . . . 0 N--CA 1.462 0.174 0 CA-C-N 115.382 -0.826 . . . . 1.0 110.99 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 87.7 mttt . . . . . 0 N--CA 1.463 0.185 0 CA-C-O 120.975 0.417 . . . . 1.0 110.508 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A 1263 ' ' SER . . . . . . . . . . . . . 35.9 m -59.16 -31.23 68.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.697 -0.683 . . . . 1.0 111.681 -179.388 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -56.75 -53.01 62.67 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.705 -0.398 . . . . 1.0 111.49 -178.376 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1265 ' ' LEU . . . . . 0.489 ' O ' ' SG ' ' A' 1269 ' ' CYS . 15.9 mt -67.87 -39.29 83.75 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.671 -0.411 . . . . 1.0 111.037 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -57.72 -43.9 85.61 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.543 -0.299 . . . . 1.0 111.175 -179.218 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -64.06 -42.48 97.0 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.502 -0.479 . . . . 1.0 110.522 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1268 ' ' CYS . . . . . . . . . . . . . 91.5 m -70.7 -36.59 73.33 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.176 -0.466 . . . . 1.0 110.936 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1269 ' ' CYS . . . . . 0.489 ' SG ' ' O ' ' A' 1265 ' ' LEU . 87.9 m -62.43 -35.23 78.62 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.092 -0.503 . . . . 1.0 112.018 -178.724 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 81.5 mt -61.96 -39.43 92.11 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.889 -0.324 . . . . 1.0 110.738 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1271 ' ' THR . . . . . . . . . . . . . 58.0 p -65.36 -29.19 69.89 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.969 -0.292 . . . . 1.0 111.15 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 87.2 mt -74.66 86.88 2.15 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.798 -0.361 . . . . 1.0 110.59 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 100.0 mtt180 -118.41 116.04 25.89 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.269 -0.423 . . . . 1.0 110.131 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1274 ' ' THR . . . . . . . . . . . . . 3.0 m -124.28 124.64 42.85 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.875 0.369 . . . . 1.0 110.162 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -112.71 138.18 49.91 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.024 -0.535 . . . . 1.0 110.194 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 90.38 0.62 76.23 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.677 -0.969 . . . . 1.0 110.677 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 21.5 mtpp -135.31 -167.5 2.02 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.11 0.481 . . . . 1.0 110.589 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -94.28 130.17 34.83 Favored Pre-proline 0 CA--C 1.536 0.423 0 CA-C-N 115.713 -0.676 . . . . 1.0 109.606 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -78.15 110.24 2.84 Favored 'Trans proline' 0 N--CA 1.493 1.466 0 C-N-CA 121.798 1.666 . . . . 1.0 112.683 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -104.24 129.73 52.04 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.887 -0.597 . . . . 1.0 109.584 178.561 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1281 ' ' ILE . . . . . 0.409 HG21 HD13 ' A' 1281 ' ' ILE . 4.8 mt -147.31 121.95 5.14 Favored Pre-proline 0 CA--C 1.54 0.571 0 CA-C-O 119.303 -0.38 . . . . 1.0 110.308 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -56.27 141.89 88.13 Favored 'Trans proline' 0 N--CA 1.494 1.532 0 CA-C-N 120.337 1.156 . . . . 1.0 111.129 178.552 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 89.9 mt -139.12 160.67 39.24 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.724 0.297 . . . . 1.0 110.393 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1284 ' ' TYR . . . . . 0.531 ' CD1' ' OE1' ' A' 1321 ' ' GLU . 62.8 m-85 -78.52 139.73 38.62 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.123 0.487 . . . . 1.0 111.46 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -151.34 107.56 3.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.588 -0.733 . . . . 1.0 109.998 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1286 ' ' THR . . . . . . . . . . . . . 18.5 m -74.78 140.59 44.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.11 0.481 . . . . 1.0 111.063 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 73.3 mt -81.73 -169.93 2.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.637 -0.711 . . . . 1.0 110.672 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -107.08 136.4 47.0 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.9 -0.591 . . . . 1.0 109.561 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1289 ' ' THR . . . . . . . . . . . . . 57.3 p -83.27 115.05 21.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.982 0.42 . . . . 1.0 111.701 -178.505 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 9.4 m -143.9 122.19 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 115.682 -0.69 . . . . 1.0 109.449 178.38 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.46 172.37 24.33 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 111.113 -0.795 . . . . 1.0 111.113 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -72.14 -46.49 0.52 Allowed 'Trans proline' 0 C--N 1.307 -1.646 0 C-N-CA 122.494 2.129 . . . . 1.0 111.143 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1293 ' ' SER . . . . . . . . . . . . . 11.3 t -89.85 165.34 14.18 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.656 -0.702 . . . . 1.0 110.046 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 28.2 m170 -59.73 -18.96 46.9 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.621 -0.511 . . . . 1.0 109.621 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -59.76 144.15 49.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.812 -0.631 . . . . 1.0 109.963 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 85.2 mtm-85 -117.54 143.51 46.01 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.014 0.435 . . . . 1.0 111.038 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1297 ' ' THR . . . . . . . . . . . . . 91.8 m -120.17 127.28 52.33 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.734 -0.666 . . . . 1.0 109.808 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -99.82 116.41 31.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.026 0.441 . . . . 1.0 110.721 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1299 ' ' THR . . . . . . . . . . . . . 91.8 m -127.11 130.31 49.6 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.743 -0.662 . . . . 1.0 110.092 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 83.2 t -111.44 129.86 66.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 N-CA-C 109.734 -0.469 . . . . 1.0 109.734 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -129.25 140.91 51.28 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.077 0.465 . . . . 1.0 110.93 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 43.7 t -113.25 128.36 70.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 N-CA-C 108.65 -0.87 . . . . 1.0 108.65 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -113.66 141.37 47.31 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.029 0.443 . . . . 1.0 110.934 -178.56 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1304 ' ' PHE . . . . . 0.551 ' HZ ' HE22 ' A' 1336 ' ' GLN . 79.1 t80 -149.43 109.08 4.02 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.593 -0.731 . . . . 1.0 110.159 -179.534 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 49.87 30.07 3.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.281 -0.418 . . . . 1.0 110.808 179.758 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 86.04 1.97 86.33 Favored Glycine 0 CA--C 1.525 0.69 0 C-N-CA 121.317 -0.468 . . . . 1.0 112.06 178.785 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -106.5 115.95 31.09 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 110.132 -0.322 . . . . 1.0 110.132 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -72.52 130.16 40.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.466 . . . . 1.0 110.302 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 30.5 pt -122.46 23.23 4.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-N 116.484 -0.325 . . . . 1.0 110.906 -179.532 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -155.96 153.28 24.62 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 111.354 -0.699 . . . . 1.0 111.354 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1311 ' ' CYS . . . . . 0.412 ' SG ' ' OD2' ' A' 1327 ' ' ASP . 31.3 p -167.65 164.23 14.51 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.21 -0.293 . . . . 1.0 110.21 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . 121.92 157.64 10.07 Favored Glycine 0 N--CA 1.468 0.801 0 N-CA-C 110.939 -0.864 . . . . 1.0 110.939 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 68.6 mttm -129.61 151.3 50.37 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.93 0.395 . . . . 1.0 110.758 -179.563 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -159.49 163.72 33.64 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 110.434 -1.067 . . . . 1.0 110.434 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -64.58 -67.13 0.04 OUTLIER 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 122.408 2.072 . . . . 1.0 111.697 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1316 ' ' SER . . . . . . . . . . . . . 13.6 p -83.89 164.27 19.53 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.361 -0.381 . . . . 1.0 110.328 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 36.7 mm -65.29 -44.31 94.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.12 -0.491 . . . . 1.0 110.836 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -55.36 -42.99 74.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.085 -0.507 . . . . 1.0 111.712 -178.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -60.01 -41.75 92.83 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.593 -0.443 . . . . 1.0 110.708 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -68.55 -37.76 80.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.307 -0.406 . . . . 1.0 110.998 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1321 ' ' GLU . . . . . 0.531 ' OE1' ' CD1' ' A' 1284 ' ' TYR . 64.8 mm-40 -61.58 -45.35 94.51 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.305 -0.407 . . . . 1.0 111.821 -179.11 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1322 ' ' MET . . . . . 0.579 ' N ' ' SD ' ' A' 1322 ' ' MET . 0.1 OUTLIER -64.2 -41.08 97.23 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.805 -0.358 . . . . 1.0 111.366 -179.259 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -64.97 -43.39 95.98 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 120.799 -0.715 . . . . 1.0 111.847 -179.218 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -66.35 -38.21 87.08 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.737 0.273 . . . . 1.0 111.737 -179.125 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -61.03 -42.69 98.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.477 -0.328 . . . . 1.0 111.862 -178.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1326 ' ' MET . . . . . . . . . . . . . 2.0 tpt -62.74 -41.83 99.37 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.471 -0.492 . . . . 1.0 110.064 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1327 ' ' ASP . . . . . 0.412 ' OD2' ' SG ' ' A' 1311 ' ' CYS . 64.7 m-20 -65.04 -34.7 79.05 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.965 -0.561 . . . . 1.0 110.544 -179.383 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1328 ' ' ALA . . . . . 0.499 ' O ' ' CD2' ' A' 1332 ' ' TYR . . . -58.83 -23.75 61.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.307 -0.406 . . . . 1.0 111.45 -179.541 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 92.6 mt -62.48 -42.48 99.52 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.727 -0.389 . . . . 1.0 110.838 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -95.11 23.98 5.27 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.357 -0.383 . . . . 1.0 111.955 -178.493 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 97.3 mttt -137.82 42.55 2.29 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 120.697 -0.401 . . . . 1.0 111.072 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1332 ' ' TYR . . . . . 0.499 ' CD2' ' O ' ' A' 1328 ' ' ALA . 14.0 m-85 -115.15 145.98 41.83 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.285 0.564 . . . . 1.0 110.977 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -117.76 -176.71 3.09 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.368 -0.833 . . . . 1.0 108.819 178.729 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -41.8 148.7 0.44 Allowed Pre-proline 0 CA--C 1.536 0.405 0 C-N-CA 120.711 -0.396 . . . . 1.0 110.475 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -68.46 154.63 71.4 Favored 'Trans proline' 0 N--CA 1.497 1.72 0 C-N-CA 122.292 1.995 . . . . 1.0 111.763 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 1336 ' ' GLN . . . . . 0.551 HE22 ' HZ ' ' A' 1304 ' ' PHE . 73.5 mm-40 . . . . . 0 N--CA 1.462 0.133 0 CA-C-O 120.772 0.32 . . . . 1.0 110.26 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 56.8 mttp . . . . . 0 N--CA 1.467 0.397 0 N-CA-C 111.731 0.271 . . . . 1.0 111.731 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A 1263 ' ' SER . . . . . . . . . . . . . 64.8 m -52.09 -39.86 60.39 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.532 -0.467 . . . . 1.0 110.807 -179.398 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -63.26 -47.89 80.49 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.878 0.37 . . . . 1.0 110.495 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1265 ' ' LEU . . . . . 0.41 HD11 ' CE1' ' A' 1284 ' ' TYR . 88.2 mt -65.71 -39.76 91.54 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.114 -0.494 . . . . 1.0 111.413 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -54.1 -40.27 67.14 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 121.043 -0.263 . . . . 1.0 111.007 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -62.95 -42.41 99.81 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.728 -0.389 . . . . 1.0 110.425 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1268 ' ' CYS . . . . . 0.407 ' O ' ' OG1' ' A' 1271 ' ' THR . 90.4 m -66.28 -37.2 84.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.296 -0.411 . . . . 1.0 110.747 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 99.8 m -59.18 -35.38 73.48 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.261 -0.427 . . . . 1.0 110.964 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 86.2 mt -62.61 -40.89 98.38 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.335 -0.393 . . . . 1.0 110.991 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1271 ' ' THR . . . . . 0.407 ' OG1' ' O ' ' A' 1268 ' ' CYS . 74.3 p -65.68 -31.68 72.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.339 -0.391 . . . . 1.0 111.562 -179.131 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 72.1 mt -74.28 83.69 1.89 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.599 -0.44 . . . . 1.0 110.578 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 7.3 mmp_? -119.51 110.76 17.27 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.244 -0.435 . . . . 1.0 110.842 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1274 ' ' THR . . . . . . . . . . . . . 21.6 m -129.29 129.89 45.46 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 109.94 -0.393 . . . . 1.0 109.94 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -112.42 136.52 51.81 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.937 0.399 . . . . 1.0 110.705 -179.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 88.37 8.27 71.41 Favored Glycine 0 CA--C 1.526 0.747 0 CA-C-N 116.06 -0.518 . . . . 1.0 111.894 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 50.4 mtpt -138.91 -172.27 3.28 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.212 0.529 . . . . 1.0 111.113 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -94.5 108.95 40.29 Favored Pre-proline 0 CA--C 1.537 0.47 0 CA-C-N 115.275 -0.875 . . . . 1.0 109.41 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -80.97 92.95 1.03 Allowed 'Trans proline' 0 N--CA 1.491 1.33 0 C-N-CA 121.769 1.646 . . . . 1.0 112.476 -179.185 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -80.94 141.43 34.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.163 -0.471 . . . . 1.0 109.742 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 10.5 mt -141.51 133.0 13.48 Favored Pre-proline 0 CA--C 1.536 0.417 0 N-CA-C 110.066 -0.346 . . . . 1.0 110.066 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -76.12 120.0 5.54 Favored 'Trans proline' 0 N--CA 1.491 1.342 0 C-N-CA 121.538 1.492 . . . . 1.0 111.466 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1283 ' ' LEU . . . . . 0.404 HD12 ' N ' ' A' 1283 ' ' LEU . 11.0 mp -106.11 153.22 22.39 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.147 -0.479 . . . . 1.0 109.759 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1284 ' ' TYR . . . . . 0.41 ' CE1' HD11 ' A' 1265 ' ' LEU . 3.0 m-85 -77.14 141.26 40.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.289 0.566 . . . . 1.0 111.042 -179.321 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 64.3 tttm -136.57 124.89 23.27 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.313 -0.858 . . . . 1.0 109.471 179.518 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1286 ' ' THR . . . . . . . . . . . . . 59.3 m -85.65 129.87 34.71 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.918 0.389 . . . . 1.0 111.087 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 77.2 mt -82.95 -170.49 3.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.919 -0.582 . . . . 1.0 110.128 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -107.99 152.73 24.08 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.097 -0.502 . . . . 1.0 109.909 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1289 ' ' THR . . . . . . . . . . . . . 73.3 p -86.53 113.21 22.25 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.896 0.379 . . . . 1.0 111.427 -179.1 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 3.4 m -149.43 122.57 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.916 -0.584 . . . . 1.0 109.915 178.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -141.85 166.85 26.14 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.123 -0.791 . . . . 1.0 111.123 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -63.27 -47.22 8.29 Favored 'Trans proline' 0 C--N 1.307 -1.609 0 C-N-CA 122.761 2.308 . . . . 1.0 111.077 179.263 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1293 ' ' SER . . . . . . . . . . . . . 31.2 t -85.49 165.36 17.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.537 -0.756 . . . . 1.0 110.416 179.56 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 17.9 m170 -59.45 -14.91 14.21 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.876 -0.416 . . . . 1.0 109.876 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -65.33 144.49 57.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.835 -0.62 . . . . 1.0 111.317 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -105.67 136.46 45.24 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.059 -0.519 . . . . 1.0 110.409 179.525 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1297 ' ' THR . . . . . . . . . . . . . 55.5 m -124.33 127.91 48.31 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 109.871 -0.418 . . . . 1.0 109.871 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -96.95 123.5 40.69 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.928 0.395 . . . . 1.0 110.251 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1299 ' ' THR . . . . . . . . . . . . . 99.6 m -126.76 130.5 50.44 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.012 -0.54 . . . . 1.0 110.722 -179.625 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 56.5 t -117.59 129.88 73.35 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.19 0 N-CA-C 109.076 -0.713 . . . . 1.0 109.076 179.266 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -129.01 147.73 50.9 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.146 0.498 . . . . 1.0 111.104 -179.088 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 29.5 t -114.16 129.84 69.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.555 -0.748 . . . . 1.0 109.055 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -113.59 141.44 47.17 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.212 0.53 . . . . 1.0 111.825 -178.723 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1304 ' ' PHE . . . . . 0.618 ' CE1' ' NE2' ' A' 1336 ' ' GLN . 80.1 t80 -137.58 100.58 4.25 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.242 -0.89 . . . . 1.0 109.355 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 50.7 mtmt 43.75 39.81 2.71 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.233 -0.439 . . . . 1.0 110.883 -178.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 88.53 6.37 73.7 Favored Glycine 0 CA--C 1.528 0.902 0 CA-C-N 116.266 -0.425 . . . . 1.0 112.361 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -112.45 121.47 44.92 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.854 0.359 . . . . 1.0 110.288 179.528 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 37.5 ttm180 -80.37 134.24 36.01 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.126 -0.488 . . . . 1.0 110.699 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 36.2 pt -131.25 9.71 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-N 116.152 -0.476 . . . . 1.0 110.442 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -159.27 151.7 22.6 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.897 -0.881 . . . . 1.0 110.897 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 9.2 t -170.8 47.1 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.76 0.314 . . . . 1.0 110.723 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1312 ' ' GLY . . . . . 0.555 ' H ' ' HB2' ' A' 1324 ' ' ALA . . . -75.77 149.61 38.4 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 111.231 -0.748 . . . . 1.0 111.231 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -136.2 149.14 48.44 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 110.137 -0.32 . . . . 1.0 110.137 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -177.94 163.47 31.74 Favored Glycine 0 CA--C 1.53 1.018 0 N-CA-C 110.663 -0.975 . . . . 1.0 110.663 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -53.7 -45.8 38.4 Favored 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 121.551 1.501 . . . . 1.0 112.16 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1316 ' ' SER . . . . . . . . . . . . . 91.1 p -105.32 161.99 13.82 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.005 0.431 . . . . 1.0 111.189 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 46.2 mm -64.97 -44.7 96.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.712 -0.677 . . . . 1.0 110.9 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -55.75 -44.04 77.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.146 -0.479 . . . . 1.0 111.124 -178.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -66.77 -39.38 87.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.509 -0.314 . . . . 1.0 110.881 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -65.21 -39.68 93.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 1.0 111.405 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -66.8 -35.54 80.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.588 -0.278 . . . . 1.0 111.291 -179.341 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1322 ' ' MET . . . . . . . . . . . . . 59.7 mtt -62.38 -42.17 99.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.515 -0.311 . . . . 1.0 110.769 -179.281 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -67.35 -43.32 88.38 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 111.196 -0.762 . . . . 1.0 111.196 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1324 ' ' ALA . . . . . 0.555 ' HB2' ' H ' ' A' 1312 ' ' GLY . . . -67.48 -39.47 85.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.725 0.298 . . . . 1.0 111.31 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -64.66 -41.22 96.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.438 -0.346 . . . . 1.0 111.599 -179.135 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1326 ' ' MET . . . . . . . . . . . . . 22.3 tpp -61.37 -48.56 80.72 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.87 -0.332 . . . . 1.0 110.436 -179.218 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -65.49 -37.46 86.87 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.998 -0.546 . . . . 1.0 111.186 -179.765 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1328 ' ' ALA . . . . . 0.531 ' O ' ' CD2' ' A' 1332 ' ' TYR . . . -56.47 -25.05 49.83 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 111.973 0.361 . . . . 1.0 111.973 -178.535 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 78.3 mt -62.61 -42.23 99.46 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.98 0.363 . . . . 1.0 111.98 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -95.19 23.89 5.4 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 111.994 0.368 . . . . 1.0 111.994 -178.597 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -132.44 34.46 3.72 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 121.197 -0.201 . . . . 1.0 110.973 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1332 ' ' TYR . . . . . 0.531 ' CD2' ' O ' ' A' 1328 ' ' ALA . 29.2 m-85 -111.5 139.38 46.98 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.325 0.583 . . . . 1.0 110.956 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1333 ' ' ASN . . . . . 0.451 ' O ' ' O ' ' A' 1334 ' ' PHE . 89.3 m-20 -102.78 -175.46 2.82 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 115.141 -0.936 . . . . 1.0 110.187 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 1334 ' ' PHE . . . . . 0.451 ' O ' ' O ' ' A' 1333 ' ' ASN . 0.5 OUTLIER -49.27 -179.56 0.03 OUTLIER Pre-proline 0 CA--C 1.539 0.542 0 N-CA-C 109.024 -0.732 . . . . 1.0 109.024 179.408 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -59.34 145.11 98.88 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 121.704 1.603 . . . . 1.0 111.693 -179.316 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 1336 ' ' GLN . . . . . 0.618 ' NE2' ' CE1' ' A' 1304 ' ' PHE . 1.3 mm100 . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.056 -0.52 . . . . 1.0 110.53 -179.293 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 18.7 pttp . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.795 0.331 . . . . 1.0 110.773 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A 1263 ' ' SER . . . . . . . . . . . . . 58.2 m -61.13 -32.13 71.83 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.133 -0.485 . . . . 1.0 110.623 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1264 ' ' GLN . . . . . 0.501 ' O ' ' SG ' ' A' 1268 ' ' CYS . 28.3 mp0 -57.04 -49.55 75.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.22 -0.446 . . . . 1.0 110.986 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1265 ' ' LEU . . . . . . . . . . . . . 34.4 mt -63.39 -40.6 97.67 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.762 -0.375 . . . . 1.0 110.605 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -63.71 -45.45 89.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.352 -0.386 . . . . 1.0 110.789 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -70.51 -39.61 74.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.447 -0.342 . . . . 1.0 111.236 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1268 ' ' CYS . . . . . 0.501 ' SG ' ' O ' ' A' 1264 ' ' GLN . 89.2 m -60.93 -35.57 77.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.46 -0.336 . . . . 1.0 111.376 -179.317 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 83.9 m -54.71 -37.95 66.46 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.864 -0.335 . . . . 1.0 111.005 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1270 ' ' LEU . . . . . 0.457 HD22 ' N ' ' A' 1270 ' ' LEU . 3.6 mm? -64.89 -39.86 94.2 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.931 -0.308 . . . . 1.0 111.07 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1271 ' ' THR . . . . . . . . . . . . . 76.6 p -66.06 -31.11 71.79 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.979 0.363 . . . . 1.0 111.979 -178.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 60.4 mt -81.09 89.54 5.98 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 120.626 -0.43 . . . . 1.0 110.83 -179.35 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -119.19 151.76 37.79 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.088 -0.506 . . . . 1.0 110.57 179.451 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1274 ' ' THR . . . . . . . . . . . . . 1.3 m -126.91 162.03 26.91 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 109.866 -0.42 . . . . 1.0 109.866 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1275 ' ' GLU . . . . . 0.545 ' C ' ' H ' ' A' 1277 ' ' LYS . 79.0 tt0 -87.97 100.18 12.71 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 112.273 0.472 . . . . 1.0 112.273 -178.603 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 57.83 -13.97 0.02 OUTLIER Glycine 0 CA--C 1.529 0.92 0 CA-C-N 115.729 -0.669 . . . . 1.0 113.353 178.251 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1277 ' ' LYS . . . . . 0.545 ' H ' ' C ' ' A' 1275 ' ' GLU . 48.9 mtpt -79.17 -166.25 0.9 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 117.694 0.747 . . . . 1.0 110.474 -179.747 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -93.45 110.14 44.96 Favored Pre-proline 0 CA--C 1.538 0.5 0 CA-C-N 116.039 -0.528 . . . . 1.0 109.813 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -80.65 114.85 3.03 Favored 'Trans proline' 0 N--CA 1.492 1.403 0 C-N-CA 121.867 1.712 . . . . 1.0 112.171 -179.099 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -83.82 133.54 34.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.001 -0.545 . . . . 1.0 109.982 179.459 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1281 ' ' ILE . . . . . 0.419 HD13 HG21 ' A' 1281 ' ' ILE . 1.8 mt -144.76 127.89 8.51 Favored Pre-proline 0 CA--C 1.538 0.501 0 CA-C-O 118.991 -0.528 . . . . 1.0 110.138 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 43.3 Cg_exo -52.95 135.57 58.62 Favored 'Trans proline' 0 N--CA 1.493 1.469 0 CA-C-N 120.482 1.208 . . . . 1.0 111.31 177.702 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 80.5 mt -122.32 152.63 39.91 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 109.596 -0.52 . . . . 1.0 109.596 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1284 ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -81.1 136.41 35.92 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.95 0.405 . . . . 1.0 110.914 -179.029 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 62.9 tttm -141.17 113.74 8.22 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.922 -0.581 . . . . 1.0 109.92 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1286 ' ' THR . . . . . . . . . . . . . 97.3 m -92.14 127.05 37.47 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.321 -0.399 . . . . 1.0 110.87 -179.693 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 60.0 mt -74.91 -172.45 1.61 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.276 -0.42 . . . . 1.0 109.948 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -108.13 126.01 52.27 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 120.84 0.352 . . . . 1.0 110.205 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1289 ' ' THR . . . . . . . . . . . . . 18.0 p -62.55 122.56 16.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.052 -0.522 . . . . 1.0 111.392 -179.054 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 15.8 m -153.25 122.62 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.809 -0.632 . . . . 1.0 109.773 178.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.01 166.67 26.25 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 111.039 -0.824 . . . . 1.0 111.039 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -66.03 -43.46 9.05 Favored 'Trans proline' 0 C--N 1.307 -1.638 0 C-N-CA 122.636 2.224 . . . . 1.0 110.852 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1293 ' ' SER . . . . . . . . . . . . . 30.3 t -89.97 165.26 14.17 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.394 -0.821 . . . . 1.0 110.126 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 71.0 m80 -59.11 -15.37 13.8 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.915 -0.402 . . . . 1.0 109.915 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -63.88 138.66 58.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.929 -0.578 . . . . 1.0 110.783 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 83.5 mtm-85 -101.87 142.41 33.23 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.193 -0.458 . . . . 1.0 110.766 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1297 ' ' THR . . . . . . . . . . . . . 94.6 m -118.73 124.33 47.04 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.958 -0.565 . . . . 1.0 109.8 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -98.51 116.03 29.86 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.362 -0.381 . . . . 1.0 110.491 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1299 ' ' THR . . . . . . . . . . . . . 91.0 m -126.88 132.39 50.93 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.115 -0.493 . . . . 1.0 110.598 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 75.4 t -121.57 131.37 73.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 N-CA-C 109.532 -0.544 . . . . 1.0 109.532 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -129.79 143.74 50.96 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.005 0.431 . . . . 1.0 110.551 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 58.0 t -109.67 129.38 64.64 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 CA-C-N 116.044 -0.526 . . . . 1.0 109.629 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -105.11 133.89 49.14 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.001 0.429 . . . . 1.0 111.332 -179.284 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 87.7 t80 -147.92 110.37 4.66 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.842 -0.617 . . . . 1.0 110.354 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 72.4 mmtt 54.58 31.19 14.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.313 -0.403 . . . . 1.0 110.647 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 78.93 6.36 88.71 Favored Glycine 0 CA--C 1.523 0.584 0 N-CA-C 111.068 -0.813 . . . . 1.0 111.068 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -112.11 117.06 31.57 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 109.975 -0.38 . . . . 1.0 109.975 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 42.3 ttm180 -73.37 128.24 34.92 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.732 -0.47 . . . . 1.0 109.732 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1309 ' ' ILE . . . . . 0.401 HD13 HG21 ' A' 1309 ' ' ILE . 24.3 pt -118.28 19.73 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-N 116.155 -0.475 . . . . 1.0 111.656 -178.308 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -161.54 147.3 13.57 Favored Glycine 0 CA--C 1.524 0.652 0 C-N-CA 120.499 -0.858 . . . . 1.0 111.418 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 44.9 t -171.11 126.77 0.68 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.719 0.295 . . . . 1.0 110.428 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -177.32 176.15 47.93 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 110.944 -0.862 . . . . 1.0 110.944 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 65.2 mttp -142.39 149.41 39.31 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.804 0.335 . . . . 1.0 110.413 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -164.96 168.5 39.18 Favored Glycine 0 CA--C 1.529 0.949 0 N-CA-C 110.635 -0.986 . . . . 1.0 110.635 179.566 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -53.92 -69.13 0.06 OUTLIER 'Trans proline' 0 N--CA 1.494 1.516 0 C-N-CA 121.602 1.535 . . . . 1.0 111.878 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1316 ' ' SER . . . . . . . . . . . . . 8.2 p -90.32 169.18 11.31 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.079 -0.509 . . . . 1.0 111.07 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 47.5 mm -63.9 -43.89 97.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.893 -0.594 . . . . 1.0 110.353 179.097 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 93.9 mm-40 -53.8 -40.79 66.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 1.0 110.967 -179.453 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -61.36 -42.39 98.62 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.392 -0.367 . . . . 1.0 110.621 -179.618 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -67.37 -37.68 83.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.25 -0.432 . . . . 1.0 110.991 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -64.84 -43.31 93.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.106 -0.497 . . . . 1.0 111.526 -179.036 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1322 ' ' MET . . . . . . . . . . . . . 78.2 mtm -64.52 -39.28 93.49 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.782 -0.367 . . . . 1.0 111.406 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -63.31 -48.36 79.76 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 111.037 -0.825 . . . . 1.0 111.037 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -69.92 -35.75 74.81 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.785 0.326 . . . . 1.0 111.083 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -59.71 -49.76 76.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.075 -0.511 . . . . 1.0 111.918 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1326 ' ' MET . . . . . . . . . . . . . 87.1 mmm -64.67 -42.39 95.41 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.723 -0.391 . . . . 1.0 111.67 -178.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -66.18 -33.62 76.17 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.329 -0.396 . . . . 1.0 111.312 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1328 ' ' ALA . . . . . . . . . . . . . . . -56.79 -20.83 24.47 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.169 -0.469 . . . . 1.0 112.194 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1329 ' ' LEU . . . . . 0.449 HD22 ' N ' ' A' 1329 ' ' LEU . 3.7 mm? -61.32 -42.66 99.05 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.585 -0.446 . . . . 1.0 111.16 -178.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1330 ' ' GLU . . . . . 0.521 ' N ' ' OE1' ' A' 1330 ' ' GLU . 50.4 mp0 -92.94 24.59 3.6 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 121.209 -0.196 . . . . 1.0 111.435 -179.161 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -128.66 10.32 6.06 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 111.702 0.26 . . . . 1.0 111.702 -178.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1332 ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -77.36 137.75 38.92 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 120.492 -0.483 . . . . 1.0 110.602 179.467 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 70.6 m-20 -107.32 -177.0 3.23 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.605 -0.725 . . . . 1.0 110.224 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 1334 ' ' PHE . . . . . 0.454 ' O ' ' O ' ' A' 1335 ' ' PRO . 19.3 m-85 -41.39 151.1 0.3 Allowed Pre-proline 0 CA--C 1.539 0.539 0 CA-C-N 116.215 -0.448 . . . . 1.0 110.438 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1335 ' ' PRO . . . . . 0.454 ' O ' ' O ' ' A' 1334 ' ' PHE . 87.9 Cg_exo -41.49 174.12 0.0 OUTLIER 'Trans proline' 0 N--CA 1.495 1.617 0 C-N-CA 122.433 2.088 . . . . 1.0 112.814 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 1336 ' ' GLN . . . . . 0.592 ' H ' ' CD ' ' A' 1336 ' ' GLN . 2.2 mp0 . . . . . 0 C--N 1.331 -0.221 0 CA-C-N 115.816 -0.629 . . . . 1.0 110.378 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 52.7 pttt . . . . . 0 CA--C 1.528 0.103 0 CA-C-O 121.01 0.433 . . . . 1.0 110.659 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A 1263 ' ' SER . . . . . . . . . . . . . 47.8 m -61.45 -35.7 78.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.12 -0.491 . . . . 1.0 111.017 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -58.46 -52.52 65.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.312 -0.404 . . . . 1.0 111.433 -179.069 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1265 ' ' LEU . . . . . . . . . . . . . 8.8 mt -65.12 -40.03 93.92 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.902 -0.319 . . . . 1.0 110.784 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 20.2 mm100 -62.29 -43.36 99.01 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 121.033 -0.267 . . . . 1.0 110.89 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -65.63 -31.51 72.57 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.792 0.33 . . . . 1.0 110.814 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1268 ' ' CYS . . . . . 0.43 ' O ' ' OG1' ' A' 1271 ' ' THR . 85.3 m -62.8 -36.5 83.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.378 -0.373 . . . . 1.0 111.119 -179.419 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 93.1 m -60.48 -37.28 80.53 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.88 -0.328 . . . . 1.0 111.036 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1270 ' ' LEU . . . . . 0.489 ' N ' HD12 ' A' 1270 ' ' LEU . 10.9 mp -63.48 -40.42 97.05 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.802 -0.359 . . . . 1.0 110.618 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1271 ' ' THR . . . . . 0.43 ' OG1' ' O ' ' A' 1268 ' ' CYS . 69.2 p -64.67 -31.3 72.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.452 -0.34 . . . . 1.0 111.426 -179.051 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 87.8 mt -69.93 84.04 0.49 Allowed 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.303 -0.559 . . . . 1.0 110.577 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -106.1 136.66 45.39 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.248 -0.433 . . . . 1.0 110.228 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1274 ' ' THR . . . . . . . . . . . . . 7.1 m -127.24 155.65 43.14 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 109.85 -0.426 . . . . 1.0 109.85 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -66.65 90.59 0.17 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.976 0.417 . . . . 1.0 111.469 -178.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 54.62 40.57 70.99 Favored Glycine 0 CA--C 1.525 0.692 0 CA-C-N 115.832 -0.622 . . . . 1.0 112.434 178.633 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 42.4 mtpt -140.4 178.92 6.96 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.508 0.671 . . . . 1.0 111.885 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -117.74 105.95 46.88 Favored Pre-proline 0 CA--C 1.539 0.538 0 CA-C-N 114.753 -1.112 . . . . 1.0 109.271 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -81.14 163.66 19.95 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 C-N-CA 121.776 1.65 . . . . 1.0 112.203 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -79.87 125.82 30.21 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.387 -0.597 . . . . 1.0 109.387 179.472 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -115.91 140.45 26.24 Favored Pre-proline 0 CA--C 1.541 0.627 0 CA-C-N 115.973 -0.558 . . . . 1.0 110.591 -178.371 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo -49.18 137.35 30.04 Favored 'Trans proline' 0 N--CA 1.491 1.381 0 C-N-CA 120.973 1.115 . . . . 1.0 110.96 178.336 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 55.4 mt -117.7 140.43 49.67 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 110.01 -0.367 . . . . 1.0 110.01 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1284 ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -85.17 137.3 33.1 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.237 -0.438 . . . . 1.0 110.241 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 88.6 tttt -140.67 121.2 14.15 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.911 0.386 . . . . 1.0 110.463 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1286 ' ' THR . . . . . . . . . . . . . 34.3 m -89.31 128.66 35.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.485 . . . . 1.0 110.253 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 54.2 mt -81.12 -172.45 3.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.478 -0.328 . . . . 1.0 110.299 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -108.13 141.05 40.44 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.241 -0.436 . . . . 1.0 110.337 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1289 ' ' THR . . . . . . . . . . . . . 5.6 p -91.04 112.74 24.77 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.238 -0.437 . . . . 1.0 110.748 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 5.6 m -143.27 122.17 7.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.185 -0.461 . . . . 1.0 110.202 179.108 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.44 166.09 26.56 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.749 -0.94 . . . . 1.0 110.749 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.01 -40.8 67.59 Favored 'Trans proline' 0 C--N 1.306 -1.688 0 C-N-CA 122.382 2.055 . . . . 1.0 110.946 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1293 ' ' SER . . . . . . . . . . . . . 29.5 t -92.95 164.34 13.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.616 -0.72 . . . . 1.0 110.079 178.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 75.7 m-70 -60.36 -9.97 4.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.084 0.468 . . . . 1.0 110.027 179.21 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -60.17 141.98 55.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.902 -0.59 . . . . 1.0 110.845 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -113.84 141.91 46.74 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.085 -0.507 . . . . 1.0 110.911 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1297 ' ' THR . . . . . . . . . . . . . 89.1 m -124.0 126.01 45.56 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.965 -0.561 . . . . 1.0 109.816 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -103.38 122.57 45.13 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.978 0.418 . . . . 1.0 110.975 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1299 ' ' THR . . . . . . . . . . . . . 89.9 m -128.03 132.84 49.08 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.875 -0.602 . . . . 1.0 110.142 179.34 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 55.9 t -118.72 132.82 67.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 N-CA-C 109.671 -0.492 . . . . 1.0 109.671 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -128.82 147.15 50.78 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.089 -0.505 . . . . 1.0 110.7 -179.402 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 44.4 t -115.21 130.07 70.38 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 N-CA-C 109.513 -0.551 . . . . 1.0 109.513 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -108.93 140.96 41.7 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.092 0.473 . . . . 1.0 111.226 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 92.0 t80 -136.96 103.54 5.19 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.683 -0.69 . . . . 1.0 109.792 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1305 ' ' LYS . . . . . 0.601 ' HE3' HE22 ' A' 1336 ' ' GLN . 98.8 mttt 47.84 34.21 3.77 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.756 -0.378 . . . . 1.0 110.511 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 87.55 10.29 70.69 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 121.26 -0.495 . . . . 1.0 111.901 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -116.11 136.39 53.07 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 120.923 0.392 . . . . 1.0 110.622 179.514 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 72.6 ttp85 -81.44 135.4 35.63 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.95 -0.568 . . . . 1.0 110.885 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 40.3 pt -135.36 18.22 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-N 116.281 -0.418 . . . . 1.0 110.744 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -161.33 147.83 14.84 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 111.305 -0.718 . . . . 1.0 111.305 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 35.5 t -168.58 134.93 1.87 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.902 0.382 . . . . 1.0 110.625 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . 169.68 170.86 34.66 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 110.799 -0.92 . . . . 1.0 110.799 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -138.59 146.75 42.17 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.973 0.415 . . . . 1.0 110.934 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -162.34 172.54 38.47 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 110.356 -1.097 . . . . 1.0 110.356 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -68.01 -73.03 0.02 OUTLIER 'Trans proline' 0 C--N 1.306 -1.66 0 C-N-CA 122.33 2.02 . . . . 1.0 111.984 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1316 ' ' SER . . . . . 0.419 ' OG ' ' OE1' ' A' 1319 ' ' GLN . 82.5 p -82.48 161.21 22.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.46 . . . . 1.0 110.769 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 44.1 mm -65.02 -43.99 96.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.996 -0.547 . . . . 1.0 110.697 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -54.96 -45.05 74.9 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.388 -0.369 . . . . 1.0 110.338 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1319 ' ' GLN . . . . . 0.419 ' OE1' ' OG ' ' A' 1316 ' ' SER . 1.4 mp0 -64.62 -40.2 95.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.33 -0.396 . . . . 1.0 110.169 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -63.61 -40.06 95.95 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.117 -0.492 . . . . 1.0 111.075 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -67.2 -38.71 85.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.327 -0.397 . . . . 1.0 110.707 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1322 ' ' MET . . . . . . . . . . . . . 78.6 mtp -64.44 -40.56 95.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.469 . . . . 1.0 110.711 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -67.48 -48.43 57.32 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 110.661 -0.976 . . . . 1.0 110.661 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -67.56 -35.13 78.44 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.877 0.37 . . . . 1.0 110.683 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -60.9 -41.24 95.72 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.945 -0.57 . . . . 1.0 111.769 -178.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1326 ' ' MET . . . . . . . . . . . . . 62.6 ttp -63.28 -41.82 99.04 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.877 -0.329 . . . . 1.0 111.316 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -67.48 -29.53 68.99 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.248 -0.433 . . . . 1.0 110.926 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1328 ' ' ALA . . . . . . . . . . . . . . . -61.13 -27.88 68.71 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.125 0.417 . . . . 1.0 112.125 -178.532 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 3.2 mm? -62.25 -41.26 98.28 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.494 -0.482 . . . . 1.0 110.569 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -88.61 18.71 4.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.354 -0.385 . . . . 1.0 111.24 -179.139 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 99.5 mttt -135.41 40.11 2.84 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.518 0.562 . . . . 1.0 112.518 -178.219 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1332 ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -106.04 134.94 48.37 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.215 0.531 . . . . 1.0 110.595 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1333 ' ' ASN . . . . . 0.427 ' O ' ' C ' ' A' 1334 ' ' PHE . 52.0 m-20 -111.43 -175.48 2.71 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.35 -0.841 . . . . 1.0 109.92 179.277 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1334 ' ' PHE . . . . . 0.427 ' C ' ' O ' ' A' 1333 ' ' ASN . 52.3 m-85 -30.39 110.59 0.27 Allowed Pre-proline 0 CA--C 1.543 0.702 0 O-C-N 123.476 0.485 . . . . 1.0 111.524 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -52.35 145.99 33.97 Favored 'Trans proline' 0 N--CA 1.496 1.673 0 C-N-CA 121.661 1.574 . . . . 1.0 112.275 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 1336 ' ' GLN . . . . . 0.601 HE22 ' HE3' ' A' 1305 ' ' LYS . 33.0 mm-40 . . . . . 0 N--CA 1.462 0.149 0 CA-C-N 115.894 -0.594 . . . . 1.0 111.205 -179.375 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 64.3 pttt . . . . . 0 CA--C 1.53 0.183 0 CA-C-O 120.617 0.246 . . . . 1.0 111.371 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A 1263 ' ' SER . . . . . . . . . . . . . 45.7 m -60.45 -28.05 67.99 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.767 0.318 . . . . 1.0 110.638 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1264 ' ' GLN . . . . . 0.45 ' O ' ' SG ' ' A' 1268 ' ' CYS . 99.1 mm-40 -54.51 -44.17 72.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 1.0 110.636 -179.166 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1265 ' ' LEU . . . . . . . . . . . . . 20.4 mt -63.58 -41.48 98.37 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.505 -0.478 . . . . 1.0 110.474 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -63.47 -43.98 95.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.846 0.355 . . . . 1.0 110.492 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -66.58 -40.82 89.13 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.037 -0.529 . . . . 1.0 109.887 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1268 ' ' CYS . . . . . 0.45 ' SG ' ' O ' ' A' 1264 ' ' GLN . 92.9 m -65.14 -35.07 79.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.596 -0.729 . . . . 1.0 110.995 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 98.4 m -56.74 -35.54 68.72 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.992 -0.283 . . . . 1.0 111.096 -179.263 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 82.9 mt -62.92 -40.98 99.27 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.478 -0.328 . . . . 1.0 110.621 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1271 ' ' THR . . . . . . . . . . . . . 70.3 p -66.77 -33.14 74.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.517 -0.31 . . . . 1.0 110.843 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1272 ' ' LEU . . . . . 0.415 HD22 ' H ' ' A' 1336 ' ' GLN . 85.9 mt -68.19 85.95 0.26 Allowed 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.572 -0.451 . . . . 1.0 110.562 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 79.4 mtp85 -119.67 131.09 55.34 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.307 -0.406 . . . . 1.0 110.75 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1274 ' ' THR . . . . . . . . . . . . . 20.8 m -120.94 128.4 52.72 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 109.992 -0.373 . . . . 1.0 109.992 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 48.4 tp10 -98.07 128.77 44.79 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.255 -0.43 . . . . 1.0 110.468 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 97.19 -9.26 65.2 Favored Glycine 0 CA--C 1.524 0.647 0 N-CA-C 111.439 -0.664 . . . . 1.0 111.439 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 52.0 mtpt -137.43 -175.11 3.95 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.207 0.527 . . . . 1.0 111.145 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -95.79 108.22 38.94 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 115.11 -0.95 . . . . 1.0 108.713 178.545 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -50.67 129.22 26.31 Favored 'Trans proline' 0 N--CA 1.493 1.445 0 C-N-CA 121.154 1.236 . . . . 1.0 112.251 -178.832 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -98.65 125.33 43.91 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.696 -0.684 . . . . 1.0 109.858 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 11.9 mt -133.73 133.84 22.8 Favored Pre-proline 0 CA--C 1.538 0.494 0 N-CA-C 110.365 -0.235 . . . . 1.0 110.365 -179.334 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -77.68 120.55 5.19 Favored 'Trans proline' 0 N--CA 1.493 1.471 0 C-N-CA 121.56 1.507 . . . . 1.0 111.531 178.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1283 ' ' LEU . . . . . 0.419 HD12 ' N ' ' A' 1283 ' ' LEU . 9.4 mp -106.91 155.83 19.34 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.193 -0.458 . . . . 1.0 110.383 -179.537 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1284 ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -77.33 144.71 37.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.921 -0.581 . . . . 1.0 111.155 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 87.7 tttt -146.12 105.73 3.96 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.837 -0.619 . . . . 1.0 109.989 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1286 ' ' THR . . . . . . . . . . . . . 26.2 m -63.44 130.38 44.19 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.123 -0.49 . . . . 1.0 111.2 -179.346 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 65.7 mt -81.4 -175.1 5.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.047 -0.524 . . . . 1.0 110.406 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -108.76 146.73 33.1 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.161 -0.472 . . . . 1.0 110.292 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1289 ' ' THR . . . . . . . . . . . . . 17.4 p -94.57 114.21 26.15 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.1 -0.5 . . . . 1.0 111.212 -178.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1290 ' ' VAL . . . . . 0.527 ' O ' HG23 ' A' 1290 ' ' VAL . 30.4 m -138.92 121.56 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-N 116.292 -0.413 . . . . 1.0 110.358 178.773 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.8 157.83 26.91 Favored Glycine 0 CA--C 1.527 0.82 0 N-CA-C 110.19 -1.164 . . . . 1.0 110.19 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -60.26 -40.56 58.11 Favored 'Trans proline' 0 C--N 1.31 -1.487 0 C-N-CA 122.055 1.837 . . . . 1.0 110.975 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1293 ' ' SER . . . . . . . . . . . . . 11.9 t -93.19 164.79 13.11 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.633 -0.712 . . . . 1.0 110.314 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 62.1 m170 -58.36 -11.39 2.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.274 -0.421 . . . . 1.0 110.018 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -60.3 147.89 38.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.98 -0.554 . . . . 1.0 110.485 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 96.2 mtt-85 -126.89 143.74 51.19 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.164 0.507 . . . . 1.0 111.149 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1297 ' ' THR . . . . . . . . . . . . . 88.4 m -125.24 128.09 47.76 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.57 -0.741 . . . . 1.0 109.366 178.668 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 95.3 m-85 -99.66 119.32 37.91 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.777 -0.453 . . . . 1.0 109.777 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1299 ' ' THR . . . . . . . . . . . . . 41.1 m -127.24 130.17 49.13 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.939 -0.573 . . . . 1.0 110.427 -179.507 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 67.2 t -118.31 127.41 75.42 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 N-CA-C 109.189 -0.671 . . . . 1.0 109.189 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -130.83 143.39 50.7 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.351 -0.386 . . . . 1.0 110.894 -179.247 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 16.9 t -106.55 129.07 60.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 N-CA-C 109.142 -0.688 . . . . 1.0 109.142 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -112.59 144.33 42.26 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.238 0.542 . . . . 1.0 111.671 -178.683 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1304 ' ' PHE . . . . . 0.432 ' O ' ' N ' ' A' 1307 ' ' GLU . 75.2 t80 -126.69 108.0 10.69 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.388 -0.823 . . . . 1.0 109.234 179.324 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 38.5 mtpt 46.75 32.24 1.69 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.514 -0.474 . . . . 1.0 109.984 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 88.97 17.29 56.52 Favored Glycine 0 CA--C 1.529 0.956 0 N-CA-C 111.83 -0.508 . . . . 1.0 111.83 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1307 ' ' GLU . . . . . 0.432 ' N ' ' O ' ' A' 1304 ' ' PHE . 99.5 mt-10 -119.47 129.71 54.87 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.964 0.382 . . . . 1.0 110.777 179.494 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1308 ' ' ARG . . . . . 0.661 HH21 ' CB ' ' A' 1311 ' ' CYS . 77.7 ttt180 -66.53 129.25 39.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.772 -0.649 . . . . 1.0 110.97 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 3.4 pt -138.24 13.01 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 116.064 -0.517 . . . . 1.0 110.874 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -173.57 153.19 16.98 Favored Glycine 0 CA--C 1.524 0.623 0 C-N-CA 120.346 -0.93 . . . . 1.0 111.674 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1311 ' ' CYS . . . . . 0.661 ' CB ' HH21 ' A' 1308 ' ' ARG . 52.4 t -169.9 144.08 2.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.877 0.37 . . . . 1.0 110.789 179.743 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -170.63 156.35 26.61 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.879 -0.888 . . . . 1.0 110.879 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 99.3 mttt -139.07 142.02 38.18 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.929 0.395 . . . . 1.0 110.595 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -167.11 176.9 41.94 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 110.277 -1.129 . . . . 1.0 110.277 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 18.3 Cg_exo -61.53 -63.23 0.1 Allowed 'Trans proline' 0 C--N 1.311 -1.408 0 C-N-CA 121.487 1.458 . . . . 1.0 111.936 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1316 ' ' SER . . . . . . . . . . . . . 9.8 p -90.95 167.25 12.55 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.8 -0.636 . . . . 1.0 111.061 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 38.1 mm -67.79 -42.43 86.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.914 -0.584 . . . . 1.0 110.088 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -54.5 -43.52 71.9 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.961 -0.563 . . . . 1.0 111.204 -178.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -66.94 -40.05 87.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.999 0.428 . . . . 1.0 110.341 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -62.59 -38.92 92.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.046 -0.525 . . . . 1.0 110.367 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -67.35 -38.17 84.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.245 -0.434 . . . . 1.0 111.445 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1322 ' ' MET . . . . . . . . . . . . . 72.1 mmm -64.13 -40.15 95.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.868 0.366 . . . . 1.0 110.547 -179.026 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -66.41 -47.42 70.58 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 111.574 -0.61 . . . . 1.0 111.574 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -66.09 -38.87 89.35 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.912 -0.315 . . . . 1.0 111.301 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -59.15 -48.3 82.11 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.358 -0.383 . . . . 1.0 111.206 -179.046 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1326 ' ' MET . . . . . 0.456 ' O ' ' OE1' ' A' 1330 ' ' GLU . 98.0 mmm -62.59 -43.97 97.49 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.729 -0.388 . . . . 1.0 111.085 -179.556 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -68.48 -32.78 73.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.528 -0.306 . . . . 1.0 111.694 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1328 ' ' ALA . . . . . . . . . . . . . . . -62.34 -33.65 75.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.677 0.275 . . . . 1.0 111.641 -178.585 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 98.7 mt -58.75 -26.49 64.04 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.707 0.289 . . . . 1.0 111.095 -179.485 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1330 ' ' GLU . . . . . 0.529 ' N ' ' OE1' ' A' 1330 ' ' GLU . 56.1 mp0 -88.84 -2.08 58.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.357 -0.383 . . . . 1.0 111.544 -179.483 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 98.4 mttt -120.41 21.46 11.64 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 112.698 0.629 . . . . 1.0 112.698 -177.461 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1332 ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -104.38 131.03 52.18 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.092 0.472 . . . . 1.0 110.585 179.531 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -101.13 -176.28 3.11 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.553 -0.749 . . . . 1.0 109.95 178.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -37.05 154.62 0.09 OUTLIER Pre-proline 0 CA--C 1.538 0.496 0 CA-C-N 116.147 -0.479 . . . . 1.0 110.846 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -52.97 157.43 8.08 Favored 'Trans proline' 0 N--CA 1.493 1.481 0 C-N-CA 121.336 1.357 . . . . 1.0 111.483 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 1336 ' ' GLN . . . . . 0.415 ' H ' HD22 ' A' 1272 ' ' LEU . 99.4 mm-40 . . . . . 0 N--CA 1.465 0.288 0 CA-C-O 120.941 0.4 . . . . 1.0 111.095 -179.494 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 52.1 mtpt . . . . . 0 N--CA 1.465 0.317 0 CA-C-O 120.592 0.234 . . . . 1.0 111.371 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A 1263 ' ' SER . . . . . . . . . . . . . 55.7 m -56.73 -45.23 82.08 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.569 -0.452 . . . . 1.0 110.532 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 28.1 mp0 -67.4 -40.91 85.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.993 0.425 . . . . 1.0 110.552 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1265 ' ' LEU . . . . . 0.474 ' N ' ' CD2' ' A' 1265 ' ' LEU . 2.2 mm? -62.96 -42.97 99.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.905 -0.589 . . . . 1.0 110.574 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -65.31 -44.35 88.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.316 -0.402 . . . . 1.0 111.292 -179.581 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -63.86 -39.27 93.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.454 -0.339 . . . . 1.0 111.267 -179.275 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1268 ' ' CYS . . . . . . . . . . . . . 97.4 m -63.94 -35.92 82.26 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.36 -0.382 . . . . 1.0 110.747 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 77.2 m -60.2 -36.23 77.19 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.121 -0.49 . . . . 1.0 111.341 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 90.2 mt -62.9 -41.04 99.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.447 -0.342 . . . . 1.0 111.086 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1271 ' ' THR . . . . . . . . . . . . . 40.4 p -64.83 -30.36 71.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.503 -0.317 . . . . 1.0 111.55 -179.42 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1272 ' ' LEU . . . . . 0.485 HD22 ' H ' ' A' 1336 ' ' GLN . 70.5 mt -78.71 96.6 5.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.87 0.367 . . . . 1.0 111.175 -179.052 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 46.8 mmm-85 -119.01 111.22 18.04 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.058 -0.519 . . . . 1.0 110.23 179.443 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1274 ' ' THR . . . . . . . . . . . . . 27.3 m -129.49 139.36 51.59 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 120.733 0.301 . . . . 1.0 110.458 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 78.8 tt0 -129.2 146.73 51.06 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.214 -0.448 . . . . 1.0 110.186 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 82.48 12.97 79.51 Favored Glycine 0 CA--C 1.524 0.651 0 N-CA-C 111.064 -0.814 . . . . 1.0 111.064 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 23.9 mtpp -136.55 -172.84 3.26 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.184 0.516 . . . . 1.0 110.919 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 87.7 mt-10 -96.37 108.57 42.74 Favored Pre-proline 0 CA--C 1.533 0.321 0 CA-C-N 115.259 -0.882 . . . . 1.0 109.046 179.082 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -50.21 133.12 35.34 Favored 'Trans proline' 0 N--CA 1.491 1.341 0 C-N-CA 121.173 1.249 . . . . 1.0 112.38 -179.224 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -139.68 124.18 18.18 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.512 -0.767 . . . . 1.0 109.28 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 7.0 mt -143.93 134.82 12.37 Favored Pre-proline 0 CA--C 1.537 0.461 0 CA-C-O 119.154 -0.45 . . . . 1.0 109.939 -178.775 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -52.24 131.71 40.89 Favored 'Trans proline' 0 N--CA 1.492 1.39 0 CA-C-N 120.322 1.151 . . . . 1.0 111.132 177.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 69.1 mt -130.13 140.65 50.76 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.918 0.389 . . . . 1.0 110.14 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1284 ' ' TYR . . . . . 0.412 ' CE2' HG22 ' A' 1302 ' ' VAL . 29.0 m-85 -82.32 141.8 32.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.877 -0.601 . . . . 1.0 111.785 -178.805 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -143.49 108.46 4.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.31 -0.859 . . . . 1.0 109.447 179.324 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1286 ' ' THR . . . . . . . . . . . . . 16.6 m -64.09 142.89 58.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.272 0.558 . . . . 1.0 110.779 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1287 ' ' LEU . . . . . 0.591 ' N ' ' CD2' ' A' 1287 ' ' LEU . 1.0 OUTLIER -80.92 -174.14 4.64 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.216 -0.902 . . . . 1.0 110.015 -179.352 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -108.86 130.59 55.42 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 109.695 -0.483 . . . . 1.0 109.695 179.297 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1289 ' ' THR . . . . . . . . . . . . . 64.9 p -87.46 116.97 25.93 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.927 0.394 . . . . 1.0 111.359 -179.23 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1290 ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' 1290 ' ' VAL . 24.1 m -149.99 122.14 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.183 0 CA-C-N 116.04 -0.527 . . . . 1.0 109.99 178.715 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.14 160.69 27.21 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.516 -1.034 . . . . 1.0 110.516 179.67 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -59.27 -43.36 41.78 Favored 'Trans proline' 0 C--N 1.308 -1.573 0 C-N-CA 122.214 1.943 . . . . 1.0 111.038 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1293 ' ' SER . . . . . . . . . . . . . 46.9 t -92.3 165.16 13.23 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.569 -0.741 . . . . 1.0 110.331 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 80.8 m80 -59.93 -6.73 1.4 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.334 -0.394 . . . . 1.0 110.389 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -66.7 148.46 51.88 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.081 -0.509 . . . . 1.0 110.612 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -129.9 143.73 50.95 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 116.236 -0.438 . . . . 1.0 110.628 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1297 ' ' THR . . . . . . . . . . . . . 84.8 m -123.54 128.7 50.13 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.933 -0.576 . . . . 1.0 109.526 179.315 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -102.03 118.98 38.05 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.184 0.516 . . . . 1.0 111.567 -178.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1299 ' ' THR . . . . . . . . . . . . . 91.9 m -127.71 130.13 48.32 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.557 -0.747 . . . . 1.0 109.815 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 53.3 t -117.31 129.94 73.01 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 N-CA-C 109.714 -0.476 . . . . 1.0 109.714 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -130.52 143.82 51.01 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.306 -0.407 . . . . 1.0 111.117 -179.322 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1302 ' ' VAL . . . . . 0.412 HG22 ' CE2' ' A' 1284 ' ' TYR . 24.9 t -107.37 126.86 63.56 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 CA-C-N 116.019 -0.537 . . . . 1.0 109.599 179.098 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -104.68 130.18 52.76 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.847 0.356 . . . . 1.0 110.539 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 61.8 t80 -142.56 109.03 5.32 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.172 -0.467 . . . . 1.0 110.371 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 68.1 mttm 52.17 27.71 4.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 1.0 110.894 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 80.14 12.22 83.5 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 111.378 -0.689 . . . . 1.0 111.378 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -109.92 120.15 41.56 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 110.023 -0.362 . . . . 1.0 110.023 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 61.6 ttp180 -75.98 126.04 30.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.341 -0.391 . . . . 1.0 110.354 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 31.5 pt -122.26 23.12 4.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-N 116.099 -0.5 . . . . 1.0 110.387 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -156.86 153.4 24.67 Favored Glycine 0 CA--C 1.524 0.639 0 N-CA-C 110.781 -0.928 . . . . 1.0 110.781 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 12.0 t -172.44 105.91 0.17 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.733 0.301 . . . . 1.0 110.557 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -173.48 167.85 40.62 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 111.108 -0.797 . . . . 1.0 111.108 179.891 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 69.0 mttm -139.61 144.08 37.55 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.811 0.338 . . . . 1.0 110.444 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -157.78 171.95 34.95 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.562 -1.015 . . . . 1.0 110.562 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.78 -76.83 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.66 0 C-N-CA 122.54 2.16 . . . . 1.0 111.759 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1316 ' ' SER . . . . . . . . . . . . . 16.2 p -76.28 162.0 28.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.015 0.436 . . . . 1.0 111.116 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 39.1 mm -63.83 -43.81 97.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.887 -0.597 . . . . 1.0 110.797 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -57.12 -40.27 76.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.305 -0.407 . . . . 1.0 110.877 -179.041 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 19.0 mm100 -62.85 -42.49 99.77 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.849 0.357 . . . . 1.0 110.66 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -67.08 -37.9 84.79 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.081 -0.508 . . . . 1.0 111.425 -179.535 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -66.12 -40.02 90.36 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.146 0.424 . . . . 1.0 112.146 -178.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1322 ' ' MET . . . . . . . . . . . . . 74.7 mtm -64.01 -41.35 97.49 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.495 -0.482 . . . . 1.0 111.161 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -64.29 -46.04 91.83 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 120.862 -0.685 . . . . 1.0 111.678 -179.489 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -66.23 -37.49 85.65 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.891 0.33 . . . . 1.0 111.891 -179.255 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -62.52 -41.74 99.05 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 111.893 0.331 . . . . 1.0 111.893 -178.647 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1326 ' ' MET . . . . . . . . . . . . . 74.1 mmm -62.92 -44.39 96.21 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.59 -0.444 . . . . 1.0 111.259 -179.578 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -68.25 -33.35 74.21 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.858 -0.337 . . . . 1.0 110.278 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1328 ' ' ALA . . . . . . . . . . . . . . . -57.45 -37.33 72.67 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.054 -0.521 . . . . 1.0 111.072 -179.328 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 76.5 mt -62.03 -36.52 81.84 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.78 0.324 . . . . 1.0 110.685 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -82.98 8.32 13.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.29 -0.414 . . . . 1.0 111.273 -179.513 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 96.5 mttt -135.81 40.51 2.74 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.395 0.517 . . . . 1.0 112.395 -177.826 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1332 ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -107.18 151.23 25.69 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.075 0.464 . . . . 1.0 110.181 179.053 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -123.77 -176.74 3.55 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.552 -0.749 . . . . 1.0 109.982 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -37.86 150.54 0.17 Allowed Pre-proline 0 CA--C 1.535 0.387 0 CA-C-N 116.257 -0.428 . . . . 1.0 110.831 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.93 156.77 64.3 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 122.478 2.118 . . . . 1.0 112.252 -179.415 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 1336 ' ' GLN . . . . . 0.485 ' H ' HD22 ' A' 1272 ' ' LEU . 99.2 mm-40 . . . . . 0 C--N 1.331 -0.205 0 CA-C-N 115.927 -0.579 . . . . 1.0 110.926 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 55.7 mtmt . . . . . 0 N--CA 1.46 0.048 0 N-CA-C 111.628 0.233 . . . . 1.0 111.628 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A 1263 ' ' SER . . . . . . . . . . . . . 45.5 m -58.82 -38.51 78.81 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.71 -0.396 . . . . 1.0 110.419 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -63.37 -47.45 82.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.955 -0.566 . . . . 1.0 111.386 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1265 ' ' LEU . . . . . 0.425 ' CD1' ' OH ' ' A' 1284 ' ' TYR . 91.7 mt -64.23 -42.59 96.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.526 -0.306 . . . . 1.0 111.099 -179.449 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -63.67 -42.8 98.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.327 -0.397 . . . . 1.0 110.908 -179.321 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -65.85 -39.68 90.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.813 0.34 . . . . 1.0 110.54 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1268 ' ' CYS . . . . . . . . . . . . . 95.4 m -62.82 -34.83 78.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.984 -0.553 . . . . 1.0 111.062 -179.489 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 77.5 m -54.83 -40.21 69.36 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.773 -0.371 . . . . 1.0 110.738 -179.306 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1270 ' ' LEU . . . . . 0.499 HD22 ' N ' ' A' 1270 ' ' LEU . 4.0 mm? -65.02 -39.96 94.15 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.079 -0.509 . . . . 1.0 111.241 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1271 ' ' THR . . . . . . . . . . . . . 80.4 p -63.88 -31.96 73.33 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.83 0.307 . . . . 1.0 111.83 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 71.8 mt -77.19 86.14 3.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.618 0.246 . . . . 1.0 111.056 -179.039 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -120.02 131.81 55.26 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 120.753 0.311 . . . . 1.0 111.07 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1274 ' ' THR . . . . . . . . . . . . . 9.3 m -128.54 139.68 52.18 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 109.176 -0.676 . . . . 1.0 109.176 178.659 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -107.85 133.01 52.83 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.208 0.528 . . . . 1.0 111.048 -179.439 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 80.85 5.17 90.24 Favored Glycine 0 CA--C 1.527 0.797 0 CA-C-N 115.705 -0.679 . . . . 1.0 112.474 178.495 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 43.3 mtpt -139.95 -174.24 3.86 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.614 0.721 . . . . 1.0 112.054 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -99.01 108.84 51.54 Favored Pre-proline 0 CA--C 1.538 0.491 0 CA-C-N 114.752 -1.113 . . . . 1.0 109.946 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -80.86 113.7 2.81 Favored 'Trans proline' 0 N--CA 1.496 1.668 0 C-N-CA 122.0 1.8 . . . . 1.0 112.798 -179.331 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -83.21 148.88 27.16 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.867 -0.606 . . . . 1.0 109.956 179.076 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 3.0 mt -140.85 132.41 13.89 Favored Pre-proline 0 CA--C 1.538 0.498 0 N-CA-C 109.303 -0.628 . . . . 1.0 109.303 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -55.2 139.08 80.62 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 CA-C-N 120.787 1.317 . . . . 1.0 110.983 178.405 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 97.0 mt -126.35 147.96 49.66 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.474 -0.33 . . . . 1.0 110.242 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1284 ' ' TYR . . . . . 0.425 ' OH ' ' CD1' ' A' 1265 ' ' LEU . 36.0 m-85 -78.0 142.79 38.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.094 -0.503 . . . . 1.0 111.132 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 65.0 tttm -145.23 106.64 4.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.472 -0.785 . . . . 1.0 109.49 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1286 ' ' THR . . . . . . . . . . . . . 41.5 m -69.41 133.93 48.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.062 -0.517 . . . . 1.0 111.267 -179.409 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 67.6 mt -81.23 -172.48 3.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.908 -0.587 . . . . 1.0 110.081 179.487 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 91.6 mm-40 -109.22 140.91 42.23 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.053 -0.521 . . . . 1.0 110.032 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1289 ' ' THR . . . . . . . . . . . . . 30.1 p -99.35 114.98 28.16 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.166 -0.47 . . . . 1.0 111.085 -179.104 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1290 ' ' VAL . . . . . 0.476 ' O ' HG23 ' A' 1290 ' ' VAL . 28.0 m -133.09 122.3 45.44 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 N-CA-C 109.927 -0.397 . . . . 1.0 109.927 178.455 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -143.62 167.51 26.61 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 111.056 -0.817 . . . . 1.0 111.056 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.47 -49.5 0.6 Allowed 'Trans proline' 0 C--N 1.308 -1.596 0 C-N-CA 122.688 2.259 . . . . 1.0 111.214 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1293 ' ' SER . . . . . . . . . . . . . 14.8 t -88.52 164.33 15.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.483 -0.781 . . . . 1.0 110.544 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 40.0 m80 -59.5 -11.35 4.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.315 -0.402 . . . . 1.0 110.416 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -67.14 143.28 56.71 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.544 -0.539 . . . . 1.0 109.544 179.044 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -127.73 149.01 50.42 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.141 0.496 . . . . 1.0 111.69 -178.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1297 ' ' THR . . . . . . . . . . . . . 88.8 m -121.72 122.0 38.56 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.461 -0.79 . . . . 1.0 109.064 178.182 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -94.34 126.11 39.39 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.189 0.518 . . . . 1.0 111.212 -179.423 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1299 ' ' THR . . . . . . . . . . . . . 91.1 m -127.24 130.63 49.98 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.765 -0.652 . . . . 1.0 110.17 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 55.4 t -120.84 130.39 74.67 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 N-CA-C 110.078 -0.341 . . . . 1.0 110.078 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -130.56 145.27 51.84 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.127 -0.488 . . . . 1.0 110.616 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 18.7 t -107.82 128.69 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 N-CA-C 109.432 -0.581 . . . . 1.0 109.432 179.135 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -106.96 137.65 44.62 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.469 -0.332 . . . . 1.0 110.989 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1304 ' ' PHE . . . . . 0.496 ' O ' ' N ' ' A' 1307 ' ' GLU . 50.6 t80 -139.34 119.33 13.45 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.334 -0.394 . . . . 1.0 110.168 179.372 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1305 ' ' LYS . . . . . 0.412 ' NZ ' ' OE1' ' A' 1336 ' ' GLN . 51.8 mttp 39.51 39.34 0.48 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.367 -0.379 . . . . 1.0 111.566 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 79.09 20.37 70.24 Favored Glycine 0 CA--C 1.528 0.852 0 C-N-CA 121.127 -0.559 . . . . 1.0 112.221 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1307 ' ' GLU . . . . . 0.496 ' N ' ' O ' ' A' 1304 ' ' PHE . 98.1 mt-10 -125.98 147.79 49.43 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.81 0.338 . . . . 1.0 110.309 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 57.1 ttp180 -91.59 126.15 36.58 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.039 -0.528 . . . . 1.0 110.106 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 45.0 pt -132.38 16.37 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-N 116.461 -0.336 . . . . 1.0 110.856 -179.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -157.47 151.63 22.89 Favored Glycine 0 CA--C 1.523 0.574 0 N-CA-C 111.084 -0.806 . . . . 1.0 111.084 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 30.3 p -173.6 138.5 0.67 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.725 0.298 . . . . 1.0 110.445 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . 179.27 162.01 27.75 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.979 -0.849 . . . . 1.0 110.979 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 59.8 mttp -141.93 142.66 33.03 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.735 0.302 . . . . 1.0 110.341 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -164.11 -178.87 37.97 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 110.701 -0.96 . . . . 1.0 110.701 179.207 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -63.65 -70.79 0.03 OUTLIER 'Trans proline' 0 C--N 1.311 -1.435 0 C-N-CA 121.689 1.593 . . . . 1.0 111.237 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1316 ' ' SER . . . . . . . . . . . . . 4.9 p -90.06 171.57 9.45 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.049 -0.523 . . . . 1.0 110.402 179.437 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 39.2 mm -64.19 -42.99 97.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.821 -0.627 . . . . 1.0 110.413 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -53.2 -42.0 65.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.776 -0.647 . . . . 1.0 111.833 -178.595 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 13.8 mp0 -67.3 -40.46 86.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.698 0.285 . . . . 1.0 110.459 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -65.69 -37.81 87.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.225 -0.443 . . . . 1.0 111.455 -179.234 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -65.92 -38.37 88.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.382 -0.372 . . . . 1.0 111.84 -178.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1322 ' ' MET . . . . . . . . . . . . . 61.6 mtt -62.3 -43.62 98.39 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.865 -0.334 . . . . 1.0 111.403 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -67.7 -40.2 90.16 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 111.634 -0.586 . . . . 1.0 111.634 -179.265 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -65.94 -38.78 89.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.678 0.275 . . . . 1.0 111.618 -179.65 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -65.82 -39.63 91.05 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.34 0.496 . . . . 1.0 112.34 -178.821 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1326 ' ' MET . . . . . . . . . . . . . 8.3 ttt -63.08 -38.83 92.76 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.76 -0.376 . . . . 1.0 110.824 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 56.7 m-20 -64.76 -31.93 73.38 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.203 -0.453 . . . . 1.0 110.645 -179.275 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1328 ' ' ALA . . . . . 0.545 ' O ' ' CD2' ' A' 1332 ' ' TYR . . . -57.31 -26.59 61.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.584 -0.28 . . . . 1.0 111.475 -179.137 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1329 ' ' LEU . . . . . 0.489 HD22 ' N ' ' A' 1329 ' ' LEU . 3.7 mm? -61.72 -41.95 98.3 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.84 -0.344 . . . . 1.0 110.946 -179.205 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -93.16 14.22 18.71 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 121.062 -0.255 . . . . 1.0 111.113 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 64.9 mttm -135.52 42.28 2.7 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 120.685 -0.406 . . . . 1.0 111.706 -178.312 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1332 ' ' TYR . . . . . 0.545 ' CD2' ' O ' ' A' 1328 ' ' ALA . 8.7 m-85 -108.7 145.5 34.94 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.303 0.573 . . . . 1.0 110.712 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -127.08 -176.07 3.61 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.209 -0.905 . . . . 1.0 109.404 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -41.26 141.04 1.13 Allowed Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 121.075 -0.25 . . . . 1.0 110.766 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -75.77 172.64 15.91 Favored 'Trans proline' 0 N--CA 1.498 1.739 0 C-N-CA 122.72 2.28 . . . . 1.0 112.245 179.735 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 1336 ' ' GLN . . . . . 0.412 ' OE1' ' NZ ' ' A' 1305 ' ' LYS . 14.0 mm100 . . . . . 0 C--N 1.331 -0.223 0 N-CA-C 109.782 -0.451 . . . . 1.0 109.782 179.385 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 98.8 mttt . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.915 0.388 . . . . 1.0 110.536 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A 1263 ' ' SER . . . . . . . . . . . . . 51.0 m -58.92 -36.88 75.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.134 -0.485 . . . . 1.0 110.616 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 14.3 mp0 -61.15 -42.68 98.99 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.819 -0.352 . . . . 1.0 110.265 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1265 ' ' LEU . . . . . 0.419 ' CD2' ' OH ' ' A' 1332 ' ' TYR . 83.4 mt -62.89 -41.52 99.44 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.742 -0.383 . . . . 1.0 110.031 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -63.82 -43.23 96.85 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.801 -0.36 . . . . 1.0 110.798 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -65.32 -39.52 92.56 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.854 0.359 . . . . 1.0 110.819 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1268 ' ' CYS . . . . . . . . . . . . . 88.5 m -64.5 -37.36 87.26 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.016 -0.538 . . . . 1.0 111.178 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 70.9 m -51.14 -41.38 60.06 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 120.55 -0.46 . . . . 1.0 110.865 -178.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1270 ' ' LEU . . . . . 0.523 HD22 ' N ' ' A' 1270 ' ' LEU . 3.6 mm? -64.39 -41.25 96.77 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.809 0.338 . . . . 1.0 110.801 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1271 ' ' THR . . . . . . . . . . . . . 48.0 p -66.56 -30.19 70.43 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.276 -0.42 . . . . 1.0 111.477 -179.039 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 92.5 mt -76.34 102.67 6.0 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.435 -0.506 . . . . 1.0 110.725 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 78.3 mtp85 -119.96 142.64 48.57 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.126 -0.488 . . . . 1.0 109.913 179.248 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1274 ' ' THR . . . . . . . . . . . . . 8.4 m -113.67 128.02 56.27 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 120.808 0.337 . . . . 1.0 110.188 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -129.54 112.06 13.37 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.408 -0.36 . . . . 1.0 110.861 -179.427 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 74.03 24.63 73.34 Favored Glycine 0 CA--C 1.527 0.823 0 CA-C-N 115.98 -0.555 . . . . 1.0 112.203 178.652 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 4.1 mtpp -136.58 -163.48 1.42 Allowed 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.335 0.588 . . . . 1.0 110.61 -179.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -95.11 108.24 37.19 Favored Pre-proline 0 CA--C 1.541 0.623 0 CA-C-N 114.865 -1.061 . . . . 1.0 109.277 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1279 ' ' PRO . . . . . 0.437 ' O ' ' OD1' ' A' 1280 ' ' ASP . 50.4 Cg_exo -49.79 122.84 9.63 Favored 'Trans proline' 0 N--CA 1.494 1.524 0 C-N-CA 121.506 1.471 . . . . 1.0 112.657 -179.326 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1280 ' ' ASP . . . . . 0.437 ' OD1' ' O ' ' A' 1279 ' ' PRO . 96.0 m-20 -143.82 124.26 13.94 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.656 -0.702 . . . . 1.0 109.392 178.74 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1281 ' ' ILE . . . . . 0.462 HD12 ' N ' ' A' 1281 ' ' ILE . 1.5 mp -137.77 135.57 19.09 Favored Pre-proline 0 CA--C 1.541 0.605 0 CA-C-N 116.242 -0.436 . . . . 1.0 110.424 -178.446 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -54.77 139.65 77.62 Favored 'Trans proline' 0 N--CA 1.496 1.64 0 CA-C-N 120.345 1.159 . . . . 1.0 111.213 178.193 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 87.4 mt -138.46 153.81 48.83 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.231 -0.44 . . . . 1.0 110.157 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1284 ' ' TYR . . . . . . . . . . . . . 81.9 m-85 -81.66 136.04 35.51 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.438 -0.346 . . . . 1.0 110.814 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 12.3 ttmm -138.83 126.02 21.42 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.204 -0.453 . . . . 1.0 109.869 178.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1286 ' ' THR . . . . . . . . . . . . . 92.3 m -99.15 125.7 44.76 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.967 0.413 . . . . 1.0 110.428 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 82.0 mt -77.54 -169.7 1.54 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.626 -0.716 . . . . 1.0 110.419 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -107.93 141.19 39.93 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.449 -0.341 . . . . 1.0 110.466 -179.671 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1289 ' ' THR . . . . . . . . . . . . . 16.9 p -87.84 114.47 24.49 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.082 -0.508 . . . . 1.0 110.858 -179.523 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 17.4 m -131.71 122.1 49.08 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-O 120.968 0.413 . . . . 1.0 110.38 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -144.52 157.71 27.3 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 110.569 -1.013 . . . . 1.0 110.569 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.74 -38.51 7.74 Favored 'Trans proline' 0 C--N 1.308 -1.563 0 C-N-CA 121.886 1.724 . . . . 1.0 110.691 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1293 ' ' SER . . . . . . . . . . . . . 26.7 t -92.74 165.22 13.05 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.503 -0.771 . . . . 1.0 110.211 179.287 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 78.9 m80 -57.61 -12.93 3.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.055 0.455 . . . . 1.0 109.839 179.523 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -63.37 145.16 56.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.805 -0.634 . . . . 1.0 110.554 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -128.41 140.13 52.0 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.03 0.443 . . . . 1.0 110.958 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1297 ' ' THR . . . . . . . . . . . . . 80.6 m -123.03 130.25 52.55 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.789 -0.642 . . . . 1.0 109.648 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 92.7 m-85 -100.07 131.46 46.01 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.148 0.499 . . . . 1.0 111.331 -178.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1299 ' ' THR . . . . . . . . . . . . . 90.1 m -127.42 131.91 50.18 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.61 -0.723 . . . . 1.0 110.017 179.505 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 55.8 t -118.42 129.48 74.66 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 109.963 -0.384 . . . . 1.0 109.963 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -129.69 144.42 51.28 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.09 -0.505 . . . . 1.0 110.589 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 24.3 t -111.61 128.24 68.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 N-CA-C 109.015 -0.735 . . . . 1.0 109.015 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -106.95 139.98 40.48 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.22 0.533 . . . . 1.0 111.622 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 75.5 t80 -140.99 106.64 5.1 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.429 -0.805 . . . . 1.0 110.118 179.359 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 55.6 mtpt 50.19 34.35 8.49 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.806 0.336 . . . . 1.0 110.736 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 83.81 18.71 62.95 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 121.343 -0.456 . . . . 1.0 111.994 179.48 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -121.68 144.07 48.98 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 109.887 -0.412 . . . . 1.0 109.887 179.369 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1308 ' ' ARG . . . . . 0.51 ' NE ' ' O ' ' A' 1310 ' ' GLY . 75.5 ttt180 -96.84 122.06 39.4 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.84 0.352 . . . . 1.0 110.144 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 35.4 pt -118.48 22.93 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-N 116.149 -0.478 . . . . 1.0 110.66 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1310 ' ' GLY . . . . . 0.51 ' O ' ' NE ' ' A' 1308 ' ' ARG . . . -159.38 153.99 25.05 Favored Glycine 0 CA--C 1.524 0.609 0 N-CA-C 110.659 -0.977 . . . . 1.0 110.659 179.833 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 8.7 p -174.17 121.42 0.29 Allowed 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.712 -0.395 . . . . 1.0 111.068 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -174.33 168.28 40.96 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.945 -0.862 . . . . 1.0 110.945 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 61.7 mttp -138.95 149.41 44.73 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.918 0.389 . . . . 1.0 110.607 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -169.06 167.74 40.69 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.438 -1.065 . . . . 1.0 110.438 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.67 -53.74 0.42 Allowed 'Trans proline' 0 C--N 1.307 -1.654 0 C-N-CA 122.449 2.099 . . . . 1.0 111.545 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1316 ' ' SER . . . . . . . . . . . . . 82.6 p -97.08 161.47 13.81 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.111 0.481 . . . . 1.0 110.98 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 40.3 mm -67.12 -42.6 88.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.655 -0.702 . . . . 1.0 111.317 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -53.06 -47.08 68.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.314 -0.403 . . . . 1.0 111.575 -178.656 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -67.29 -37.81 84.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.466 -0.333 . . . . 1.0 111.265 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -62.25 -37.5 85.69 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.251 -0.431 . . . . 1.0 111.202 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -67.15 -38.58 85.72 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.288 -0.415 . . . . 1.0 111.901 -179.024 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1322 ' ' MET . . . . . . . . . . . . . 57.2 mtt -61.59 -43.07 99.53 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.634 -0.426 . . . . 1.0 111.049 -179.231 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -63.92 -46.99 90.15 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.857 -0.897 . . . . 1.0 110.857 -179.761 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -65.14 -43.13 92.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.817 0.341 . . . . 1.0 110.561 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -68.29 -41.51 80.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.073 -0.512 . . . . 1.0 111.229 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1326 ' ' MET . . . . . . . . . . . . . 48.2 ttp -63.1 -43.68 97.81 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.011 0.434 . . . . 1.0 110.253 -179.499 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -68.9 -29.56 67.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.771 -0.65 . . . . 1.0 110.602 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1328 ' ' ALA . . . . . 0.53 ' O ' ' CD2' ' A' 1332 ' ' TYR . . . -59.63 -25.31 64.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.105 -0.498 . . . . 1.0 111.777 -178.679 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 96.2 mt -61.17 -41.52 96.93 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.943 -0.303 . . . . 1.0 110.967 -179.22 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -89.29 11.22 19.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.565 -0.289 . . . . 1.0 111.352 -178.882 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 64.1 mttm -129.52 40.69 3.56 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 112.084 0.402 . . . . 1.0 112.084 -178.317 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 1332 ' ' TYR . . . . . 0.53 ' CD2' ' O ' ' A' 1328 ' ' ALA . 16.0 m-85 -116.01 137.32 52.22 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 120.95 0.405 . . . . 1.0 110.298 179.202 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1333 ' ' ASN . . . . . 0.425 ' O ' ' C ' ' A' 1334 ' ' PHE . 97.1 m-20 -137.12 167.51 21.41 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.866 -0.607 . . . . 1.0 109.397 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1334 ' ' PHE . . . . . 0.425 ' C ' ' O ' ' A' 1333 ' ' ASN . 75.0 m-85 -30.68 94.06 0.06 OUTLIER Pre-proline 0 N--CA 1.47 0.532 0 O-C-N 123.518 0.511 . . . . 1.0 111.592 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1335 ' ' PRO . . . . . 0.436 ' O ' ' O ' ' A' 1336 ' ' GLN . 44.5 Cg_endo -91.4 -163.98 0.13 Allowed 'Trans proline' 0 N--CA 1.488 1.159 0 C-N-CA 122.942 2.428 . . . . 1.0 112.431 -179.086 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 1336 ' ' GLN . . . . . 0.436 ' O ' ' O ' ' A' 1335 ' ' PRO . 13.5 mm100 . . . . . 0 N--CA 1.465 0.305 0 CA-C-N 115.817 -0.629 . . . . 1.0 110.793 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1259 ' ' ASN . . . . . . . . . . . . . 94.9 m-20 . . . . . 0 N--CA 1.489 1.514 0 N-CA-C 109.461 -0.57 . . . . 1.0 109.461 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A 1260 ' ' ASP . . . . . 0.652 ' H ' ' CD ' ' A' 1261 ' ' PRO . 0.7 OUTLIER -172.71 -40.83 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.294 0 CA-C-N 116.286 -0.416 . . . . 1.0 110.946 179.557 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A 1261 ' ' PRO . . . . . 0.652 ' CD ' ' H ' ' A' 1260 ' ' ASP . 15.8 Cg_exo -67.41 153.97 75.21 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 C-N-CA 122.401 2.067 . . . . 1.0 111.782 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 34.6 tptt -60.92 138.56 58.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.01 0.433 . . . . 1.0 110.423 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1263 ' ' SER . . . . . . . . . . . . . 68.3 m -57.5 -41.39 80.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.706 -0.679 . . . . 1.0 111.112 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 25.0 mp0 -58.97 -43.99 91.46 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.703 -0.399 . . . . 1.0 110.209 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1265 ' ' LEU . . . . . 0.482 ' CD2' ' OH ' ' A' 1332 ' ' TYR . 36.9 mt -63.61 -41.95 98.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 1.0 110.505 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 29.9 mm100 -63.46 -44.73 93.63 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.346 -0.388 . . . . 1.0 110.718 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -64.02 -39.76 94.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.127 -0.488 . . . . 1.0 110.689 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1268 ' ' CYS . . . . . . . . . . . . . 98.3 m -64.92 -35.74 82.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.02 -0.536 . . . . 1.0 110.859 -179.522 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 79.1 m -60.44 -37.51 81.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.443 -0.344 . . . . 1.0 110.771 -179.284 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 89.1 mt -63.86 -39.31 93.9 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.214 -0.448 . . . . 1.0 111.106 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1271 ' ' THR . . . . . . . . . . . . . 68.7 p -65.06 -30.06 71.0 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.504 -0.316 . . . . 1.0 111.478 -179.162 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 77.6 mt -77.67 84.48 4.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.496 -0.32 . . . . 1.0 111.492 -178.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -119.74 130.09 54.81 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 110.139 -0.319 . . . . 1.0 110.139 178.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1274 ' ' THR . . . . . . . . . . . . . 21.4 m -129.65 133.4 47.09 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 120.773 0.32 . . . . 1.0 110.434 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 39.9 tp10 -111.54 142.72 43.47 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.356 -0.384 . . . . 1.0 110.202 179.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 88.2 7.11 73.82 Favored Glycine 0 CA--C 1.527 0.815 0 N-CA-C 111.201 -0.76 . . . . 1.0 111.201 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 49.4 mtpt -138.63 -164.71 1.69 Allowed 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 110.239 -0.282 . . . . 1.0 110.239 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -92.43 151.05 41.01 Favored Pre-proline 0 CA--C 1.531 0.238 0 N-CA-C 109.87 -0.418 . . . . 1.0 109.87 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.09 76.13 1.29 Allowed 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.278 1.986 . . . . 1.0 112.22 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -90.83 121.5 32.75 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.815 -0.439 . . . . 1.0 109.815 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 13.1 mt -148.67 133.51 9.12 Favored Pre-proline 0 CA--C 1.535 0.398 0 N-CA-C 109.953 -0.388 . . . . 1.0 109.953 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.09 111.82 3.27 Favored 'Trans proline' 0 N--CA 1.495 1.597 0 C-N-CA 121.323 1.349 . . . . 1.0 111.514 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 89.5 mt -121.59 154.47 36.69 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.033 0.444 . . . . 1.0 110.867 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1284 ' ' TYR . . . . . 0.443 ' CE1' HD13 ' A' 1265 ' ' LEU . 4.2 m-85 -79.0 140.45 37.97 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.876 -0.602 . . . . 1.0 110.892 -179.692 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 79.7 tttt -145.97 115.13 7.04 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.515 -0.766 . . . . 1.0 109.575 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 27.2 m -63.83 131.88 49.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.843 0.354 . . . . 1.0 110.686 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 72.8 mt -87.74 -172.2 3.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.046 -0.525 . . . . 1.0 110.302 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -107.67 137.61 45.39 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.285 -0.416 . . . . 1.0 110.052 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1289 ' ' THR . . . . . . . . . . . . . 19.0 p -75.49 115.95 15.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.095 -0.502 . . . . 1.0 111.286 -178.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 16.6 m -136.11 122.15 30.31 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-N 116.051 -0.522 . . . . 1.0 109.836 178.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.86 159.25 27.33 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 110.947 -0.861 . . . . 1.0 110.947 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -63.67 -38.91 37.71 Favored 'Trans proline' 0 C--N 1.308 -1.593 0 C-N-CA 122.371 2.047 . . . . 1.0 111.132 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1293 ' ' SER . . . . . . . . . . . . . 14.3 t -91.86 165.13 13.4 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.728 -0.669 . . . . 1.0 110.55 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -61.38 -9.5 5.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.172 0.511 . . . . 1.0 109.75 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -62.91 144.98 56.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.481 -0.782 . . . . 1.0 111.11 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -103.01 130.35 50.08 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.097 -0.501 . . . . 1.0 110.685 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1297 ' ' THR . . . . . . . . . . . . . 92.3 m -125.92 127.65 46.33 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.923 -0.58 . . . . 1.0 110.093 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -101.44 127.2 48.21 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.001 0.429 . . . . 1.0 110.819 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1299 ' ' THR . . . . . . . . . . . . . 64.0 m -127.56 130.56 49.3 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.86 -0.609 . . . . 1.0 110.313 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 54.3 t -116.77 128.0 74.26 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 N-CA-C 109.139 -0.689 . . . . 1.0 109.139 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -130.49 142.35 50.49 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.13 0.49 . . . . 1.0 111.657 -179.065 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 2.7 t -112.28 127.43 69.49 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 N-CA-C 108.801 -0.814 . . . . 1.0 108.801 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -115.98 139.54 50.15 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.146 0.498 . . . . 1.0 111.449 -178.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 52.7 t80 -128.38 102.31 6.59 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.6 -0.727 . . . . 1.0 110.212 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 64.4 mttp 47.01 36.58 4.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.108 -0.497 . . . . 1.0 111.05 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 90.99 4.34 69.22 Favored Glycine 0 CA--C 1.527 0.815 0 N-CA-C 111.946 -0.462 . . . . 1.0 111.946 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -110.05 119.77 40.36 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 120.992 0.425 . . . . 1.0 110.356 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 62.0 ttp180 -76.08 136.43 39.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.931 -0.577 . . . . 1.0 110.634 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 42.1 pt -138.56 20.17 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-N 116.36 -0.382 . . . . 1.0 110.169 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -151.03 148.35 19.37 Favored Glycine 0 CA--C 1.523 0.587 0 N-CA-C 111.062 -0.815 . . . . 1.0 111.062 -179.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 25.0 p -171.35 116.37 0.42 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.804 0.335 . . . . 1.0 110.185 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -175.57 131.05 1.83 Allowed Glycine 0 CA--C 1.523 0.583 0 N-CA-C 111.018 -0.833 . . . . 1.0 111.018 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 68.8 mttm -109.95 146.0 35.97 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.778 0.323 . . . . 1.0 110.373 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -167.16 173.2 42.36 Favored Glycine 0 CA--C 1.524 0.634 0 N-CA-C 111.139 -0.785 . . . . 1.0 111.139 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -69.41 -75.08 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.677 0 C-N-CA 122.592 2.195 . . . . 1.0 111.918 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1316 ' ' SER . . . . . . . . . . . . . 95.5 p -79.0 158.2 27.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.926 0.393 . . . . 1.0 110.943 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 47.5 mm -63.88 -44.66 98.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.0 -0.545 . . . . 1.0 111.209 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -54.48 -46.34 73.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.536 -0.302 . . . . 1.0 111.125 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -62.89 -38.77 92.24 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.842 -0.343 . . . . 1.0 110.865 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -64.63 -38.49 91.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.425 -0.352 . . . . 1.0 111.08 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1321 ' ' GLU . . . . . 0.413 ' O ' ' HB2' ' A' 1325 ' ' ALA . 98.2 mt-10 -66.41 -36.46 82.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.299 -0.41 . . . . 1.0 111.404 -179.381 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1322 ' ' MET . . . . . . . . . . . . . 95.1 mmm -62.74 -42.65 99.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.323 -0.399 . . . . 1.0 111.469 -179.109 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -66.7 -49.68 53.69 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 120.711 -0.757 . . . . 1.0 111.528 -179.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -70.27 -36.22 74.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.792 0.329 . . . . 1.0 111.534 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1325 ' ' ALA . . . . . 0.413 ' HB2' ' O ' ' A' 1321 ' ' GLU . . . -56.01 -50.27 71.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.23 -0.441 . . . . 1.0 111.729 -178.547 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1326 ' ' MET . . . . . . . . . . . . . 66.4 mtt -65.57 -38.56 89.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.744 0.307 . . . . 1.0 111.484 -179.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -63.52 -36.98 85.58 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.348 -0.387 . . . . 1.0 111.549 -179.053 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1328 ' ' ALA . . . . . 0.524 ' O ' ' CD2' ' A' 1332 ' ' TYR . . . -58.69 -25.76 63.19 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.188 0.44 . . . . 1.0 112.188 -178.757 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 1.9 mm? -62.05 -41.45 98.14 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.679 -0.408 . . . . 1.0 111.148 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -93.62 4.57 53.75 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.142 0.423 . . . . 1.0 112.142 -178.524 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 67.5 mttm -117.7 20.65 13.35 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.269 0.47 . . . . 1.0 112.269 -178.215 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1332 ' ' TYR . . . . . 0.524 ' CD2' ' O ' ' A' 1328 ' ' ALA . 11.4 m-85 -83.54 137.76 33.71 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.122 0.487 . . . . 1.0 110.502 179.249 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -117.33 -175.98 2.91 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.521 -0.763 . . . . 1.0 110.17 179.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 53.8 m-85 -34.99 151.05 0.07 OUTLIER Pre-proline 0 CA--C 1.538 0.484 0 CA-C-N 115.977 -0.556 . . . . 1.0 111.115 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -69.61 -178.9 2.5 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 C-N-CA 122.419 2.079 . . . . 1.0 112.133 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1336 ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -38.1 100.83 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.175 0 CA-C-O 121.168 0.509 . . . . 1.0 111.205 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 1337 ' ' MET . . . . . . . . . . . . . 27.7 ttt . . . . . 0 C--O 1.219 -0.52 0 CA-C-O 117.978 -1.011 . . . . 1.0 110.56 -179.836 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A 1259 ' ' ASN . . . . . . . . . . . . . 24.7 m120 . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.481 -0.563 . . . . 1.0 109.481 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A 1260 ' ' ASP . . . . . 0.433 ' O ' ' OD1' ' A' 1260 ' ' ASP . 2.3 p30 41.75 59.23 9.5 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.025 -0.534 . . . . 1.0 111.037 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1261 ' ' PRO . . . . . 0.514 ' C ' ' H ' ' A' 1263 ' ' SER . 72.6 Cg_endo -72.99 141.3 32.86 Favored 'Trans proline' 0 C--N 1.308 -1.571 0 C-N-CA 122.575 2.184 . . . . 1.0 111.722 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 55.0 mtpt 47.38 9.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 1.0 111.156 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1263 ' ' SER . . . . . 0.514 ' H ' ' C ' ' A' 1261 ' ' PRO . 50.4 m -61.0 -42.66 98.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.891 0.376 . . . . 1.0 110.701 -179.705 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1264 ' ' GLN . . . . . 0.431 ' O ' ' SG ' ' A' 1268 ' ' CYS . 28.0 mm100 -65.08 -46.88 79.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.102 -0.499 . . . . 1.0 111.497 -179.451 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1265 ' ' LEU . . . . . . . . . . . . . 92.7 mt -64.66 -42.03 95.69 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.35 -0.386 . . . . 1.0 111.59 -179.256 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -64.9 -43.54 92.52 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.47 -0.492 . . . . 1.0 110.575 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 -68.19 -38.61 82.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.087 -0.506 . . . . 1.0 110.944 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1268 ' ' CYS . . . . . 0.431 ' SG ' ' O ' ' A' 1264 ' ' GLN . 93.5 m -64.9 -36.48 84.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.45 -0.341 . . . . 1.0 111.047 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 84.0 m -56.5 -36.69 69.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.753 0.311 . . . . 1.0 110.839 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 97.2 mt -63.25 -40.87 98.64 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.329 -0.396 . . . . 1.0 111.042 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1271 ' ' THR . . . . . 0.409 ' OG1' ' O ' ' A' 1268 ' ' CYS . 68.3 p -67.76 -26.31 66.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.195 -0.457 . . . . 1.0 111.369 -179.345 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 82.2 mt -85.68 86.65 7.35 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.823 0.344 . . . . 1.0 111.382 -178.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -119.19 117.98 30.09 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.071 -0.513 . . . . 1.0 110.112 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1274 ' ' THR . . . . . 0.427 ' OG1' ' OE1' ' A' 1336 ' ' GLN . 6.8 m -129.04 131.24 47.32 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 120.844 0.355 . . . . 1.0 110.268 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -113.03 134.97 54.28 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.207 -0.451 . . . . 1.0 110.304 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 89.67 7.11 69.32 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 111.38 -0.688 . . . . 1.0 111.38 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 50.6 mtpt -138.41 -168.75 2.44 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.79 0.329 . . . . 1.0 110.613 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -93.38 136.02 24.77 Favored Pre-proline 0 CA--C 1.536 0.409 0 CA-C-N 116.11 -0.495 . . . . 1.0 110.104 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -76.49 87.74 1.42 Allowed 'Trans proline' 0 N--CA 1.493 1.461 0 C-N-CA 121.869 1.713 . . . . 1.0 112.353 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1280 ' ' ASP . . . . . 0.48 ' OD2' ' NZ ' ' A' 1305 ' ' LYS . 78.3 m-20 -86.49 124.39 32.76 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.726 -0.472 . . . . 1.0 109.726 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1281 ' ' ILE . . . . . 0.426 HD13 HG21 ' A' 1281 ' ' ILE . 2.5 mt -148.02 124.08 5.34 Favored Pre-proline 0 CA--C 1.54 0.579 0 N-CA-C 109.972 -0.381 . . . . 1.0 109.972 -179.177 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 45.0 Cg_exo -51.79 131.44 37.97 Favored 'Trans proline' 0 N--CA 1.494 1.501 0 CA-C-N 120.246 1.123 . . . . 1.0 111.828 179.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 55.6 mt -134.74 152.49 51.8 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.028 -0.533 . . . . 1.0 109.871 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1284 ' ' TYR . . . . . 0.465 ' CD1' ' OE1' ' A' 1321 ' ' GLU . 84.6 m-85 -78.46 137.8 38.14 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.043 0.449 . . . . 1.0 111.152 -179.655 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 85.7 tttt -139.01 104.81 5.13 Favored 'General case' 0 N--CA 1.462 0.175 0 N-CA-C 108.918 -0.771 . . . . 1.0 108.918 178.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 24.0 m -63.17 134.93 56.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.406 0.622 . . . . 1.0 112.174 -178.218 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 70.3 mt -87.0 -169.22 2.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.179 -0.919 . . . . 1.0 109.998 179.602 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -106.44 136.88 45.43 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 109.593 -0.521 . . . . 1.0 109.593 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1289 ' ' THR . . . . . . . . . . . . . 3.5 p -88.87 115.09 26.16 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.156 -0.475 . . . . 1.0 111.452 -178.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 7.1 m -133.55 123.56 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 121.034 0.445 . . . . 1.0 110.153 178.728 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.29 166.42 26.41 Favored Glycine 0 CA--C 1.524 0.644 0 N-CA-C 110.674 -0.97 . . . . 1.0 110.674 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -67.9 -42.89 5.73 Favored 'Trans proline' 0 C--N 1.306 -1.667 0 C-N-CA 122.467 2.112 . . . . 1.0 111.125 179.217 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1293 ' ' SER . . . . . . . . . . . . . 31.4 t -90.3 165.51 13.85 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.621 -0.718 . . . . 1.0 110.484 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -58.11 -14.49 6.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.281 -0.418 . . . . 1.0 110.207 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -65.92 142.0 58.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.922 -0.581 . . . . 1.0 110.72 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -110.53 145.19 38.19 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.211 -0.45 . . . . 1.0 110.837 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1297 ' ' THR . . . . . . . . . . . . . 94.9 m -116.25 124.31 49.88 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.264 -0.643 . . . . 1.0 109.264 178.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -96.37 119.83 35.58 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.057 0.456 . . . . 1.0 110.786 -179.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1299 ' ' THR . . . . . . . . . . . . . 88.8 m -127.35 127.97 45.11 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.777 -0.647 . . . . 1.0 110.321 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1300 ' ' VAL . . . . . 0.548 HG11 ' OE2' ' A' 1321 ' ' GLU . 25.3 t -118.26 128.43 75.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 N-CA-C 109.58 -0.526 . . . . 1.0 109.58 179.636 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -130.69 148.7 52.51 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.3 -0.409 . . . . 1.0 110.228 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 3.0 t -105.91 125.95 61.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 N-CA-C 109.54 -0.541 . . . . 1.0 109.54 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -107.3 129.0 54.94 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.904 0.383 . . . . 1.0 110.878 -179.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 88.7 t80 -139.08 119.73 14.1 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 115.886 -0.597 . . . . 1.0 109.698 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1305 ' ' LYS . . . . . 0.48 ' NZ ' ' OD2' ' A' 1280 ' ' ASP . 72.7 mmtt 49.25 32.51 4.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.388 -0.369 . . . . 1.0 110.115 -179.637 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 78.35 21.48 69.89 Favored Glycine 0 CA--C 1.526 0.74 0 C-N-CA 121.076 -0.583 . . . . 1.0 111.816 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -121.08 130.86 53.94 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 116.987 0.393 . . . . 1.0 110.865 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 44.5 ttm180 -87.44 90.92 8.55 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.241 -0.651 . . . . 1.0 109.241 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 34.7 pt -81.35 -17.29 12.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 112.715 0.635 . . . . 1.0 112.715 -178.064 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -147.51 156.8 27.14 Favored Glycine 0 CA--C 1.525 0.669 0 C-N-CA 120.389 -0.91 . . . . 1.0 112.089 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 2.6 p -177.0 144.5 0.44 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.395 -0.403 . . . . 1.0 109.99 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -165.57 158.86 31.9 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 111.093 -0.803 . . . . 1.0 111.093 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 68.2 mttm -129.02 141.2 51.32 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.678 0.275 . . . . 1.0 110.269 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -164.33 -179.76 38.68 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.812 -0.915 . . . . 1.0 110.812 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -58.93 -59.82 0.42 Allowed 'Trans proline' 0 N--CA 1.494 1.521 0 C-N-CA 122.132 1.888 . . . . 1.0 112.017 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1316 ' ' SER . . . . . 0.438 ' OG ' ' OE1' ' A' 1319 ' ' GLN . 6.5 p -103.33 168.97 8.82 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.114 -0.494 . . . . 1.0 110.658 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 43.4 mt -67.05 -41.54 87.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.874 -0.603 . . . . 1.0 110.955 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -51.57 -41.41 61.12 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.463 -0.335 . . . . 1.0 111.215 -178.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1319 ' ' GLN . . . . . 0.438 ' OE1' ' OG ' ' A' 1316 ' ' SER . 7.3 mp0 -64.54 -39.77 94.36 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.753 -0.379 . . . . 1.0 110.052 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -65.88 -37.4 86.04 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.169 -0.469 . . . . 1.0 110.99 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1321 ' ' GLU . . . . . 0.548 ' OE2' HG11 ' A' 1300 ' ' VAL . 80.5 mm-40 -61.08 -50.22 74.16 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.452 -0.34 . . . . 1.0 110.862 -179.67 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1322 ' ' MET . . . . . . . . . . . . . 63.7 mtm -66.51 -38.95 88.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.137 -0.483 . . . . 1.0 111.553 -179.337 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -62.42 -48.28 83.29 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.891 -0.884 . . . . 1.0 110.891 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -66.12 -35.33 80.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.926 0.393 . . . . 1.0 110.601 179.494 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -57.69 -48.64 78.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.903 -0.589 . . . . 1.0 112.031 -179.03 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1326 ' ' MET . . . . . . . . . . . . . 93.8 mmm -63.67 -40.57 97.17 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.809 -0.356 . . . . 1.0 111.598 -179.014 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -67.7 -28.79 67.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.731 0.3 . . . . 1.0 111.173 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1328 ' ' ALA . . . . . . . . . . . . . . . -62.04 -35.45 78.63 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.414 0.524 . . . . 1.0 112.414 -178.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.93 -40.47 93.35 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 120.923 -0.311 . . . . 1.0 111.329 -178.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -75.09 15.07 0.45 Allowed 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.258 0.466 . . . . 1.0 112.258 -178.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 97.0 mttt -146.24 45.39 1.24 Allowed 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 113.061 0.763 . . . . 1.0 113.061 -178.565 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1332 ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -101.96 153.32 19.99 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.145 0.497 . . . . 1.0 110.342 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 98.2 m-20 -127.74 -177.47 4.12 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.508 -0.769 . . . . 1.0 110.629 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 1334 ' ' PHE . . . . . 0.477 ' O ' ' O ' ' A' 1335 ' ' PRO . 61.7 m-85 -42.48 153.98 0.29 Allowed Pre-proline 0 CA--C 1.534 0.355 0 CA-C-N 115.815 -0.63 . . . . 1.0 110.662 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1335 ' ' PRO . . . . . 0.477 ' O ' ' O ' ' A' 1334 ' ' PHE . 77.3 Cg_exo -39.73 174.77 0.0 OUTLIER 'Trans proline' 0 N--CA 1.496 1.66 0 C-N-CA 122.826 2.351 . . . . 1.0 113.56 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1336 ' ' GLN . . . . . 0.427 ' OE1' ' OG1' ' A' 1274 ' ' THR . 11.2 mt-30 -36.89 117.49 0.51 Allowed 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.382 -0.826 . . . . 1.0 110.99 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 1337 ' ' MET . . . . . . . . . . . . . 27.3 ttt . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 117.989 -1.005 . . . . 1.0 110.677 -179.524 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A 1259 ' ' ASN . . . . . . . . . . . . . 54.5 t30 . . . . . 0 N--CA 1.491 1.62 0 N-CA-C 109.319 -0.622 . . . . 1.0 109.319 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A 1260 ' ' ASP . . . . . . . . . . . . . 47.1 t0 -173.07 63.62 0.3 Allowed Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.229 -0.441 . . . . 1.0 110.581 -179.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1261 ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.89 -95.14 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.591 0 C-N-CA 122.484 2.123 . . . . 1.0 112.366 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 87.7 mttt -92.01 1.99 56.84 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.975 0.417 . . . . 1.0 110.508 -179.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1263 ' ' SER . . . . . . . . . . . . . 35.9 m -59.16 -31.23 68.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.697 -0.683 . . . . 1.0 111.681 -179.388 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -56.75 -53.01 62.67 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.705 -0.398 . . . . 1.0 111.49 -178.376 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1265 ' ' LEU . . . . . 0.489 ' O ' ' SG ' ' A' 1269 ' ' CYS . 15.9 mt -67.87 -39.29 83.75 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.671 -0.411 . . . . 1.0 111.037 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -57.72 -43.9 85.61 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.543 -0.299 . . . . 1.0 111.175 -179.218 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -64.06 -42.48 97.0 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.502 -0.479 . . . . 1.0 110.522 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1268 ' ' CYS . . . . . . . . . . . . . 91.5 m -70.7 -36.59 73.33 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.176 -0.466 . . . . 1.0 110.936 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1269 ' ' CYS . . . . . 0.489 ' SG ' ' O ' ' A' 1265 ' ' LEU . 87.9 m -62.43 -35.23 78.62 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.092 -0.503 . . . . 1.0 112.018 -178.724 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 81.5 mt -61.96 -39.43 92.11 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.889 -0.324 . . . . 1.0 110.738 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1271 ' ' THR . . . . . . . . . . . . . 58.0 p -65.36 -29.19 69.89 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.969 -0.292 . . . . 1.0 111.15 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 87.2 mt -74.66 86.88 2.15 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.798 -0.361 . . . . 1.0 110.59 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 100.0 mtt180 -118.41 116.04 25.89 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.269 -0.423 . . . . 1.0 110.131 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1274 ' ' THR . . . . . . . . . . . . . 3.0 m -124.28 124.64 42.85 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.875 0.369 . . . . 1.0 110.162 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -112.71 138.18 49.91 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.024 -0.535 . . . . 1.0 110.194 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 90.38 0.62 76.23 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.677 -0.969 . . . . 1.0 110.677 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 21.5 mtpp -135.31 -167.5 2.02 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.11 0.481 . . . . 1.0 110.589 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -94.28 130.17 34.83 Favored Pre-proline 0 CA--C 1.536 0.423 0 CA-C-N 115.713 -0.676 . . . . 1.0 109.606 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -78.15 110.24 2.84 Favored 'Trans proline' 0 N--CA 1.493 1.466 0 C-N-CA 121.798 1.666 . . . . 1.0 112.683 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -104.24 129.73 52.04 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.887 -0.597 . . . . 1.0 109.584 178.561 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1281 ' ' ILE . . . . . 0.409 HG21 HD13 ' A' 1281 ' ' ILE . 4.8 mt -147.31 121.95 5.14 Favored Pre-proline 0 CA--C 1.54 0.571 0 CA-C-O 119.303 -0.38 . . . . 1.0 110.308 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -56.27 141.89 88.13 Favored 'Trans proline' 0 N--CA 1.494 1.532 0 CA-C-N 120.337 1.156 . . . . 1.0 111.129 178.552 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 89.9 mt -139.12 160.67 39.24 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.724 0.297 . . . . 1.0 110.393 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1284 ' ' TYR . . . . . 0.531 ' CD1' ' OE1' ' A' 1321 ' ' GLU . 62.8 m-85 -78.52 139.73 38.62 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.123 0.487 . . . . 1.0 111.46 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -151.34 107.56 3.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.588 -0.733 . . . . 1.0 109.998 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 18.5 m -74.78 140.59 44.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.11 0.481 . . . . 1.0 111.063 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 73.3 mt -81.73 -169.93 2.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.637 -0.711 . . . . 1.0 110.672 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -107.08 136.4 47.0 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.9 -0.591 . . . . 1.0 109.561 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1289 ' ' THR . . . . . . . . . . . . . 57.3 p -83.27 115.05 21.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.982 0.42 . . . . 1.0 111.701 -178.505 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 9.4 m -143.9 122.19 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 115.682 -0.69 . . . . 1.0 109.449 178.38 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.46 172.37 24.33 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 111.113 -0.795 . . . . 1.0 111.113 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -72.14 -46.49 0.52 Allowed 'Trans proline' 0 C--N 1.307 -1.646 0 C-N-CA 122.494 2.129 . . . . 1.0 111.143 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1293 ' ' SER . . . . . . . . . . . . . 11.3 t -89.85 165.34 14.18 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.656 -0.702 . . . . 1.0 110.046 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 28.2 m170 -59.73 -18.96 46.9 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.621 -0.511 . . . . 1.0 109.621 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -59.76 144.15 49.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.812 -0.631 . . . . 1.0 109.963 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 85.2 mtm-85 -117.54 143.51 46.01 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.014 0.435 . . . . 1.0 111.038 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1297 ' ' THR . . . . . . . . . . . . . 91.8 m -120.17 127.28 52.33 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.734 -0.666 . . . . 1.0 109.808 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -99.82 116.41 31.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.026 0.441 . . . . 1.0 110.721 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1299 ' ' THR . . . . . . . . . . . . . 91.8 m -127.11 130.31 49.6 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.743 -0.662 . . . . 1.0 110.092 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 83.2 t -111.44 129.86 66.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 N-CA-C 109.734 -0.469 . . . . 1.0 109.734 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -129.25 140.91 51.28 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.077 0.465 . . . . 1.0 110.93 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 43.7 t -113.25 128.36 70.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 N-CA-C 108.65 -0.87 . . . . 1.0 108.65 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -113.66 141.37 47.31 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.029 0.443 . . . . 1.0 110.934 -178.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1304 ' ' PHE . . . . . 0.551 ' HZ ' HE22 ' A' 1336 ' ' GLN . 79.1 t80 -149.43 109.08 4.02 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.593 -0.731 . . . . 1.0 110.159 -179.534 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 49.87 30.07 3.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.281 -0.418 . . . . 1.0 110.808 179.758 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 86.04 1.97 86.33 Favored Glycine 0 CA--C 1.525 0.69 0 C-N-CA 121.317 -0.468 . . . . 1.0 112.06 178.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -106.5 115.95 31.09 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 110.132 -0.322 . . . . 1.0 110.132 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -72.52 130.16 40.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.466 . . . . 1.0 110.302 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 30.5 pt -122.46 23.23 4.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-N 116.484 -0.325 . . . . 1.0 110.906 -179.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -155.96 153.28 24.62 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 111.354 -0.699 . . . . 1.0 111.354 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1311 ' ' CYS . . . . . 0.412 ' SG ' ' OD2' ' A' 1327 ' ' ASP . 31.3 p -167.65 164.23 14.51 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.21 -0.293 . . . . 1.0 110.21 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . 121.92 157.64 10.07 Favored Glycine 0 N--CA 1.468 0.801 0 N-CA-C 110.939 -0.864 . . . . 1.0 110.939 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 68.6 mttm -129.61 151.3 50.37 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.93 0.395 . . . . 1.0 110.758 -179.563 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -159.49 163.72 33.64 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 110.434 -1.067 . . . . 1.0 110.434 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -64.58 -67.13 0.04 OUTLIER 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 122.408 2.072 . . . . 1.0 111.697 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1316 ' ' SER . . . . . . . . . . . . . 13.6 p -83.89 164.27 19.53 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.361 -0.381 . . . . 1.0 110.328 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 36.7 mm -65.29 -44.31 94.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.12 -0.491 . . . . 1.0 110.836 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -55.36 -42.99 74.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.085 -0.507 . . . . 1.0 111.712 -178.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -60.01 -41.75 92.83 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.593 -0.443 . . . . 1.0 110.708 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -68.55 -37.76 80.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.307 -0.406 . . . . 1.0 110.998 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1321 ' ' GLU . . . . . 0.531 ' OE1' ' CD1' ' A' 1284 ' ' TYR . 64.8 mm-40 -61.58 -45.35 94.51 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.305 -0.407 . . . . 1.0 111.821 -179.11 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1322 ' ' MET . . . . . 0.579 ' N ' ' SD ' ' A' 1322 ' ' MET . 0.1 OUTLIER -64.2 -41.08 97.23 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.805 -0.358 . . . . 1.0 111.366 -179.259 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -64.97 -43.39 95.98 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 120.799 -0.715 . . . . 1.0 111.847 -179.218 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -66.35 -38.21 87.08 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.737 0.273 . . . . 1.0 111.737 -179.125 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -61.03 -42.69 98.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.477 -0.328 . . . . 1.0 111.862 -178.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1326 ' ' MET . . . . . . . . . . . . . 2.0 tpt -62.74 -41.83 99.37 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.471 -0.492 . . . . 1.0 110.064 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1327 ' ' ASP . . . . . 0.412 ' OD2' ' SG ' ' A' 1311 ' ' CYS . 64.7 m-20 -65.04 -34.7 79.05 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.965 -0.561 . . . . 1.0 110.544 -179.383 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1328 ' ' ALA . . . . . 0.499 ' O ' ' CD2' ' A' 1332 ' ' TYR . . . -58.83 -23.75 61.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.307 -0.406 . . . . 1.0 111.45 -179.541 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 92.6 mt -62.48 -42.48 99.52 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.727 -0.389 . . . . 1.0 110.838 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -95.11 23.98 5.27 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.357 -0.383 . . . . 1.0 111.955 -178.493 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 97.3 mttt -137.82 42.55 2.29 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 120.697 -0.401 . . . . 1.0 111.072 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1332 ' ' TYR . . . . . 0.499 ' CD2' ' O ' ' A' 1328 ' ' ALA . 14.0 m-85 -115.15 145.98 41.83 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.285 0.564 . . . . 1.0 110.977 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -117.76 -176.71 3.09 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.368 -0.833 . . . . 1.0 108.819 178.729 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -41.8 148.7 0.44 Allowed Pre-proline 0 CA--C 1.536 0.405 0 C-N-CA 120.711 -0.396 . . . . 1.0 110.475 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -68.46 154.63 71.4 Favored 'Trans proline' 0 N--CA 1.497 1.72 0 C-N-CA 122.292 1.995 . . . . 1.0 111.763 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1336 ' ' GLN . . . . . 0.551 HE22 ' HZ ' ' A' 1304 ' ' PHE . 73.5 mm-40 -43.43 114.96 0.7 Allowed 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 120.772 0.32 . . . . 1.0 110.26 -179.615 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 1337 ' ' MET . . . . . . . . . . . . . 94.8 mmm . . . . . 0 C--O 1.22 -0.486 0 CA-C-O 117.78 -1.105 . . . . 1.0 110.652 -179.308 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A 1259 ' ' ASN . . . . . 0.432 ' O ' ' OG ' ' A' 1263 ' ' SER . 61.1 t30 . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.504 -0.554 . . . . 1.0 109.504 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1260 ' ' ASP . . . . . 0.577 ' N ' ' CD ' ' A' 1261 ' ' PRO . 0.2 OUTLIER -104.45 -43.27 0.17 Allowed Pre-proline 0 CA--C 1.537 0.471 0 CA-C-N 116.36 -0.382 . . . . 1.0 110.612 -179.773 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A 1261 ' ' PRO . . . . . 0.577 ' CD ' ' N ' ' A' 1260 ' ' ASP . 45.0 Cg_exo -55.59 -37.87 94.74 Favored 'Trans proline' 0 N--CA 1.499 1.812 0 C-N-CA 122.481 2.121 . . . . 1.0 112.727 -179.516 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 56.8 mttp -94.04 -8.03 41.0 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.428 -0.351 . . . . 1.0 111.731 -178.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1263 ' ' SER . . . . . 0.432 ' OG ' ' O ' ' A' 1259 ' ' ASN . 64.8 m -52.09 -39.86 60.39 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.532 -0.467 . . . . 1.0 110.807 -179.398 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -63.26 -47.89 80.49 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.878 0.37 . . . . 1.0 110.495 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1265 ' ' LEU . . . . . 0.41 HD11 ' CE1' ' A' 1284 ' ' TYR . 88.2 mt -65.71 -39.76 91.54 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.114 -0.494 . . . . 1.0 111.413 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -54.1 -40.27 67.14 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 121.043 -0.263 . . . . 1.0 111.007 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -62.95 -42.41 99.81 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.728 -0.389 . . . . 1.0 110.425 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1268 ' ' CYS . . . . . 0.407 ' O ' ' OG1' ' A' 1271 ' ' THR . 90.4 m -66.28 -37.2 84.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.296 -0.411 . . . . 1.0 110.747 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 99.8 m -59.18 -35.38 73.48 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.261 -0.427 . . . . 1.0 110.964 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 86.2 mt -62.61 -40.89 98.38 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.335 -0.393 . . . . 1.0 110.991 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1271 ' ' THR . . . . . 0.407 ' OG1' ' O ' ' A' 1268 ' ' CYS . 74.3 p -65.68 -31.68 72.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.339 -0.391 . . . . 1.0 111.562 -179.131 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 72.1 mt -74.28 83.69 1.89 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.599 -0.44 . . . . 1.0 110.578 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 7.3 mmp_? -119.51 110.76 17.27 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.244 -0.435 . . . . 1.0 110.842 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1274 ' ' THR . . . . . . . . . . . . . 21.6 m -129.29 129.89 45.46 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 109.94 -0.393 . . . . 1.0 109.94 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -112.42 136.52 51.81 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.937 0.399 . . . . 1.0 110.705 -179.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 88.37 8.27 71.41 Favored Glycine 0 CA--C 1.526 0.747 0 CA-C-N 116.06 -0.518 . . . . 1.0 111.894 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 50.4 mtpt -138.91 -172.27 3.28 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.212 0.529 . . . . 1.0 111.113 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -94.5 108.95 40.29 Favored Pre-proline 0 CA--C 1.537 0.47 0 CA-C-N 115.275 -0.875 . . . . 1.0 109.41 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -80.97 92.95 1.03 Allowed 'Trans proline' 0 N--CA 1.491 1.33 0 C-N-CA 121.769 1.646 . . . . 1.0 112.476 -179.185 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -80.94 141.43 34.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.163 -0.471 . . . . 1.0 109.742 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 10.5 mt -141.51 133.0 13.48 Favored Pre-proline 0 CA--C 1.536 0.417 0 N-CA-C 110.066 -0.346 . . . . 1.0 110.066 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -76.12 120.0 5.54 Favored 'Trans proline' 0 N--CA 1.491 1.342 0 C-N-CA 121.538 1.492 . . . . 1.0 111.466 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1283 ' ' LEU . . . . . 0.404 HD12 ' N ' ' A' 1283 ' ' LEU . 11.0 mp -106.11 153.22 22.39 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.147 -0.479 . . . . 1.0 109.759 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1284 ' ' TYR . . . . . 0.41 ' CE1' HD11 ' A' 1265 ' ' LEU . 3.0 m-85 -77.14 141.26 40.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.289 0.566 . . . . 1.0 111.042 -179.321 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 64.3 tttm -136.57 124.89 23.27 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.313 -0.858 . . . . 1.0 109.471 179.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 59.3 m -85.65 129.87 34.71 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.918 0.389 . . . . 1.0 111.087 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 77.2 mt -82.95 -170.49 3.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.919 -0.582 . . . . 1.0 110.128 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -107.99 152.73 24.08 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.097 -0.502 . . . . 1.0 109.909 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1289 ' ' THR . . . . . . . . . . . . . 73.3 p -86.53 113.21 22.25 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.896 0.379 . . . . 1.0 111.427 -179.1 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 3.4 m -149.43 122.57 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.916 -0.584 . . . . 1.0 109.915 178.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -141.85 166.85 26.14 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.123 -0.791 . . . . 1.0 111.123 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -63.27 -47.22 8.29 Favored 'Trans proline' 0 C--N 1.307 -1.609 0 C-N-CA 122.761 2.308 . . . . 1.0 111.077 179.263 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1293 ' ' SER . . . . . . . . . . . . . 31.2 t -85.49 165.36 17.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.537 -0.756 . . . . 1.0 110.416 179.56 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 17.9 m170 -59.45 -14.91 14.21 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.876 -0.416 . . . . 1.0 109.876 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -65.33 144.49 57.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.835 -0.62 . . . . 1.0 111.317 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -105.67 136.46 45.24 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.059 -0.519 . . . . 1.0 110.409 179.525 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1297 ' ' THR . . . . . . . . . . . . . 55.5 m -124.33 127.91 48.31 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 109.871 -0.418 . . . . 1.0 109.871 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -96.95 123.5 40.69 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.928 0.395 . . . . 1.0 110.251 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1299 ' ' THR . . . . . . . . . . . . . 99.6 m -126.76 130.5 50.44 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.012 -0.54 . . . . 1.0 110.722 -179.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 56.5 t -117.59 129.88 73.35 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.19 0 N-CA-C 109.076 -0.713 . . . . 1.0 109.076 179.266 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -129.01 147.73 50.9 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.146 0.498 . . . . 1.0 111.104 -179.088 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 29.5 t -114.16 129.84 69.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.555 -0.748 . . . . 1.0 109.055 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -113.59 141.44 47.17 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.212 0.53 . . . . 1.0 111.825 -178.723 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1304 ' ' PHE . . . . . 0.618 ' CE1' ' NE2' ' A' 1336 ' ' GLN . 80.1 t80 -137.58 100.58 4.25 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.242 -0.89 . . . . 1.0 109.355 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 50.7 mtmt 43.75 39.81 2.71 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.233 -0.439 . . . . 1.0 110.883 -178.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 88.53 6.37 73.7 Favored Glycine 0 CA--C 1.528 0.902 0 CA-C-N 116.266 -0.425 . . . . 1.0 112.361 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -112.45 121.47 44.92 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.854 0.359 . . . . 1.0 110.288 179.528 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 37.5 ttm180 -80.37 134.24 36.01 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.126 -0.488 . . . . 1.0 110.699 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 36.2 pt -131.25 9.71 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-N 116.152 -0.476 . . . . 1.0 110.442 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -159.27 151.7 22.6 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.897 -0.881 . . . . 1.0 110.897 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 9.2 t -170.8 47.1 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.76 0.314 . . . . 1.0 110.723 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1312 ' ' GLY . . . . . 0.555 ' H ' ' HB2' ' A' 1324 ' ' ALA . . . -75.77 149.61 38.4 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 111.231 -0.748 . . . . 1.0 111.231 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -136.2 149.14 48.44 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 110.137 -0.32 . . . . 1.0 110.137 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -177.94 163.47 31.74 Favored Glycine 0 CA--C 1.53 1.018 0 N-CA-C 110.663 -0.975 . . . . 1.0 110.663 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -53.7 -45.8 38.4 Favored 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 121.551 1.501 . . . . 1.0 112.16 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1316 ' ' SER . . . . . . . . . . . . . 91.1 p -105.32 161.99 13.82 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.005 0.431 . . . . 1.0 111.189 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 46.2 mm -64.97 -44.7 96.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.712 -0.677 . . . . 1.0 110.9 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -55.75 -44.04 77.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.146 -0.479 . . . . 1.0 111.124 -178.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -66.77 -39.38 87.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.509 -0.314 . . . . 1.0 110.881 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -65.21 -39.68 93.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 1.0 111.405 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -66.8 -35.54 80.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.588 -0.278 . . . . 1.0 111.291 -179.341 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1322 ' ' MET . . . . . . . . . . . . . 59.7 mtt -62.38 -42.17 99.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.515 -0.311 . . . . 1.0 110.769 -179.281 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -67.35 -43.32 88.38 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 111.196 -0.762 . . . . 1.0 111.196 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1324 ' ' ALA . . . . . 0.555 ' HB2' ' H ' ' A' 1312 ' ' GLY . . . -67.48 -39.47 85.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.725 0.298 . . . . 1.0 111.31 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -64.66 -41.22 96.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.438 -0.346 . . . . 1.0 111.599 -179.135 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1326 ' ' MET . . . . . . . . . . . . . 22.3 tpp -61.37 -48.56 80.72 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.87 -0.332 . . . . 1.0 110.436 -179.218 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -65.49 -37.46 86.87 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.998 -0.546 . . . . 1.0 111.186 -179.765 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1328 ' ' ALA . . . . . 0.531 ' O ' ' CD2' ' A' 1332 ' ' TYR . . . -56.47 -25.05 49.83 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 111.973 0.361 . . . . 1.0 111.973 -178.535 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 78.3 mt -62.61 -42.23 99.46 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.98 0.363 . . . . 1.0 111.98 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -95.19 23.89 5.4 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 111.994 0.368 . . . . 1.0 111.994 -178.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -132.44 34.46 3.72 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 121.197 -0.201 . . . . 1.0 110.973 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1332 ' ' TYR . . . . . 0.531 ' CD2' ' O ' ' A' 1328 ' ' ALA . 29.2 m-85 -111.5 139.38 46.98 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.325 0.583 . . . . 1.0 110.956 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1333 ' ' ASN . . . . . 0.451 ' O ' ' O ' ' A' 1334 ' ' PHE . 89.3 m-20 -102.78 -175.46 2.82 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 115.141 -0.936 . . . . 1.0 110.187 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1334 ' ' PHE . . . . . 0.451 ' O ' ' O ' ' A' 1333 ' ' ASN . 0.5 OUTLIER -49.27 -179.56 0.03 OUTLIER Pre-proline 0 CA--C 1.539 0.542 0 N-CA-C 109.024 -0.732 . . . . 1.0 109.024 179.408 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -59.34 145.11 98.88 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 121.704 1.603 . . . . 1.0 111.693 -179.316 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1336 ' ' GLN . . . . . 0.618 ' NE2' ' CE1' ' A' 1304 ' ' PHE . 1.3 mm100 -63.05 125.99 25.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.056 -0.52 . . . . 1.0 110.53 -179.293 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 1337 ' ' MET . . . . . . . . . . . . . 98.7 mtp . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.971 -1.014 . . . . 1.0 110.406 -179.935 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A 1259 ' ' ASN . . . . . . . . . . . . . 56.4 m-20 . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.003 -0.74 . . . . 1.0 109.003 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A 1260 ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -177.02 74.28 0.24 Allowed Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.422 -0.354 . . . . 1.0 110.824 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1261 ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -53.33 -41.12 75.17 Favored 'Trans proline' 0 C--N 1.307 -1.657 0 C-N-CA 122.645 2.23 . . . . 1.0 112.104 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 18.7 pttp -162.29 31.69 0.11 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.303 -0.408 . . . . 1.0 110.773 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1263 ' ' SER . . . . . . . . . . . . . 58.2 m -61.13 -32.13 71.83 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.133 -0.485 . . . . 1.0 110.623 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1264 ' ' GLN . . . . . 0.501 ' O ' ' SG ' ' A' 1268 ' ' CYS . 28.3 mp0 -57.04 -49.55 75.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.22 -0.446 . . . . 1.0 110.986 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1265 ' ' LEU . . . . . . . . . . . . . 34.4 mt -63.39 -40.6 97.67 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.762 -0.375 . . . . 1.0 110.605 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -63.71 -45.45 89.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.352 -0.386 . . . . 1.0 110.789 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -70.51 -39.61 74.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.447 -0.342 . . . . 1.0 111.236 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1268 ' ' CYS . . . . . 0.501 ' SG ' ' O ' ' A' 1264 ' ' GLN . 89.2 m -60.93 -35.57 77.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.46 -0.336 . . . . 1.0 111.376 -179.317 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 83.9 m -54.71 -37.95 66.46 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.864 -0.335 . . . . 1.0 111.005 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1270 ' ' LEU . . . . . 0.457 HD22 ' N ' ' A' 1270 ' ' LEU . 3.6 mm? -64.89 -39.86 94.2 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.931 -0.308 . . . . 1.0 111.07 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1271 ' ' THR . . . . . . . . . . . . . 76.6 p -66.06 -31.11 71.79 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.979 0.363 . . . . 1.0 111.979 -178.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 60.4 mt -81.09 89.54 5.98 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 120.626 -0.43 . . . . 1.0 110.83 -179.35 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -119.19 151.76 37.79 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.088 -0.506 . . . . 1.0 110.57 179.451 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1274 ' ' THR . . . . . . . . . . . . . 1.3 m -126.91 162.03 26.91 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 109.866 -0.42 . . . . 1.0 109.866 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1275 ' ' GLU . . . . . 0.545 ' C ' ' H ' ' A' 1277 ' ' LYS . 79.0 tt0 -87.97 100.18 12.71 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 112.273 0.472 . . . . 1.0 112.273 -178.603 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 57.83 -13.97 0.02 OUTLIER Glycine 0 CA--C 1.529 0.92 0 CA-C-N 115.729 -0.669 . . . . 1.0 113.353 178.251 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1277 ' ' LYS . . . . . 0.545 ' H ' ' C ' ' A' 1275 ' ' GLU . 48.9 mtpt -79.17 -166.25 0.9 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 117.694 0.747 . . . . 1.0 110.474 -179.747 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -93.45 110.14 44.96 Favored Pre-proline 0 CA--C 1.538 0.5 0 CA-C-N 116.039 -0.528 . . . . 1.0 109.813 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -80.65 114.85 3.03 Favored 'Trans proline' 0 N--CA 1.492 1.403 0 C-N-CA 121.867 1.712 . . . . 1.0 112.171 -179.099 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1280 ' ' ASP . . . . . 0.518 ' OD2' ' NZ ' ' A' 1305 ' ' LYS . 66.0 m-20 -83.82 133.54 34.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.001 -0.545 . . . . 1.0 109.982 179.459 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1281 ' ' ILE . . . . . 0.419 HD13 HG21 ' A' 1281 ' ' ILE . 1.8 mt -144.76 127.89 8.51 Favored Pre-proline 0 CA--C 1.538 0.501 0 CA-C-O 118.991 -0.528 . . . . 1.0 110.138 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 43.3 Cg_exo -52.95 135.57 58.62 Favored 'Trans proline' 0 N--CA 1.493 1.469 0 CA-C-N 120.482 1.208 . . . . 1.0 111.31 177.702 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 80.5 mt -122.32 152.63 39.91 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 109.596 -0.52 . . . . 1.0 109.596 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1284 ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -81.1 136.41 35.92 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.95 0.405 . . . . 1.0 110.914 -179.029 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 62.9 tttm -141.17 113.74 8.22 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.922 -0.581 . . . . 1.0 109.92 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 97.3 m -92.14 127.05 37.47 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.321 -0.399 . . . . 1.0 110.87 -179.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 60.0 mt -74.91 -172.45 1.61 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.276 -0.42 . . . . 1.0 109.948 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -108.13 126.01 52.27 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 120.84 0.352 . . . . 1.0 110.205 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1289 ' ' THR . . . . . . . . . . . . . 18.0 p -62.55 122.56 16.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.052 -0.522 . . . . 1.0 111.392 -179.054 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 15.8 m -153.25 122.62 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.809 -0.632 . . . . 1.0 109.773 178.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.01 166.67 26.25 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 111.039 -0.824 . . . . 1.0 111.039 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -66.03 -43.46 9.05 Favored 'Trans proline' 0 C--N 1.307 -1.638 0 C-N-CA 122.636 2.224 . . . . 1.0 110.852 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1293 ' ' SER . . . . . . . . . . . . . 30.3 t -89.97 165.26 14.17 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.394 -0.821 . . . . 1.0 110.126 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 71.0 m80 -59.11 -15.37 13.8 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.915 -0.402 . . . . 1.0 109.915 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -63.88 138.66 58.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.929 -0.578 . . . . 1.0 110.783 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 83.5 mtm-85 -101.87 142.41 33.23 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.193 -0.458 . . . . 1.0 110.766 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1297 ' ' THR . . . . . . . . . . . . . 94.6 m -118.73 124.33 47.04 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.958 -0.565 . . . . 1.0 109.8 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -98.51 116.03 29.86 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.362 -0.381 . . . . 1.0 110.491 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1299 ' ' THR . . . . . . . . . . . . . 91.0 m -126.88 132.39 50.93 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.115 -0.493 . . . . 1.0 110.598 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 75.4 t -121.57 131.37 73.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 N-CA-C 109.532 -0.544 . . . . 1.0 109.532 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -129.79 143.74 50.96 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.005 0.431 . . . . 1.0 110.551 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 58.0 t -109.67 129.38 64.64 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 CA-C-N 116.044 -0.526 . . . . 1.0 109.629 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -105.11 133.89 49.14 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.001 0.429 . . . . 1.0 111.332 -179.284 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 87.7 t80 -147.92 110.37 4.66 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.842 -0.617 . . . . 1.0 110.354 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1305 ' ' LYS . . . . . 0.518 ' NZ ' ' OD2' ' A' 1280 ' ' ASP . 72.4 mmtt 54.58 31.19 14.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.313 -0.403 . . . . 1.0 110.647 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 78.93 6.36 88.71 Favored Glycine 0 CA--C 1.523 0.584 0 N-CA-C 111.068 -0.813 . . . . 1.0 111.068 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -112.11 117.06 31.57 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 109.975 -0.38 . . . . 1.0 109.975 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 42.3 ttm180 -73.37 128.24 34.92 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.732 -0.47 . . . . 1.0 109.732 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1309 ' ' ILE . . . . . 0.401 HD13 HG21 ' A' 1309 ' ' ILE . 24.3 pt -118.28 19.73 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-N 116.155 -0.475 . . . . 1.0 111.656 -178.308 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -161.54 147.3 13.57 Favored Glycine 0 CA--C 1.524 0.652 0 C-N-CA 120.499 -0.858 . . . . 1.0 111.418 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 44.9 t -171.11 126.77 0.68 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.719 0.295 . . . . 1.0 110.428 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -177.32 176.15 47.93 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 110.944 -0.862 . . . . 1.0 110.944 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 65.2 mttp -142.39 149.41 39.31 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.804 0.335 . . . . 1.0 110.413 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -164.96 168.5 39.18 Favored Glycine 0 CA--C 1.529 0.949 0 N-CA-C 110.635 -0.986 . . . . 1.0 110.635 179.566 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -53.92 -69.13 0.06 OUTLIER 'Trans proline' 0 N--CA 1.494 1.516 0 C-N-CA 121.602 1.535 . . . . 1.0 111.878 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1316 ' ' SER . . . . . . . . . . . . . 8.2 p -90.32 169.18 11.31 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.079 -0.509 . . . . 1.0 111.07 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 47.5 mm -63.9 -43.89 97.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.893 -0.594 . . . . 1.0 110.353 179.097 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 93.9 mm-40 -53.8 -40.79 66.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 1.0 110.967 -179.453 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -61.36 -42.39 98.62 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.392 -0.367 . . . . 1.0 110.621 -179.618 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -67.37 -37.68 83.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.25 -0.432 . . . . 1.0 110.991 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -64.84 -43.31 93.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.106 -0.497 . . . . 1.0 111.526 -179.036 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1322 ' ' MET . . . . . . . . . . . . . 78.2 mtm -64.52 -39.28 93.49 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.782 -0.367 . . . . 1.0 111.406 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -63.31 -48.36 79.76 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 111.037 -0.825 . . . . 1.0 111.037 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -69.92 -35.75 74.81 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.785 0.326 . . . . 1.0 111.083 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -59.71 -49.76 76.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.075 -0.511 . . . . 1.0 111.918 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1326 ' ' MET . . . . . . . . . . . . . 87.1 mmm -64.67 -42.39 95.41 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.723 -0.391 . . . . 1.0 111.67 -178.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -66.18 -33.62 76.17 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.329 -0.396 . . . . 1.0 111.312 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1328 ' ' ALA . . . . . . . . . . . . . . . -56.79 -20.83 24.47 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.169 -0.469 . . . . 1.0 112.194 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1329 ' ' LEU . . . . . 0.449 HD22 ' N ' ' A' 1329 ' ' LEU . 3.7 mm? -61.32 -42.66 99.05 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.585 -0.446 . . . . 1.0 111.16 -178.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1330 ' ' GLU . . . . . 0.521 ' N ' ' OE1' ' A' 1330 ' ' GLU . 50.4 mp0 -92.94 24.59 3.6 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 121.209 -0.196 . . . . 1.0 111.435 -179.161 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -128.66 10.32 6.06 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 111.702 0.26 . . . . 1.0 111.702 -178.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1332 ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -77.36 137.75 38.92 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 120.492 -0.483 . . . . 1.0 110.602 179.467 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 70.6 m-20 -107.32 -177.0 3.23 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.605 -0.725 . . . . 1.0 110.224 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 1334 ' ' PHE . . . . . 0.454 ' O ' ' O ' ' A' 1335 ' ' PRO . 19.3 m-85 -41.39 151.1 0.3 Allowed Pre-proline 0 CA--C 1.539 0.539 0 CA-C-N 116.215 -0.448 . . . . 1.0 110.438 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1335 ' ' PRO . . . . . 0.454 ' O ' ' O ' ' A' 1334 ' ' PHE . 87.9 Cg_exo -41.49 174.12 0.0 OUTLIER 'Trans proline' 0 N--CA 1.495 1.617 0 C-N-CA 122.433 2.088 . . . . 1.0 112.814 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1336 ' ' GLN . . . . . 0.592 ' H ' ' CD ' ' A' 1336 ' ' GLN . 2.2 mp0 -55.93 122.58 11.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.816 -0.629 . . . . 1.0 110.378 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 1337 ' ' MET . . . . . . . . . . . . . 98.8 mtp . . . . . 0 C--O 1.22 -0.497 0 CA-C-O 117.909 -1.043 . . . . 1.0 110.591 179.913 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A 1259 ' ' ASN . . . . . . . . . . . . . 42.9 p-10 . . . . . 0 N--CA 1.491 1.597 0 N-CA-C 109.785 -0.45 . . . . 1.0 109.785 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A 1260 ' ' ASP . . . . . . . . . . . . . 14.6 m-20 55.67 66.47 3.67 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 115.803 -0.635 . . . . 1.0 110.99 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1261 ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -55.17 -39.6 90.11 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 122.484 2.123 . . . . 1.0 111.551 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 52.7 pttt -162.36 59.42 0.23 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.019 -0.537 . . . . 1.0 110.659 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1263 ' ' SER . . . . . . . . . . . . . 47.8 m -61.45 -35.7 78.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.12 -0.491 . . . . 1.0 111.017 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -58.46 -52.52 65.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.312 -0.404 . . . . 1.0 111.433 -179.069 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1265 ' ' LEU . . . . . . . . . . . . . 8.8 mt -65.12 -40.03 93.92 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.902 -0.319 . . . . 1.0 110.784 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 20.2 mm100 -62.29 -43.36 99.01 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 121.033 -0.267 . . . . 1.0 110.89 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -65.63 -31.51 72.57 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.792 0.33 . . . . 1.0 110.814 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1268 ' ' CYS . . . . . 0.43 ' O ' ' OG1' ' A' 1271 ' ' THR . 85.3 m -62.8 -36.5 83.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.378 -0.373 . . . . 1.0 111.119 -179.419 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 93.1 m -60.48 -37.28 80.53 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.88 -0.328 . . . . 1.0 111.036 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1270 ' ' LEU . . . . . 0.489 ' N ' HD12 ' A' 1270 ' ' LEU . 10.9 mp -63.48 -40.42 97.05 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.802 -0.359 . . . . 1.0 110.618 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1271 ' ' THR . . . . . 0.43 ' OG1' ' O ' ' A' 1268 ' ' CYS . 69.2 p -64.67 -31.3 72.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.452 -0.34 . . . . 1.0 111.426 -179.051 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 87.8 mt -69.93 84.04 0.49 Allowed 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.303 -0.559 . . . . 1.0 110.577 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -106.1 136.66 45.39 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.248 -0.433 . . . . 1.0 110.228 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1274 ' ' THR . . . . . . . . . . . . . 7.1 m -127.24 155.65 43.14 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 109.85 -0.426 . . . . 1.0 109.85 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -66.65 90.59 0.17 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.976 0.417 . . . . 1.0 111.469 -178.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 54.62 40.57 70.99 Favored Glycine 0 CA--C 1.525 0.692 0 CA-C-N 115.832 -0.622 . . . . 1.0 112.434 178.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 42.4 mtpt -140.4 178.92 6.96 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.508 0.671 . . . . 1.0 111.885 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -117.74 105.95 46.88 Favored Pre-proline 0 CA--C 1.539 0.538 0 CA-C-N 114.753 -1.112 . . . . 1.0 109.271 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -81.14 163.66 19.95 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 C-N-CA 121.776 1.65 . . . . 1.0 112.203 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -79.87 125.82 30.21 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.387 -0.597 . . . . 1.0 109.387 179.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -115.91 140.45 26.24 Favored Pre-proline 0 CA--C 1.541 0.627 0 CA-C-N 115.973 -0.558 . . . . 1.0 110.591 -178.371 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo -49.18 137.35 30.04 Favored 'Trans proline' 0 N--CA 1.491 1.381 0 C-N-CA 120.973 1.115 . . . . 1.0 110.96 178.336 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 55.4 mt -117.7 140.43 49.67 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 110.01 -0.367 . . . . 1.0 110.01 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1284 ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -85.17 137.3 33.1 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.237 -0.438 . . . . 1.0 110.241 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 88.6 tttt -140.67 121.2 14.15 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.911 0.386 . . . . 1.0 110.463 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 34.3 m -89.31 128.66 35.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.485 . . . . 1.0 110.253 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 54.2 mt -81.12 -172.45 3.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.478 -0.328 . . . . 1.0 110.299 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -108.13 141.05 40.44 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.241 -0.436 . . . . 1.0 110.337 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1289 ' ' THR . . . . . . . . . . . . . 5.6 p -91.04 112.74 24.77 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.238 -0.437 . . . . 1.0 110.748 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 5.6 m -143.27 122.17 7.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.185 -0.461 . . . . 1.0 110.202 179.108 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.44 166.09 26.56 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.749 -0.94 . . . . 1.0 110.749 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.01 -40.8 67.59 Favored 'Trans proline' 0 C--N 1.306 -1.688 0 C-N-CA 122.382 2.055 . . . . 1.0 110.946 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1293 ' ' SER . . . . . . . . . . . . . 29.5 t -92.95 164.34 13.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.616 -0.72 . . . . 1.0 110.079 178.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 75.7 m-70 -60.36 -9.97 4.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.084 0.468 . . . . 1.0 110.027 179.21 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -60.17 141.98 55.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.902 -0.59 . . . . 1.0 110.845 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -113.84 141.91 46.74 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.085 -0.507 . . . . 1.0 110.911 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1297 ' ' THR . . . . . . . . . . . . . 89.1 m -124.0 126.01 45.56 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.965 -0.561 . . . . 1.0 109.816 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -103.38 122.57 45.13 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.978 0.418 . . . . 1.0 110.975 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1299 ' ' THR . . . . . . . . . . . . . 89.9 m -128.03 132.84 49.08 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.875 -0.602 . . . . 1.0 110.142 179.34 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 55.9 t -118.72 132.82 67.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 N-CA-C 109.671 -0.492 . . . . 1.0 109.671 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -128.82 147.15 50.78 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.089 -0.505 . . . . 1.0 110.7 -179.402 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 44.4 t -115.21 130.07 70.38 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 N-CA-C 109.513 -0.551 . . . . 1.0 109.513 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -108.93 140.96 41.7 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.092 0.473 . . . . 1.0 111.226 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 92.0 t80 -136.96 103.54 5.19 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.683 -0.69 . . . . 1.0 109.792 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1305 ' ' LYS . . . . . 0.601 ' HE3' HE22 ' A' 1336 ' ' GLN . 98.8 mttt 47.84 34.21 3.77 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.756 -0.378 . . . . 1.0 110.511 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 87.55 10.29 70.69 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 121.26 -0.495 . . . . 1.0 111.901 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -116.11 136.39 53.07 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 120.923 0.392 . . . . 1.0 110.622 179.514 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 72.6 ttp85 -81.44 135.4 35.63 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.95 -0.568 . . . . 1.0 110.885 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 40.3 pt -135.36 18.22 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-N 116.281 -0.418 . . . . 1.0 110.744 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -161.33 147.83 14.84 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 111.305 -0.718 . . . . 1.0 111.305 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 35.5 t -168.58 134.93 1.87 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.902 0.382 . . . . 1.0 110.625 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . 169.68 170.86 34.66 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 110.799 -0.92 . . . . 1.0 110.799 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -138.59 146.75 42.17 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.973 0.415 . . . . 1.0 110.934 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -162.34 172.54 38.47 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 110.356 -1.097 . . . . 1.0 110.356 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -68.01 -73.03 0.02 OUTLIER 'Trans proline' 0 C--N 1.306 -1.66 0 C-N-CA 122.33 2.02 . . . . 1.0 111.984 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1316 ' ' SER . . . . . 0.419 ' OG ' ' OE1' ' A' 1319 ' ' GLN . 82.5 p -82.48 161.21 22.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.46 . . . . 1.0 110.769 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 44.1 mm -65.02 -43.99 96.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.996 -0.547 . . . . 1.0 110.697 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -54.96 -45.05 74.9 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.388 -0.369 . . . . 1.0 110.338 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1319 ' ' GLN . . . . . 0.419 ' OE1' ' OG ' ' A' 1316 ' ' SER . 1.4 mp0 -64.62 -40.2 95.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.33 -0.396 . . . . 1.0 110.169 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -63.61 -40.06 95.95 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.117 -0.492 . . . . 1.0 111.075 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -67.2 -38.71 85.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.327 -0.397 . . . . 1.0 110.707 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1322 ' ' MET . . . . . . . . . . . . . 78.6 mtp -64.44 -40.56 95.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.469 . . . . 1.0 110.711 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -67.48 -48.43 57.32 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 110.661 -0.976 . . . . 1.0 110.661 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -67.56 -35.13 78.44 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.877 0.37 . . . . 1.0 110.683 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -60.9 -41.24 95.72 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.945 -0.57 . . . . 1.0 111.769 -178.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1326 ' ' MET . . . . . . . . . . . . . 62.6 ttp -63.28 -41.82 99.04 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.877 -0.329 . . . . 1.0 111.316 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -67.48 -29.53 68.99 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.248 -0.433 . . . . 1.0 110.926 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1328 ' ' ALA . . . . . . . . . . . . . . . -61.13 -27.88 68.71 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.125 0.417 . . . . 1.0 112.125 -178.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 3.2 mm? -62.25 -41.26 98.28 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.494 -0.482 . . . . 1.0 110.569 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -88.61 18.71 4.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.354 -0.385 . . . . 1.0 111.24 -179.139 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 99.5 mttt -135.41 40.11 2.84 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.518 0.562 . . . . 1.0 112.518 -178.219 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1332 ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -106.04 134.94 48.37 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.215 0.531 . . . . 1.0 110.595 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1333 ' ' ASN . . . . . 0.427 ' O ' ' C ' ' A' 1334 ' ' PHE . 52.0 m-20 -111.43 -175.48 2.71 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.35 -0.841 . . . . 1.0 109.92 179.277 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1334 ' ' PHE . . . . . 0.427 ' C ' ' O ' ' A' 1333 ' ' ASN . 52.3 m-85 -30.39 110.59 0.27 Allowed Pre-proline 0 CA--C 1.543 0.702 0 O-C-N 123.476 0.485 . . . . 1.0 111.524 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -52.35 145.99 33.97 Favored 'Trans proline' 0 N--CA 1.496 1.673 0 C-N-CA 121.661 1.574 . . . . 1.0 112.275 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1336 ' ' GLN . . . . . 0.601 HE22 ' HE3' ' A' 1305 ' ' LYS . 33.0 mm-40 -38.35 117.27 0.61 Allowed 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 115.894 -0.594 . . . . 1.0 111.205 -179.375 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 1337 ' ' MET . . . . . . . . . . . . . 65.9 mtt . . . . . 0 C--O 1.219 -0.517 0 CA-C-O 117.907 -1.044 . . . . 1.0 110.602 179.782 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A 1259 ' ' ASN . . . . . . . . . . . . . 43.4 t-20 . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.525 -0.546 . . . . 1.0 109.525 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A 1260 ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -138.72 79.08 29.5 Favored Pre-proline 0 N--CA 1.465 0.278 0 CA-C-N 116.068 -0.515 . . . . 1.0 109.963 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1261 ' ' PRO . . . . . 0.569 ' C ' ' H ' ' A' 1263 ' ' SER . 16.9 Cg_exo -65.22 154.1 75.13 Favored 'Trans proline' 0 C--N 1.308 -1.569 0 C-N-CA 122.668 2.246 . . . . 1.0 112.486 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 64.3 pttt -62.25 11.42 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.812 -0.631 . . . . 1.0 111.371 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1263 ' ' SER . . . . . 0.569 ' H ' ' C ' ' A' 1261 ' ' PRO . 45.7 m -60.45 -28.05 67.99 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.767 0.318 . . . . 1.0 110.638 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1264 ' ' GLN . . . . . 0.45 ' O ' ' SG ' ' A' 1268 ' ' CYS . 99.1 mm-40 -54.51 -44.17 72.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 1.0 110.636 -179.166 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1265 ' ' LEU . . . . . . . . . . . . . 20.4 mt -63.58 -41.48 98.37 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.505 -0.478 . . . . 1.0 110.474 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -63.47 -43.98 95.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.846 0.355 . . . . 1.0 110.492 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -66.58 -40.82 89.13 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.037 -0.529 . . . . 1.0 109.887 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1268 ' ' CYS . . . . . 0.45 ' SG ' ' O ' ' A' 1264 ' ' GLN . 92.9 m -65.14 -35.07 79.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.596 -0.729 . . . . 1.0 110.995 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 98.4 m -56.74 -35.54 68.72 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.992 -0.283 . . . . 1.0 111.096 -179.263 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 82.9 mt -62.92 -40.98 99.27 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.478 -0.328 . . . . 1.0 110.621 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1271 ' ' THR . . . . . . . . . . . . . 70.3 p -66.77 -33.14 74.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.517 -0.31 . . . . 1.0 110.843 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1272 ' ' LEU . . . . . 0.415 HD22 ' H ' ' A' 1336 ' ' GLN . 85.9 mt -68.19 85.95 0.26 Allowed 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.572 -0.451 . . . . 1.0 110.562 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 79.4 mtp85 -119.67 131.09 55.34 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.307 -0.406 . . . . 1.0 110.75 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1274 ' ' THR . . . . . . . . . . . . . 20.8 m -120.94 128.4 52.72 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 109.992 -0.373 . . . . 1.0 109.992 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 48.4 tp10 -98.07 128.77 44.79 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.255 -0.43 . . . . 1.0 110.468 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 97.19 -9.26 65.2 Favored Glycine 0 CA--C 1.524 0.647 0 N-CA-C 111.439 -0.664 . . . . 1.0 111.439 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 52.0 mtpt -137.43 -175.11 3.95 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.207 0.527 . . . . 1.0 111.145 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -95.79 108.22 38.94 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 115.11 -0.95 . . . . 1.0 108.713 178.545 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -50.67 129.22 26.31 Favored 'Trans proline' 0 N--CA 1.493 1.445 0 C-N-CA 121.154 1.236 . . . . 1.0 112.251 -178.832 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -98.65 125.33 43.91 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.696 -0.684 . . . . 1.0 109.858 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 11.9 mt -133.73 133.84 22.8 Favored Pre-proline 0 CA--C 1.538 0.494 0 N-CA-C 110.365 -0.235 . . . . 1.0 110.365 -179.334 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -77.68 120.55 5.19 Favored 'Trans proline' 0 N--CA 1.493 1.471 0 C-N-CA 121.56 1.507 . . . . 1.0 111.531 178.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1283 ' ' LEU . . . . . 0.419 HD12 ' N ' ' A' 1283 ' ' LEU . 9.4 mp -106.91 155.83 19.34 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.193 -0.458 . . . . 1.0 110.383 -179.537 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1284 ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -77.33 144.71 37.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.921 -0.581 . . . . 1.0 111.155 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 87.7 tttt -146.12 105.73 3.96 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.837 -0.619 . . . . 1.0 109.989 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 26.2 m -63.44 130.38 44.19 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.123 -0.49 . . . . 1.0 111.2 -179.346 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 65.7 mt -81.4 -175.1 5.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.047 -0.524 . . . . 1.0 110.406 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -108.76 146.73 33.1 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.161 -0.472 . . . . 1.0 110.292 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1289 ' ' THR . . . . . . . . . . . . . 17.4 p -94.57 114.21 26.15 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.1 -0.5 . . . . 1.0 111.212 -178.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1290 ' ' VAL . . . . . 0.527 ' O ' HG23 ' A' 1290 ' ' VAL . 30.4 m -138.92 121.56 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-N 116.292 -0.413 . . . . 1.0 110.358 178.773 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.8 157.83 26.91 Favored Glycine 0 CA--C 1.527 0.82 0 N-CA-C 110.19 -1.164 . . . . 1.0 110.19 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -60.26 -40.56 58.11 Favored 'Trans proline' 0 C--N 1.31 -1.487 0 C-N-CA 122.055 1.837 . . . . 1.0 110.975 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1293 ' ' SER . . . . . . . . . . . . . 11.9 t -93.19 164.79 13.11 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.633 -0.712 . . . . 1.0 110.314 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 62.1 m170 -58.36 -11.39 2.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.274 -0.421 . . . . 1.0 110.018 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -60.3 147.89 38.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.98 -0.554 . . . . 1.0 110.485 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 96.2 mtt-85 -126.89 143.74 51.19 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.164 0.507 . . . . 1.0 111.149 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1297 ' ' THR . . . . . . . . . . . . . 88.4 m -125.24 128.09 47.76 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.57 -0.741 . . . . 1.0 109.366 178.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 95.3 m-85 -99.66 119.32 37.91 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.777 -0.453 . . . . 1.0 109.777 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1299 ' ' THR . . . . . . . . . . . . . 41.1 m -127.24 130.17 49.13 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.939 -0.573 . . . . 1.0 110.427 -179.507 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 67.2 t -118.31 127.41 75.42 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 N-CA-C 109.189 -0.671 . . . . 1.0 109.189 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -130.83 143.39 50.7 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.351 -0.386 . . . . 1.0 110.894 -179.247 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 16.9 t -106.55 129.07 60.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 N-CA-C 109.142 -0.688 . . . . 1.0 109.142 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -112.59 144.33 42.26 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.238 0.542 . . . . 1.0 111.671 -178.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1304 ' ' PHE . . . . . 0.432 ' O ' ' N ' ' A' 1307 ' ' GLU . 75.2 t80 -126.69 108.0 10.69 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.388 -0.823 . . . . 1.0 109.234 179.324 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 38.5 mtpt 46.75 32.24 1.69 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.514 -0.474 . . . . 1.0 109.984 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 88.97 17.29 56.52 Favored Glycine 0 CA--C 1.529 0.956 0 N-CA-C 111.83 -0.508 . . . . 1.0 111.83 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1307 ' ' GLU . . . . . 0.432 ' N ' ' O ' ' A' 1304 ' ' PHE . 99.5 mt-10 -119.47 129.71 54.87 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.964 0.382 . . . . 1.0 110.777 179.494 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1308 ' ' ARG . . . . . 0.661 HH21 ' CB ' ' A' 1311 ' ' CYS . 77.7 ttt180 -66.53 129.25 39.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.772 -0.649 . . . . 1.0 110.97 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 3.4 pt -138.24 13.01 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 116.064 -0.517 . . . . 1.0 110.874 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -173.57 153.19 16.98 Favored Glycine 0 CA--C 1.524 0.623 0 C-N-CA 120.346 -0.93 . . . . 1.0 111.674 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1311 ' ' CYS . . . . . 0.661 ' CB ' HH21 ' A' 1308 ' ' ARG . 52.4 t -169.9 144.08 2.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.877 0.37 . . . . 1.0 110.789 179.743 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -170.63 156.35 26.61 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.879 -0.888 . . . . 1.0 110.879 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 99.3 mttt -139.07 142.02 38.18 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.929 0.395 . . . . 1.0 110.595 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -167.11 176.9 41.94 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 110.277 -1.129 . . . . 1.0 110.277 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 18.3 Cg_exo -61.53 -63.23 0.1 Allowed 'Trans proline' 0 C--N 1.311 -1.408 0 C-N-CA 121.487 1.458 . . . . 1.0 111.936 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1316 ' ' SER . . . . . . . . . . . . . 9.8 p -90.95 167.25 12.55 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.8 -0.636 . . . . 1.0 111.061 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 38.1 mm -67.79 -42.43 86.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.914 -0.584 . . . . 1.0 110.088 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -54.5 -43.52 71.9 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.961 -0.563 . . . . 1.0 111.204 -178.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -66.94 -40.05 87.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.999 0.428 . . . . 1.0 110.341 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -62.59 -38.92 92.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.046 -0.525 . . . . 1.0 110.367 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -67.35 -38.17 84.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.245 -0.434 . . . . 1.0 111.445 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1322 ' ' MET . . . . . . . . . . . . . 72.1 mmm -64.13 -40.15 95.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.868 0.366 . . . . 1.0 110.547 -179.026 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -66.41 -47.42 70.58 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 111.574 -0.61 . . . . 1.0 111.574 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -66.09 -38.87 89.35 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.912 -0.315 . . . . 1.0 111.301 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -59.15 -48.3 82.11 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.358 -0.383 . . . . 1.0 111.206 -179.046 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1326 ' ' MET . . . . . 0.456 ' O ' ' OE1' ' A' 1330 ' ' GLU . 98.0 mmm -62.59 -43.97 97.49 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.729 -0.388 . . . . 1.0 111.085 -179.556 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -68.48 -32.78 73.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.528 -0.306 . . . . 1.0 111.694 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1328 ' ' ALA . . . . . . . . . . . . . . . -62.34 -33.65 75.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.677 0.275 . . . . 1.0 111.641 -178.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 98.7 mt -58.75 -26.49 64.04 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.707 0.289 . . . . 1.0 111.095 -179.485 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1330 ' ' GLU . . . . . 0.529 ' N ' ' OE1' ' A' 1330 ' ' GLU . 56.1 mp0 -88.84 -2.08 58.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.357 -0.383 . . . . 1.0 111.544 -179.483 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 98.4 mttt -120.41 21.46 11.64 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 112.698 0.629 . . . . 1.0 112.698 -177.461 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1332 ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -104.38 131.03 52.18 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.092 0.472 . . . . 1.0 110.585 179.531 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -101.13 -176.28 3.11 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.553 -0.749 . . . . 1.0 109.95 178.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -37.05 154.62 0.09 OUTLIER Pre-proline 0 CA--C 1.538 0.496 0 CA-C-N 116.147 -0.479 . . . . 1.0 110.846 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -52.97 157.43 8.08 Favored 'Trans proline' 0 N--CA 1.493 1.481 0 C-N-CA 121.336 1.357 . . . . 1.0 111.483 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 1336 ' ' GLN . . . . . 0.415 ' H ' HD22 ' A' 1272 ' ' LEU . 99.4 mm-40 -37.17 109.9 0.11 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 120.941 0.4 . . . . 1.0 111.095 -179.494 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 1337 ' ' MET . . . . . . . . . . . . . 94.1 mmm . . . . . 0 C--O 1.219 -0.518 0 CA-C-O 117.847 -1.073 . . . . 1.0 110.659 179.785 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A 1259 ' ' ASN . . . . . . . . . . . . . 91.4 m-20 . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.301 -0.629 . . . . 1.0 109.301 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A 1260 ' ' ASP . . . . . 0.713 ' H ' ' CD ' ' A' 1261 ' ' PRO . 0.0 OUTLIER -154.66 -43.49 0.0 OUTLIER Pre-proline 0 CA--C 1.537 0.448 0 CA-C-N 116.416 -0.356 . . . . 1.0 111.319 -179.966 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A 1261 ' ' PRO . . . . . 0.713 ' CD ' ' H ' ' A' 1260 ' ' ASP . 45.7 Cg_exo -58.62 -31.55 94.87 Favored 'Trans proline' 0 N--CA 1.499 1.84 0 C-N-CA 122.33 2.02 . . . . 1.0 112.811 -179.108 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -94.42 8.25 42.69 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.497 -0.32 . . . . 1.0 111.371 -179.087 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1263 ' ' SER . . . . . . . . . . . . . 55.7 m -56.73 -45.23 82.08 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.569 -0.452 . . . . 1.0 110.532 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 28.1 mp0 -67.4 -40.91 85.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.993 0.425 . . . . 1.0 110.552 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1265 ' ' LEU . . . . . 0.474 ' N ' ' CD2' ' A' 1265 ' ' LEU . 2.2 mm? -62.96 -42.97 99.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.905 -0.589 . . . . 1.0 110.574 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -65.31 -44.35 88.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.316 -0.402 . . . . 1.0 111.292 -179.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -63.86 -39.27 93.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.454 -0.339 . . . . 1.0 111.267 -179.275 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1268 ' ' CYS . . . . . . . . . . . . . 97.4 m -63.94 -35.92 82.26 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.36 -0.382 . . . . 1.0 110.747 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 77.2 m -60.2 -36.23 77.19 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.121 -0.49 . . . . 1.0 111.341 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 90.2 mt -62.9 -41.04 99.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.447 -0.342 . . . . 1.0 111.086 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1271 ' ' THR . . . . . . . . . . . . . 40.4 p -64.83 -30.36 71.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.503 -0.317 . . . . 1.0 111.55 -179.42 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1272 ' ' LEU . . . . . 0.485 HD22 ' H ' ' A' 1336 ' ' GLN . 70.5 mt -78.71 96.6 5.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.87 0.367 . . . . 1.0 111.175 -179.052 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 46.8 mmm-85 -119.01 111.22 18.04 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.058 -0.519 . . . . 1.0 110.23 179.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1274 ' ' THR . . . . . . . . . . . . . 27.3 m -129.49 139.36 51.59 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 120.733 0.301 . . . . 1.0 110.458 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 78.8 tt0 -129.2 146.73 51.06 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.214 -0.448 . . . . 1.0 110.186 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 82.48 12.97 79.51 Favored Glycine 0 CA--C 1.524 0.651 0 N-CA-C 111.064 -0.814 . . . . 1.0 111.064 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 23.9 mtpp -136.55 -172.84 3.26 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.184 0.516 . . . . 1.0 110.919 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 87.7 mt-10 -96.37 108.57 42.74 Favored Pre-proline 0 CA--C 1.533 0.321 0 CA-C-N 115.259 -0.882 . . . . 1.0 109.046 179.082 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -50.21 133.12 35.34 Favored 'Trans proline' 0 N--CA 1.491 1.341 0 C-N-CA 121.173 1.249 . . . . 1.0 112.38 -179.224 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -139.68 124.18 18.18 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.512 -0.767 . . . . 1.0 109.28 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 7.0 mt -143.93 134.82 12.37 Favored Pre-proline 0 CA--C 1.537 0.461 0 CA-C-O 119.154 -0.45 . . . . 1.0 109.939 -178.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -52.24 131.71 40.89 Favored 'Trans proline' 0 N--CA 1.492 1.39 0 CA-C-N 120.322 1.151 . . . . 1.0 111.132 177.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 69.1 mt -130.13 140.65 50.76 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.918 0.389 . . . . 1.0 110.14 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1284 ' ' TYR . . . . . 0.412 ' CE2' HG22 ' A' 1302 ' ' VAL . 29.0 m-85 -82.32 141.8 32.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.877 -0.601 . . . . 1.0 111.785 -178.805 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -143.49 108.46 4.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.31 -0.859 . . . . 1.0 109.447 179.324 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 16.6 m -64.09 142.89 58.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.272 0.558 . . . . 1.0 110.779 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1287 ' ' LEU . . . . . 0.591 ' N ' ' CD2' ' A' 1287 ' ' LEU . 1.0 OUTLIER -80.92 -174.14 4.64 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.216 -0.902 . . . . 1.0 110.015 -179.352 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -108.86 130.59 55.42 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 109.695 -0.483 . . . . 1.0 109.695 179.297 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1289 ' ' THR . . . . . . . . . . . . . 64.9 p -87.46 116.97 25.93 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.927 0.394 . . . . 1.0 111.359 -179.23 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1290 ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' 1290 ' ' VAL . 24.1 m -149.99 122.14 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.183 0 CA-C-N 116.04 -0.527 . . . . 1.0 109.99 178.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.14 160.69 27.21 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.516 -1.034 . . . . 1.0 110.516 179.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -59.27 -43.36 41.78 Favored 'Trans proline' 0 C--N 1.308 -1.573 0 C-N-CA 122.214 1.943 . . . . 1.0 111.038 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1293 ' ' SER . . . . . . . . . . . . . 46.9 t -92.3 165.16 13.23 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.569 -0.741 . . . . 1.0 110.331 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 80.8 m80 -59.93 -6.73 1.4 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.334 -0.394 . . . . 1.0 110.389 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -66.7 148.46 51.88 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.081 -0.509 . . . . 1.0 110.612 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -129.9 143.73 50.95 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 116.236 -0.438 . . . . 1.0 110.628 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1297 ' ' THR . . . . . . . . . . . . . 84.8 m -123.54 128.7 50.13 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.933 -0.576 . . . . 1.0 109.526 179.315 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -102.03 118.98 38.05 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.184 0.516 . . . . 1.0 111.567 -178.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1299 ' ' THR . . . . . . . . . . . . . 91.9 m -127.71 130.13 48.32 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.557 -0.747 . . . . 1.0 109.815 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 53.3 t -117.31 129.94 73.01 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 N-CA-C 109.714 -0.476 . . . . 1.0 109.714 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -130.52 143.82 51.01 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.306 -0.407 . . . . 1.0 111.117 -179.322 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1302 ' ' VAL . . . . . 0.412 HG22 ' CE2' ' A' 1284 ' ' TYR . 24.9 t -107.37 126.86 63.56 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 CA-C-N 116.019 -0.537 . . . . 1.0 109.599 179.098 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -104.68 130.18 52.76 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.847 0.356 . . . . 1.0 110.539 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 61.8 t80 -142.56 109.03 5.32 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.172 -0.467 . . . . 1.0 110.371 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 68.1 mttm 52.17 27.71 4.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 1.0 110.894 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 80.14 12.22 83.5 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 111.378 -0.689 . . . . 1.0 111.378 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -109.92 120.15 41.56 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 110.023 -0.362 . . . . 1.0 110.023 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 61.6 ttp180 -75.98 126.04 30.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.341 -0.391 . . . . 1.0 110.354 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 31.5 pt -122.26 23.12 4.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-N 116.099 -0.5 . . . . 1.0 110.387 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -156.86 153.4 24.67 Favored Glycine 0 CA--C 1.524 0.639 0 N-CA-C 110.781 -0.928 . . . . 1.0 110.781 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 12.0 t -172.44 105.91 0.17 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.733 0.301 . . . . 1.0 110.557 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -173.48 167.85 40.62 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 111.108 -0.797 . . . . 1.0 111.108 179.891 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 69.0 mttm -139.61 144.08 37.55 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.811 0.338 . . . . 1.0 110.444 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -157.78 171.95 34.95 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.562 -1.015 . . . . 1.0 110.562 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.78 -76.83 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.66 0 C-N-CA 122.54 2.16 . . . . 1.0 111.759 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1316 ' ' SER . . . . . . . . . . . . . 16.2 p -76.28 162.0 28.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.015 0.436 . . . . 1.0 111.116 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 39.1 mm -63.83 -43.81 97.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.887 -0.597 . . . . 1.0 110.797 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -57.12 -40.27 76.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.305 -0.407 . . . . 1.0 110.877 -179.041 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 19.0 mm100 -62.85 -42.49 99.77 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.849 0.357 . . . . 1.0 110.66 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -67.08 -37.9 84.79 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.081 -0.508 . . . . 1.0 111.425 -179.535 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -66.12 -40.02 90.36 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.146 0.424 . . . . 1.0 112.146 -178.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1322 ' ' MET . . . . . . . . . . . . . 74.7 mtm -64.01 -41.35 97.49 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.495 -0.482 . . . . 1.0 111.161 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -64.29 -46.04 91.83 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 120.862 -0.685 . . . . 1.0 111.678 -179.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -66.23 -37.49 85.65 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.891 0.33 . . . . 1.0 111.891 -179.255 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -62.52 -41.74 99.05 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 111.893 0.331 . . . . 1.0 111.893 -178.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1326 ' ' MET . . . . . . . . . . . . . 74.1 mmm -62.92 -44.39 96.21 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.59 -0.444 . . . . 1.0 111.259 -179.578 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -68.25 -33.35 74.21 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.858 -0.337 . . . . 1.0 110.278 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1328 ' ' ALA . . . . . . . . . . . . . . . -57.45 -37.33 72.67 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.054 -0.521 . . . . 1.0 111.072 -179.328 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 76.5 mt -62.03 -36.52 81.84 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.78 0.324 . . . . 1.0 110.685 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -82.98 8.32 13.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.29 -0.414 . . . . 1.0 111.273 -179.513 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 96.5 mttt -135.81 40.51 2.74 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.395 0.517 . . . . 1.0 112.395 -177.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1332 ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -107.18 151.23 25.69 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.075 0.464 . . . . 1.0 110.181 179.053 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -123.77 -176.74 3.55 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.552 -0.749 . . . . 1.0 109.982 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -37.86 150.54 0.17 Allowed Pre-proline 0 CA--C 1.535 0.387 0 CA-C-N 116.257 -0.428 . . . . 1.0 110.831 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.93 156.77 64.3 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 122.478 2.118 . . . . 1.0 112.252 -179.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 1336 ' ' GLN . . . . . 0.485 ' H ' HD22 ' A' 1272 ' ' LEU . 99.2 mm-40 -39.22 117.82 0.73 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.927 -0.579 . . . . 1.0 110.926 -179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 1337 ' ' MET . . . . . . . . . . . . . 3.3 ttt . . . . . 0 C--O 1.22 -0.472 0 CA-C-O 117.959 -1.02 . . . . 1.0 110.477 -179.76 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A 1259 ' ' ASN . . . . . . . . . . . . . 23.8 t-20 . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.477 -0.564 . . . . 1.0 109.477 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A 1260 ' ' ASP . . . . . . . . . . . . . 5.6 t70 59.83 55.55 4.52 Favored Pre-proline 0 CA--C 1.533 0.292 0 CA-C-N 116.179 -0.464 . . . . 1.0 110.602 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1261 ' ' PRO . . . . . 0.43 ' C ' ' H ' ' A' 1263 ' ' SER . 91.9 Cg_endo -75.99 153.2 37.0 Favored 'Trans proline' 0 N--CA 1.496 1.627 0 C-N-CA 123.006 2.471 . . . . 1.0 113.037 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 55.7 mtmt 52.55 8.52 0.08 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.972 -0.558 . . . . 1.0 111.628 178.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1263 ' ' SER . . . . . 0.43 ' H ' ' C ' ' A' 1261 ' ' PRO . 45.5 m -58.82 -38.51 78.81 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.71 -0.396 . . . . 1.0 110.419 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -63.37 -47.45 82.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.955 -0.566 . . . . 1.0 111.386 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1265 ' ' LEU . . . . . 0.425 ' CD1' ' OH ' ' A' 1284 ' ' TYR . 91.7 mt -64.23 -42.59 96.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.526 -0.306 . . . . 1.0 111.099 -179.449 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -63.67 -42.8 98.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.327 -0.397 . . . . 1.0 110.908 -179.321 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -65.85 -39.68 90.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.813 0.34 . . . . 1.0 110.54 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1268 ' ' CYS . . . . . . . . . . . . . 95.4 m -62.82 -34.83 78.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.984 -0.553 . . . . 1.0 111.062 -179.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 77.5 m -54.83 -40.21 69.36 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.773 -0.371 . . . . 1.0 110.738 -179.306 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1270 ' ' LEU . . . . . 0.499 HD22 ' N ' ' A' 1270 ' ' LEU . 4.0 mm? -65.02 -39.96 94.15 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.079 -0.509 . . . . 1.0 111.241 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1271 ' ' THR . . . . . . . . . . . . . 80.4 p -63.88 -31.96 73.33 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.83 0.307 . . . . 1.0 111.83 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 71.8 mt -77.19 86.14 3.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.618 0.246 . . . . 1.0 111.056 -179.039 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -120.02 131.81 55.26 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 120.753 0.311 . . . . 1.0 111.07 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1274 ' ' THR . . . . . . . . . . . . . 9.3 m -128.54 139.68 52.18 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 109.176 -0.676 . . . . 1.0 109.176 178.659 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -107.85 133.01 52.83 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.208 0.528 . . . . 1.0 111.048 -179.439 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 80.85 5.17 90.24 Favored Glycine 0 CA--C 1.527 0.797 0 CA-C-N 115.705 -0.679 . . . . 1.0 112.474 178.495 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 43.3 mtpt -139.95 -174.24 3.86 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.614 0.721 . . . . 1.0 112.054 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -99.01 108.84 51.54 Favored Pre-proline 0 CA--C 1.538 0.491 0 CA-C-N 114.752 -1.113 . . . . 1.0 109.946 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -80.86 113.7 2.81 Favored 'Trans proline' 0 N--CA 1.496 1.668 0 C-N-CA 122.0 1.8 . . . . 1.0 112.798 -179.331 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -83.21 148.88 27.16 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.867 -0.606 . . . . 1.0 109.956 179.076 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 3.0 mt -140.85 132.41 13.89 Favored Pre-proline 0 CA--C 1.538 0.498 0 N-CA-C 109.303 -0.628 . . . . 1.0 109.303 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -55.2 139.08 80.62 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 CA-C-N 120.787 1.317 . . . . 1.0 110.983 178.405 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 97.0 mt -126.35 147.96 49.66 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.474 -0.33 . . . . 1.0 110.242 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1284 ' ' TYR . . . . . 0.425 ' OH ' ' CD1' ' A' 1265 ' ' LEU . 36.0 m-85 -78.0 142.79 38.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.094 -0.503 . . . . 1.0 111.132 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 65.0 tttm -145.23 106.64 4.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.472 -0.785 . . . . 1.0 109.49 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 41.5 m -69.41 133.93 48.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.062 -0.517 . . . . 1.0 111.267 -179.409 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 67.6 mt -81.23 -172.48 3.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.908 -0.587 . . . . 1.0 110.081 179.487 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 91.6 mm-40 -109.22 140.91 42.23 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.053 -0.521 . . . . 1.0 110.032 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1289 ' ' THR . . . . . . . . . . . . . 30.1 p -99.35 114.98 28.16 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.166 -0.47 . . . . 1.0 111.085 -179.104 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1290 ' ' VAL . . . . . 0.476 ' O ' HG23 ' A' 1290 ' ' VAL . 28.0 m -133.09 122.3 45.44 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 N-CA-C 109.927 -0.397 . . . . 1.0 109.927 178.455 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -143.62 167.51 26.61 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 111.056 -0.817 . . . . 1.0 111.056 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.47 -49.5 0.6 Allowed 'Trans proline' 0 C--N 1.308 -1.596 0 C-N-CA 122.688 2.259 . . . . 1.0 111.214 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1293 ' ' SER . . . . . . . . . . . . . 14.8 t -88.52 164.33 15.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.483 -0.781 . . . . 1.0 110.544 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 40.0 m80 -59.5 -11.35 4.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.315 -0.402 . . . . 1.0 110.416 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -67.14 143.28 56.71 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.544 -0.539 . . . . 1.0 109.544 179.044 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -127.73 149.01 50.42 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.141 0.496 . . . . 1.0 111.69 -178.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1297 ' ' THR . . . . . . . . . . . . . 88.8 m -121.72 122.0 38.56 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.461 -0.79 . . . . 1.0 109.064 178.182 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -94.34 126.11 39.39 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.189 0.518 . . . . 1.0 111.212 -179.423 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1299 ' ' THR . . . . . . . . . . . . . 91.1 m -127.24 130.63 49.98 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.765 -0.652 . . . . 1.0 110.17 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 55.4 t -120.84 130.39 74.67 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 N-CA-C 110.078 -0.341 . . . . 1.0 110.078 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -130.56 145.27 51.84 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.127 -0.488 . . . . 1.0 110.616 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 18.7 t -107.82 128.69 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 N-CA-C 109.432 -0.581 . . . . 1.0 109.432 179.135 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -106.96 137.65 44.62 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.469 -0.332 . . . . 1.0 110.989 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1304 ' ' PHE . . . . . 0.496 ' O ' ' N ' ' A' 1307 ' ' GLU . 50.6 t80 -139.34 119.33 13.45 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.334 -0.394 . . . . 1.0 110.168 179.372 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1305 ' ' LYS . . . . . 0.412 ' NZ ' ' OE1' ' A' 1336 ' ' GLN . 51.8 mttp 39.51 39.34 0.48 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.367 -0.379 . . . . 1.0 111.566 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 79.09 20.37 70.24 Favored Glycine 0 CA--C 1.528 0.852 0 C-N-CA 121.127 -0.559 . . . . 1.0 112.221 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1307 ' ' GLU . . . . . 0.496 ' N ' ' O ' ' A' 1304 ' ' PHE . 98.1 mt-10 -125.98 147.79 49.43 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.81 0.338 . . . . 1.0 110.309 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 57.1 ttp180 -91.59 126.15 36.58 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.039 -0.528 . . . . 1.0 110.106 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 45.0 pt -132.38 16.37 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-N 116.461 -0.336 . . . . 1.0 110.856 -179.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -157.47 151.63 22.89 Favored Glycine 0 CA--C 1.523 0.574 0 N-CA-C 111.084 -0.806 . . . . 1.0 111.084 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 30.3 p -173.6 138.5 0.67 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.725 0.298 . . . . 1.0 110.445 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . 179.27 162.01 27.75 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.979 -0.849 . . . . 1.0 110.979 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 59.8 mttp -141.93 142.66 33.03 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.735 0.302 . . . . 1.0 110.341 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -164.11 -178.87 37.97 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 110.701 -0.96 . . . . 1.0 110.701 179.207 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -63.65 -70.79 0.03 OUTLIER 'Trans proline' 0 C--N 1.311 -1.435 0 C-N-CA 121.689 1.593 . . . . 1.0 111.237 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1316 ' ' SER . . . . . . . . . . . . . 4.9 p -90.06 171.57 9.45 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.049 -0.523 . . . . 1.0 110.402 179.437 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 39.2 mm -64.19 -42.99 97.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.821 -0.627 . . . . 1.0 110.413 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -53.2 -42.0 65.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.776 -0.647 . . . . 1.0 111.833 -178.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 13.8 mp0 -67.3 -40.46 86.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.698 0.285 . . . . 1.0 110.459 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -65.69 -37.81 87.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.225 -0.443 . . . . 1.0 111.455 -179.234 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -65.92 -38.37 88.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.382 -0.372 . . . . 1.0 111.84 -178.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1322 ' ' MET . . . . . . . . . . . . . 61.6 mtt -62.3 -43.62 98.39 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.865 -0.334 . . . . 1.0 111.403 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -67.7 -40.2 90.16 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 111.634 -0.586 . . . . 1.0 111.634 -179.265 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -65.94 -38.78 89.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.678 0.275 . . . . 1.0 111.618 -179.65 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -65.82 -39.63 91.05 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.34 0.496 . . . . 1.0 112.34 -178.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1326 ' ' MET . . . . . . . . . . . . . 8.3 ttt -63.08 -38.83 92.76 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.76 -0.376 . . . . 1.0 110.824 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 56.7 m-20 -64.76 -31.93 73.38 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.203 -0.453 . . . . 1.0 110.645 -179.275 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1328 ' ' ALA . . . . . 0.545 ' O ' ' CD2' ' A' 1332 ' ' TYR . . . -57.31 -26.59 61.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.584 -0.28 . . . . 1.0 111.475 -179.137 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1329 ' ' LEU . . . . . 0.489 HD22 ' N ' ' A' 1329 ' ' LEU . 3.7 mm? -61.72 -41.95 98.3 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.84 -0.344 . . . . 1.0 110.946 -179.205 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -93.16 14.22 18.71 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 121.062 -0.255 . . . . 1.0 111.113 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 64.9 mttm -135.52 42.28 2.7 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 120.685 -0.406 . . . . 1.0 111.706 -178.312 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1332 ' ' TYR . . . . . 0.545 ' CD2' ' O ' ' A' 1328 ' ' ALA . 8.7 m-85 -108.7 145.5 34.94 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.303 0.573 . . . . 1.0 110.712 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -127.08 -176.07 3.61 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.209 -0.905 . . . . 1.0 109.404 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -41.26 141.04 1.13 Allowed Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 121.075 -0.25 . . . . 1.0 110.766 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -75.77 172.64 15.91 Favored 'Trans proline' 0 N--CA 1.498 1.739 0 C-N-CA 122.72 2.28 . . . . 1.0 112.245 179.735 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 1336 ' ' GLN . . . . . 0.412 ' OE1' ' NZ ' ' A' 1305 ' ' LYS . 14.0 mm100 -50.41 115.1 1.31 Allowed 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.782 -0.451 . . . . 1.0 109.782 179.385 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 1337 ' ' MET . . . . . . . . . . . . . 1.5 tpt . . . . . 0 C--O 1.22 -0.483 0 CA-C-O 118.026 -0.988 . . . . 1.0 110.167 -179.692 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A 1259 ' ' ASN . . . . . 0.431 ' O ' ' OD1' ' A' 1259 ' ' ASN . 27.0 p30 . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 109.631 -0.507 . . . . 1.0 109.631 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1260 ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -79.59 151.04 74.02 Favored Pre-proline 0 CA--C 1.534 0.356 0 CA-C-N 116.021 -0.536 . . . . 1.0 110.188 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1261 ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -66.55 -20.92 53.44 Favored 'Trans proline' 0 N--CA 1.497 1.688 0 C-N-CA 122.421 2.081 . . . . 1.0 111.784 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 98.8 mttt -63.47 -41.85 98.61 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.045 -0.525 . . . . 1.0 110.536 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1263 ' ' SER . . . . . . . . . . . . . 51.0 m -58.92 -36.88 75.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.134 -0.485 . . . . 1.0 110.616 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 14.3 mp0 -61.15 -42.68 98.99 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.819 -0.352 . . . . 1.0 110.265 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1265 ' ' LEU . . . . . 0.419 ' CD2' ' OH ' ' A' 1332 ' ' TYR . 83.4 mt -62.89 -41.52 99.44 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.742 -0.383 . . . . 1.0 110.031 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -63.82 -43.23 96.85 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.801 -0.36 . . . . 1.0 110.798 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -65.32 -39.52 92.56 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.854 0.359 . . . . 1.0 110.819 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1268 ' ' CYS . . . . . . . . . . . . . 88.5 m -64.5 -37.36 87.26 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.016 -0.538 . . . . 1.0 111.178 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 70.9 m -51.14 -41.38 60.06 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 120.55 -0.46 . . . . 1.0 110.865 -178.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1270 ' ' LEU . . . . . 0.523 HD22 ' N ' ' A' 1270 ' ' LEU . 3.6 mm? -64.39 -41.25 96.77 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.809 0.338 . . . . 1.0 110.801 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1271 ' ' THR . . . . . . . . . . . . . 48.0 p -66.56 -30.19 70.43 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.276 -0.42 . . . . 1.0 111.477 -179.039 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 92.5 mt -76.34 102.67 6.0 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.435 -0.506 . . . . 1.0 110.725 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 78.3 mtp85 -119.96 142.64 48.57 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.126 -0.488 . . . . 1.0 109.913 179.248 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1274 ' ' THR . . . . . . . . . . . . . 8.4 m -113.67 128.02 56.27 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 120.808 0.337 . . . . 1.0 110.188 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -129.54 112.06 13.37 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.408 -0.36 . . . . 1.0 110.861 -179.427 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 74.03 24.63 73.34 Favored Glycine 0 CA--C 1.527 0.823 0 CA-C-N 115.98 -0.555 . . . . 1.0 112.203 178.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 4.1 mtpp -136.58 -163.48 1.42 Allowed 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.335 0.588 . . . . 1.0 110.61 -179.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -95.11 108.24 37.19 Favored Pre-proline 0 CA--C 1.541 0.623 0 CA-C-N 114.865 -1.061 . . . . 1.0 109.277 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1279 ' ' PRO . . . . . 0.437 ' O ' ' OD1' ' A' 1280 ' ' ASP . 50.4 Cg_exo -49.79 122.84 9.63 Favored 'Trans proline' 0 N--CA 1.494 1.524 0 C-N-CA 121.506 1.471 . . . . 1.0 112.657 -179.326 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1280 ' ' ASP . . . . . 0.437 ' OD1' ' O ' ' A' 1279 ' ' PRO . 96.0 m-20 -143.82 124.26 13.94 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.656 -0.702 . . . . 1.0 109.392 178.74 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1281 ' ' ILE . . . . . 0.462 HD12 ' N ' ' A' 1281 ' ' ILE . 1.5 mp -137.77 135.57 19.09 Favored Pre-proline 0 CA--C 1.541 0.605 0 CA-C-N 116.242 -0.436 . . . . 1.0 110.424 -178.446 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -54.77 139.65 77.62 Favored 'Trans proline' 0 N--CA 1.496 1.64 0 CA-C-N 120.345 1.159 . . . . 1.0 111.213 178.193 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 87.4 mt -138.46 153.81 48.83 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.231 -0.44 . . . . 1.0 110.157 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1284 ' ' TYR . . . . . . . . . . . . . 81.9 m-85 -81.66 136.04 35.51 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.438 -0.346 . . . . 1.0 110.814 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 12.3 ttmm -138.83 126.02 21.42 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.204 -0.453 . . . . 1.0 109.869 178.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 92.3 m -99.15 125.7 44.76 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.967 0.413 . . . . 1.0 110.428 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 82.0 mt -77.54 -169.7 1.54 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.626 -0.716 . . . . 1.0 110.419 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -107.93 141.19 39.93 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.449 -0.341 . . . . 1.0 110.466 -179.671 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1289 ' ' THR . . . . . . . . . . . . . 16.9 p -87.84 114.47 24.49 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.082 -0.508 . . . . 1.0 110.858 -179.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 17.4 m -131.71 122.1 49.08 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-O 120.968 0.413 . . . . 1.0 110.38 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -144.52 157.71 27.3 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 110.569 -1.013 . . . . 1.0 110.569 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.74 -38.51 7.74 Favored 'Trans proline' 0 C--N 1.308 -1.563 0 C-N-CA 121.886 1.724 . . . . 1.0 110.691 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1293 ' ' SER . . . . . . . . . . . . . 26.7 t -92.74 165.22 13.05 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.503 -0.771 . . . . 1.0 110.211 179.287 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 78.9 m80 -57.61 -12.93 3.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.055 0.455 . . . . 1.0 109.839 179.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -63.37 145.16 56.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.805 -0.634 . . . . 1.0 110.554 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -128.41 140.13 52.0 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.03 0.443 . . . . 1.0 110.958 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1297 ' ' THR . . . . . . . . . . . . . 80.6 m -123.03 130.25 52.55 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.789 -0.642 . . . . 1.0 109.648 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 92.7 m-85 -100.07 131.46 46.01 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.148 0.499 . . . . 1.0 111.331 -178.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1299 ' ' THR . . . . . . . . . . . . . 90.1 m -127.42 131.91 50.18 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.61 -0.723 . . . . 1.0 110.017 179.505 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 55.8 t -118.42 129.48 74.66 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 109.963 -0.384 . . . . 1.0 109.963 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -129.69 144.42 51.28 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.09 -0.505 . . . . 1.0 110.589 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 24.3 t -111.61 128.24 68.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 N-CA-C 109.015 -0.735 . . . . 1.0 109.015 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -106.95 139.98 40.48 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.22 0.533 . . . . 1.0 111.622 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 75.5 t80 -140.99 106.64 5.1 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.429 -0.805 . . . . 1.0 110.118 179.359 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 55.6 mtpt 50.19 34.35 8.49 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.806 0.336 . . . . 1.0 110.736 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 83.81 18.71 62.95 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 121.343 -0.456 . . . . 1.0 111.994 179.48 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -121.68 144.07 48.98 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 109.887 -0.412 . . . . 1.0 109.887 179.369 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1308 ' ' ARG . . . . . 0.51 ' NE ' ' O ' ' A' 1310 ' ' GLY . 75.5 ttt180 -96.84 122.06 39.4 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.84 0.352 . . . . 1.0 110.144 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 35.4 pt -118.48 22.93 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-N 116.149 -0.478 . . . . 1.0 110.66 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1310 ' ' GLY . . . . . 0.51 ' O ' ' NE ' ' A' 1308 ' ' ARG . . . -159.38 153.99 25.05 Favored Glycine 0 CA--C 1.524 0.609 0 N-CA-C 110.659 -0.977 . . . . 1.0 110.659 179.833 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 8.7 p -174.17 121.42 0.29 Allowed 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.712 -0.395 . . . . 1.0 111.068 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -174.33 168.28 40.96 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.945 -0.862 . . . . 1.0 110.945 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 61.7 mttp -138.95 149.41 44.73 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.918 0.389 . . . . 1.0 110.607 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -169.06 167.74 40.69 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.438 -1.065 . . . . 1.0 110.438 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.67 -53.74 0.42 Allowed 'Trans proline' 0 C--N 1.307 -1.654 0 C-N-CA 122.449 2.099 . . . . 1.0 111.545 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1316 ' ' SER . . . . . . . . . . . . . 82.6 p -97.08 161.47 13.81 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.111 0.481 . . . . 1.0 110.98 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 40.3 mm -67.12 -42.6 88.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.655 -0.702 . . . . 1.0 111.317 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -53.06 -47.08 68.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.314 -0.403 . . . . 1.0 111.575 -178.656 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -67.29 -37.81 84.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.466 -0.333 . . . . 1.0 111.265 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -62.25 -37.5 85.69 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.251 -0.431 . . . . 1.0 111.202 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -67.15 -38.58 85.72 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.288 -0.415 . . . . 1.0 111.901 -179.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1322 ' ' MET . . . . . . . . . . . . . 57.2 mtt -61.59 -43.07 99.53 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.634 -0.426 . . . . 1.0 111.049 -179.231 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -63.92 -46.99 90.15 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.857 -0.897 . . . . 1.0 110.857 -179.761 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -65.14 -43.13 92.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.817 0.341 . . . . 1.0 110.561 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -68.29 -41.51 80.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.073 -0.512 . . . . 1.0 111.229 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1326 ' ' MET . . . . . . . . . . . . . 48.2 ttp -63.1 -43.68 97.81 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.011 0.434 . . . . 1.0 110.253 -179.499 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -68.9 -29.56 67.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.771 -0.65 . . . . 1.0 110.602 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1328 ' ' ALA . . . . . 0.53 ' O ' ' CD2' ' A' 1332 ' ' TYR . . . -59.63 -25.31 64.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.105 -0.498 . . . . 1.0 111.777 -178.679 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 96.2 mt -61.17 -41.52 96.93 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.943 -0.303 . . . . 1.0 110.967 -179.22 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -89.29 11.22 19.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.565 -0.289 . . . . 1.0 111.352 -178.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 64.1 mttm -129.52 40.69 3.56 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 112.084 0.402 . . . . 1.0 112.084 -178.317 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 1332 ' ' TYR . . . . . 0.53 ' CD2' ' O ' ' A' 1328 ' ' ALA . 16.0 m-85 -116.01 137.32 52.22 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 120.95 0.405 . . . . 1.0 110.298 179.202 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1333 ' ' ASN . . . . . 0.425 ' O ' ' C ' ' A' 1334 ' ' PHE . 97.1 m-20 -137.12 167.51 21.41 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.866 -0.607 . . . . 1.0 109.397 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1334 ' ' PHE . . . . . 0.425 ' C ' ' O ' ' A' 1333 ' ' ASN . 75.0 m-85 -30.68 94.06 0.06 OUTLIER Pre-proline 0 N--CA 1.47 0.532 0 O-C-N 123.518 0.511 . . . . 1.0 111.592 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1335 ' ' PRO . . . . . 0.436 ' O ' ' O ' ' A' 1336 ' ' GLN . 44.5 Cg_endo -91.4 -163.98 0.13 Allowed 'Trans proline' 0 N--CA 1.488 1.159 0 C-N-CA 122.942 2.428 . . . . 1.0 112.431 -179.086 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1336 ' ' GLN . . . . . 0.436 ' O ' ' O ' ' A' 1335 ' ' PRO . 13.5 mm100 -37.49 159.33 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.817 -0.629 . . . . 1.0 110.793 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 1337 ' ' MET . . . . . . . . . . . . . 27.4 ttt . . . . . 0 C--O 1.22 -0.476 0 CA-C-O 117.884 -1.055 . . . . 1.0 110.625 -179.665 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 34.6 tptt . . . . . 0 CA--C 1.526 0.048 0 CA-C-O 121.01 0.433 . . . . 1.0 110.423 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A 1263 ' ' SER . . . . . . . . . . . . . 68.3 m -57.5 -41.39 80.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.706 -0.679 . . . . 1.0 111.112 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 25.0 mp0 -58.97 -43.99 91.46 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.703 -0.399 . . . . 1.0 110.209 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1265 ' ' LEU . . . . . 0.482 ' CD2' ' OH ' ' A' 1332 ' ' TYR . 36.9 mt -63.61 -41.95 98.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 1.0 110.505 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -63.46 -44.73 93.63 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.346 -0.388 . . . . 1.0 110.718 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -64.02 -39.76 94.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.127 -0.488 . . . . 1.0 110.689 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1268 ' ' CYS . . . . . . . . . . . . . 98.3 m -64.92 -35.74 82.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.02 -0.536 . . . . 1.0 110.859 -179.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 79.1 m -60.44 -37.51 81.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.443 -0.344 . . . . 1.0 110.771 -179.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 89.1 mt -63.86 -39.31 93.9 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.214 -0.448 . . . . 1.0 111.106 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1271 ' ' THR . . . . . . . . . . . . . 68.7 p -65.06 -30.06 71.0 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.504 -0.316 . . . . 1.0 111.478 -179.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 77.6 mt -77.67 84.48 4.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.496 -0.32 . . . . 1.0 111.492 -178.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -119.74 130.09 54.81 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 110.139 -0.319 . . . . 1.0 110.139 178.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1274 ' ' THR . . . . . . . . . . . . . 21.4 m -129.65 133.4 47.09 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 120.773 0.32 . . . . 1.0 110.434 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 39.9 tp10 -111.54 142.72 43.47 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.356 -0.384 . . . . 1.0 110.202 179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 88.2 7.11 73.82 Favored Glycine 0 CA--C 1.527 0.815 0 N-CA-C 111.201 -0.76 . . . . 1.0 111.201 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 49.4 mtpt -138.63 -164.71 1.69 Allowed 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 110.239 -0.282 . . . . 1.0 110.239 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -92.43 151.05 41.01 Favored Pre-proline 0 CA--C 1.531 0.238 0 N-CA-C 109.87 -0.418 . . . . 1.0 109.87 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.09 76.13 1.29 Allowed 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.278 1.986 . . . . 1.0 112.22 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -90.83 121.5 32.75 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.815 -0.439 . . . . 1.0 109.815 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 13.1 mt -148.67 133.51 9.12 Favored Pre-proline 0 CA--C 1.535 0.398 0 N-CA-C 109.953 -0.388 . . . . 1.0 109.953 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.09 111.82 3.27 Favored 'Trans proline' 0 N--CA 1.495 1.597 0 C-N-CA 121.323 1.349 . . . . 1.0 111.514 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 89.5 mt -121.59 154.47 36.69 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.033 0.444 . . . . 1.0 110.867 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1284 ' ' TYR . . . . . 0.443 ' CE1' HD13 ' A' 1265 ' ' LEU . 4.2 m-85 -79.0 140.45 37.97 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.876 -0.602 . . . . 1.0 110.892 -179.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 79.7 tttt -145.97 115.13 7.04 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.515 -0.766 . . . . 1.0 109.575 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1286 ' ' THR . . . . . . . . . . . . . 27.2 m -63.83 131.88 49.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.843 0.354 . . . . 1.0 110.686 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 72.8 mt -87.74 -172.2 3.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.046 -0.525 . . . . 1.0 110.302 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -107.67 137.61 45.39 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.285 -0.416 . . . . 1.0 110.052 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1289 ' ' THR . . . . . . . . . . . . . 19.0 p -75.49 115.95 15.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.095 -0.502 . . . . 1.0 111.286 -178.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 16.6 m -136.11 122.15 30.31 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-N 116.051 -0.522 . . . . 1.0 109.836 178.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.86 159.25 27.33 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 110.947 -0.861 . . . . 1.0 110.947 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -63.67 -38.91 37.71 Favored 'Trans proline' 0 C--N 1.308 -1.593 0 C-N-CA 122.371 2.047 . . . . 1.0 111.132 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1293 ' ' SER . . . . . . . . . . . . . 14.3 t -91.86 165.13 13.4 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.728 -0.669 . . . . 1.0 110.55 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -61.38 -9.5 5.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.172 0.511 . . . . 1.0 109.75 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -62.91 144.98 56.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.481 -0.782 . . . . 1.0 111.11 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -103.01 130.35 50.08 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.097 -0.501 . . . . 1.0 110.685 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1297 ' ' THR . . . . . . . . . . . . . 92.3 m -125.92 127.65 46.33 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.923 -0.58 . . . . 1.0 110.093 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -101.44 127.2 48.21 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.001 0.429 . . . . 1.0 110.819 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1299 ' ' THR . . . . . . . . . . . . . 64.0 m -127.56 130.56 49.3 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.86 -0.609 . . . . 1.0 110.313 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 54.3 t -116.77 128.0 74.26 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 N-CA-C 109.139 -0.689 . . . . 1.0 109.139 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -130.49 142.35 50.49 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.13 0.49 . . . . 1.0 111.657 -179.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 2.7 t -112.28 127.43 69.49 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 N-CA-C 108.801 -0.814 . . . . 1.0 108.801 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -115.98 139.54 50.15 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.146 0.498 . . . . 1.0 111.449 -178.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 52.7 t80 -128.38 102.31 6.59 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.6 -0.727 . . . . 1.0 110.212 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 64.4 mttp 47.01 36.58 4.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.108 -0.497 . . . . 1.0 111.05 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 90.99 4.34 69.22 Favored Glycine 0 CA--C 1.527 0.815 0 N-CA-C 111.946 -0.462 . . . . 1.0 111.946 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -110.05 119.77 40.36 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 120.992 0.425 . . . . 1.0 110.356 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 62.0 ttp180 -76.08 136.43 39.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.931 -0.577 . . . . 1.0 110.634 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 42.1 pt -138.56 20.17 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-N 116.36 -0.382 . . . . 1.0 110.169 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -151.03 148.35 19.37 Favored Glycine 0 CA--C 1.523 0.587 0 N-CA-C 111.062 -0.815 . . . . 1.0 111.062 -179.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 25.0 p -171.35 116.37 0.42 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.804 0.335 . . . . 1.0 110.185 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -175.57 131.05 1.83 Allowed Glycine 0 CA--C 1.523 0.583 0 N-CA-C 111.018 -0.833 . . . . 1.0 111.018 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 68.8 mttm -109.95 146.0 35.97 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.778 0.323 . . . . 1.0 110.373 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -167.16 173.2 42.36 Favored Glycine 0 CA--C 1.524 0.634 0 N-CA-C 111.139 -0.785 . . . . 1.0 111.139 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -69.41 -75.08 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.677 0 C-N-CA 122.592 2.195 . . . . 1.0 111.918 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1316 ' ' SER . . . . . . . . . . . . . 95.5 p -79.0 158.2 27.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.926 0.393 . . . . 1.0 110.943 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 47.5 mm -63.88 -44.66 98.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.0 -0.545 . . . . 1.0 111.209 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -54.48 -46.34 73.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.536 -0.302 . . . . 1.0 111.125 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -62.89 -38.77 92.24 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.842 -0.343 . . . . 1.0 110.865 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -64.63 -38.49 91.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.425 -0.352 . . . . 1.0 111.08 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1321 ' ' GLU . . . . . 0.413 ' O ' ' HB2' ' A' 1325 ' ' ALA . 98.2 mt-10 -66.41 -36.46 82.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.299 -0.41 . . . . 1.0 111.404 -179.381 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1322 ' ' MET . . . . . . . . . . . . . 95.1 mmm -62.74 -42.65 99.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.323 -0.399 . . . . 1.0 111.469 -179.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -66.7 -49.68 53.69 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 120.711 -0.757 . . . . 1.0 111.528 -179.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -70.27 -36.22 74.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.792 0.329 . . . . 1.0 111.534 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1325 ' ' ALA . . . . . 0.413 ' HB2' ' O ' ' A' 1321 ' ' GLU . . . -56.01 -50.27 71.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.23 -0.441 . . . . 1.0 111.729 -178.547 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1326 ' ' MET . . . . . . . . . . . . . 66.4 mtt -65.57 -38.56 89.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.744 0.307 . . . . 1.0 111.484 -179.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -63.52 -36.98 85.58 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.348 -0.387 . . . . 1.0 111.549 -179.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1328 ' ' ALA . . . . . 0.524 ' O ' ' CD2' ' A' 1332 ' ' TYR . . . -58.69 -25.76 63.19 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.188 0.44 . . . . 1.0 112.188 -178.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 1.9 mm? -62.05 -41.45 98.14 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.679 -0.408 . . . . 1.0 111.148 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -93.62 4.57 53.75 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.142 0.423 . . . . 1.0 112.142 -178.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 67.5 mttm -117.7 20.65 13.35 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.269 0.47 . . . . 1.0 112.269 -178.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1332 ' ' TYR . . . . . 0.524 ' CD2' ' O ' ' A' 1328 ' ' ALA . 11.4 m-85 -83.54 137.76 33.71 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.122 0.487 . . . . 1.0 110.502 179.249 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -117.33 -175.98 2.91 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.521 -0.763 . . . . 1.0 110.17 179.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 53.8 m-85 -34.99 151.05 0.07 OUTLIER Pre-proline 0 CA--C 1.538 0.484 0 CA-C-N 115.977 -0.556 . . . . 1.0 111.115 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -69.61 -178.9 2.5 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 C-N-CA 122.419 2.079 . . . . 1.0 112.133 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 1336 ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 . . . . . 0 N--CA 1.462 0.175 0 CA-C-O 121.168 0.509 . . . . 1.0 111.205 -179.911 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 55.0 mtpt . . . . . 0 CA--C 1.53 0.18 0 CA-C-O 120.565 0.221 . . . . 1.0 111.156 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A 1263 ' ' SER . . . . . . . . . . . . . 50.4 m -61.0 -42.66 98.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.891 0.376 . . . . 1.0 110.701 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1264 ' ' GLN . . . . . 0.431 ' O ' ' SG ' ' A' 1268 ' ' CYS . 28.0 mm100 -65.08 -46.88 79.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.102 -0.499 . . . . 1.0 111.497 -179.451 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1265 ' ' LEU . . . . . . . . . . . . . 92.7 mt -64.66 -42.03 95.69 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.35 -0.386 . . . . 1.0 111.59 -179.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -64.9 -43.54 92.52 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.47 -0.492 . . . . 1.0 110.575 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 17.5 mm100 -68.19 -38.61 82.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.087 -0.506 . . . . 1.0 110.944 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1268 ' ' CYS . . . . . 0.431 ' SG ' ' O ' ' A' 1264 ' ' GLN . 93.5 m -64.9 -36.48 84.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.45 -0.341 . . . . 1.0 111.047 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 84.0 m -56.5 -36.69 69.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.753 0.311 . . . . 1.0 110.839 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 97.2 mt -63.25 -40.87 98.64 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.329 -0.396 . . . . 1.0 111.042 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1271 ' ' THR . . . . . 0.409 ' OG1' ' O ' ' A' 1268 ' ' CYS . 68.3 p -67.76 -26.31 66.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.195 -0.457 . . . . 1.0 111.369 -179.345 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 82.2 mt -85.68 86.65 7.35 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.823 0.344 . . . . 1.0 111.382 -178.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -119.19 117.98 30.09 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.071 -0.513 . . . . 1.0 110.112 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1274 ' ' THR . . . . . 0.427 ' OG1' ' OE1' ' A' 1336 ' ' GLN . 6.8 m -129.04 131.24 47.32 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 120.844 0.355 . . . . 1.0 110.268 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -113.03 134.97 54.28 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.207 -0.451 . . . . 1.0 110.304 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 89.67 7.11 69.32 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 111.38 -0.688 . . . . 1.0 111.38 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 50.6 mtpt -138.41 -168.75 2.44 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.79 0.329 . . . . 1.0 110.613 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -93.38 136.02 24.77 Favored Pre-proline 0 CA--C 1.536 0.409 0 CA-C-N 116.11 -0.495 . . . . 1.0 110.104 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -76.49 87.74 1.42 Allowed 'Trans proline' 0 N--CA 1.493 1.461 0 C-N-CA 121.869 1.713 . . . . 1.0 112.353 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1280 ' ' ASP . . . . . 0.48 ' OD2' ' NZ ' ' A' 1305 ' ' LYS . 78.3 m-20 -86.49 124.39 32.76 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.726 -0.472 . . . . 1.0 109.726 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1281 ' ' ILE . . . . . 0.426 HD13 HG21 ' A' 1281 ' ' ILE . 2.5 mt -148.02 124.08 5.34 Favored Pre-proline 0 CA--C 1.54 0.579 0 N-CA-C 109.972 -0.381 . . . . 1.0 109.972 -179.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 45.0 Cg_exo -51.79 131.44 37.97 Favored 'Trans proline' 0 N--CA 1.494 1.501 0 CA-C-N 120.246 1.123 . . . . 1.0 111.828 179.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 55.6 mt -134.74 152.49 51.8 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.028 -0.533 . . . . 1.0 109.871 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1284 ' ' TYR . . . . . 0.465 ' CD1' ' OE1' ' A' 1321 ' ' GLU . 84.6 m-85 -78.46 137.8 38.14 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.043 0.449 . . . . 1.0 111.152 -179.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 85.7 tttt -139.01 104.81 5.13 Favored 'General case' 0 N--CA 1.462 0.175 0 N-CA-C 108.918 -0.771 . . . . 1.0 108.918 178.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1286 ' ' THR . . . . . . . . . . . . . 24.0 m -63.17 134.93 56.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.406 0.622 . . . . 1.0 112.174 -178.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 70.3 mt -87.0 -169.22 2.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.179 -0.919 . . . . 1.0 109.998 179.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -106.44 136.88 45.43 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 109.593 -0.521 . . . . 1.0 109.593 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1289 ' ' THR . . . . . . . . . . . . . 3.5 p -88.87 115.09 26.16 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.156 -0.475 . . . . 1.0 111.452 -178.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 7.1 m -133.55 123.56 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 121.034 0.445 . . . . 1.0 110.153 178.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.29 166.42 26.41 Favored Glycine 0 CA--C 1.524 0.644 0 N-CA-C 110.674 -0.97 . . . . 1.0 110.674 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -67.9 -42.89 5.73 Favored 'Trans proline' 0 C--N 1.306 -1.667 0 C-N-CA 122.467 2.112 . . . . 1.0 111.125 179.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1293 ' ' SER . . . . . . . . . . . . . 31.4 t -90.3 165.51 13.85 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.621 -0.718 . . . . 1.0 110.484 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -58.11 -14.49 6.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.281 -0.418 . . . . 1.0 110.207 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -65.92 142.0 58.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.922 -0.581 . . . . 1.0 110.72 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -110.53 145.19 38.19 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.211 -0.45 . . . . 1.0 110.837 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1297 ' ' THR . . . . . . . . . . . . . 94.9 m -116.25 124.31 49.88 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.264 -0.643 . . . . 1.0 109.264 178.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -96.37 119.83 35.58 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.057 0.456 . . . . 1.0 110.786 -179.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1299 ' ' THR . . . . . . . . . . . . . 88.8 m -127.35 127.97 45.11 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.777 -0.647 . . . . 1.0 110.321 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1300 ' ' VAL . . . . . 0.548 HG11 ' OE2' ' A' 1321 ' ' GLU . 25.3 t -118.26 128.43 75.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 N-CA-C 109.58 -0.526 . . . . 1.0 109.58 179.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -130.69 148.7 52.51 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.3 -0.409 . . . . 1.0 110.228 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 3.0 t -105.91 125.95 61.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 N-CA-C 109.54 -0.541 . . . . 1.0 109.54 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -107.3 129.0 54.94 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.904 0.383 . . . . 1.0 110.878 -179.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 88.7 t80 -139.08 119.73 14.1 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 115.886 -0.597 . . . . 1.0 109.698 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1305 ' ' LYS . . . . . 0.48 ' NZ ' ' OD2' ' A' 1280 ' ' ASP . 72.7 mmtt 49.25 32.51 4.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.388 -0.369 . . . . 1.0 110.115 -179.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 78.35 21.48 69.89 Favored Glycine 0 CA--C 1.526 0.74 0 C-N-CA 121.076 -0.583 . . . . 1.0 111.816 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -121.08 130.86 53.94 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 116.987 0.393 . . . . 1.0 110.865 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 44.5 ttm180 -87.44 90.92 8.55 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.241 -0.651 . . . . 1.0 109.241 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 34.7 pt -81.35 -17.29 12.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 112.715 0.635 . . . . 1.0 112.715 -178.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -147.51 156.8 27.14 Favored Glycine 0 CA--C 1.525 0.669 0 C-N-CA 120.389 -0.91 . . . . 1.0 112.089 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 2.6 p -177.0 144.5 0.44 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.395 -0.403 . . . . 1.0 109.99 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -165.57 158.86 31.9 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 111.093 -0.803 . . . . 1.0 111.093 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 68.2 mttm -129.02 141.2 51.32 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.678 0.275 . . . . 1.0 110.269 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -164.33 -179.76 38.68 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.812 -0.915 . . . . 1.0 110.812 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -58.93 -59.82 0.42 Allowed 'Trans proline' 0 N--CA 1.494 1.521 0 C-N-CA 122.132 1.888 . . . . 1.0 112.017 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1316 ' ' SER . . . . . 0.438 ' OG ' ' OE1' ' A' 1319 ' ' GLN . 6.5 p -103.33 168.97 8.82 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.114 -0.494 . . . . 1.0 110.658 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 43.4 mt -67.05 -41.54 87.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.874 -0.603 . . . . 1.0 110.955 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -51.57 -41.41 61.12 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.463 -0.335 . . . . 1.0 111.215 -178.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1319 ' ' GLN . . . . . 0.438 ' OE1' ' OG ' ' A' 1316 ' ' SER . 7.3 mp0 -64.54 -39.77 94.36 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.753 -0.379 . . . . 1.0 110.052 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -65.88 -37.4 86.04 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.169 -0.469 . . . . 1.0 110.99 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1321 ' ' GLU . . . . . 0.548 ' OE2' HG11 ' A' 1300 ' ' VAL . 80.5 mm-40 -61.08 -50.22 74.16 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.452 -0.34 . . . . 1.0 110.862 -179.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1322 ' ' MET . . . . . . . . . . . . . 63.7 mtm -66.51 -38.95 88.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.137 -0.483 . . . . 1.0 111.553 -179.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -62.42 -48.28 83.29 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.891 -0.884 . . . . 1.0 110.891 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -66.12 -35.33 80.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.926 0.393 . . . . 1.0 110.601 179.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -57.69 -48.64 78.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.903 -0.589 . . . . 1.0 112.031 -179.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1326 ' ' MET . . . . . . . . . . . . . 93.8 mmm -63.67 -40.57 97.17 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.809 -0.356 . . . . 1.0 111.598 -179.014 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -67.7 -28.79 67.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.731 0.3 . . . . 1.0 111.173 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1328 ' ' ALA . . . . . . . . . . . . . . . -62.04 -35.45 78.63 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.414 0.524 . . . . 1.0 112.414 -178.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.93 -40.47 93.35 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 120.923 -0.311 . . . . 1.0 111.329 -178.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -75.09 15.07 0.45 Allowed 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.258 0.466 . . . . 1.0 112.258 -178.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 97.0 mttt -146.24 45.39 1.24 Allowed 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 113.061 0.763 . . . . 1.0 113.061 -178.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1332 ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -101.96 153.32 19.99 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.145 0.497 . . . . 1.0 110.342 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 9.1 m120 -127.74 -177.47 4.12 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.508 -0.769 . . . . 1.0 110.629 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 1334 ' ' PHE . . . . . 0.477 ' O ' ' O ' ' A' 1335 ' ' PRO . 61.7 m-85 -42.48 153.98 0.29 Allowed Pre-proline 0 CA--C 1.534 0.355 0 CA-C-N 115.815 -0.63 . . . . 1.0 110.662 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1335 ' ' PRO . . . . . 0.477 ' O ' ' O ' ' A' 1334 ' ' PHE . 77.3 Cg_exo -39.73 174.77 0.0 OUTLIER 'Trans proline' 0 N--CA 1.496 1.66 0 C-N-CA 122.826 2.351 . . . . 1.0 113.56 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 1336 ' ' GLN . . . . . 0.427 ' OE1' ' OG1' ' A' 1274 ' ' THR . 11.2 mt-30 . . . . . 0 N--CA 1.462 0.174 0 CA-C-N 115.382 -0.826 . . . . 1.0 110.99 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 87.7 mttt . . . . . 0 N--CA 1.463 0.185 0 CA-C-O 120.975 0.417 . . . . 1.0 110.508 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A 1263 ' ' SER . . . . . . . . . . . . . 35.9 m -59.16 -31.23 68.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.697 -0.683 . . . . 1.0 111.681 -179.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -56.75 -53.01 62.67 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.705 -0.398 . . . . 1.0 111.49 -178.376 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1265 ' ' LEU . . . . . 0.489 ' O ' ' SG ' ' A' 1269 ' ' CYS . 15.9 mt -67.87 -39.29 83.75 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.671 -0.411 . . . . 1.0 111.037 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -57.72 -43.9 85.61 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.543 -0.299 . . . . 1.0 111.175 -179.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -64.06 -42.48 97.0 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.502 -0.479 . . . . 1.0 110.522 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1268 ' ' CYS . . . . . . . . . . . . . 91.5 m -70.7 -36.59 73.33 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.176 -0.466 . . . . 1.0 110.936 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1269 ' ' CYS . . . . . 0.489 ' SG ' ' O ' ' A' 1265 ' ' LEU . 87.9 m -62.43 -35.23 78.62 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.092 -0.503 . . . . 1.0 112.018 -178.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 81.5 mt -61.96 -39.43 92.11 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.889 -0.324 . . . . 1.0 110.738 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1271 ' ' THR . . . . . . . . . . . . . 58.0 p -65.36 -29.19 69.89 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.969 -0.292 . . . . 1.0 111.15 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 87.2 mt -74.66 86.88 2.15 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.798 -0.361 . . . . 1.0 110.59 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 100.0 mtt180 -118.41 116.04 25.89 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.269 -0.423 . . . . 1.0 110.131 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1274 ' ' THR . . . . . . . . . . . . . 3.0 m -124.28 124.64 42.85 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.875 0.369 . . . . 1.0 110.162 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -112.71 138.18 49.91 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.024 -0.535 . . . . 1.0 110.194 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 90.38 0.62 76.23 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.677 -0.969 . . . . 1.0 110.677 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 21.5 mtpp -135.31 -167.5 2.02 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.11 0.481 . . . . 1.0 110.589 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -94.28 130.17 34.83 Favored Pre-proline 0 CA--C 1.536 0.423 0 CA-C-N 115.713 -0.676 . . . . 1.0 109.606 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -78.15 110.24 2.84 Favored 'Trans proline' 0 N--CA 1.493 1.466 0 C-N-CA 121.798 1.666 . . . . 1.0 112.683 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -104.24 129.73 52.04 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.887 -0.597 . . . . 1.0 109.584 178.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1281 ' ' ILE . . . . . 0.409 HG21 HD13 ' A' 1281 ' ' ILE . 4.8 mt -147.31 121.95 5.14 Favored Pre-proline 0 CA--C 1.54 0.571 0 CA-C-O 119.303 -0.38 . . . . 1.0 110.308 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -56.27 141.89 88.13 Favored 'Trans proline' 0 N--CA 1.494 1.532 0 CA-C-N 120.337 1.156 . . . . 1.0 111.129 178.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 89.9 mt -139.12 160.67 39.24 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.724 0.297 . . . . 1.0 110.393 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1284 ' ' TYR . . . . . 0.531 ' CD1' ' OE1' ' A' 1321 ' ' GLU . 62.8 m-85 -78.52 139.73 38.62 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.123 0.487 . . . . 1.0 111.46 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -151.34 107.56 3.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.588 -0.733 . . . . 1.0 109.998 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1286 ' ' THR . . . . . . . . . . . . . 18.5 m -74.78 140.59 44.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.11 0.481 . . . . 1.0 111.063 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 73.3 mt -81.73 -169.93 2.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.637 -0.711 . . . . 1.0 110.672 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -107.08 136.4 47.0 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.9 -0.591 . . . . 1.0 109.561 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1289 ' ' THR . . . . . . . . . . . . . 57.3 p -83.27 115.05 21.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.982 0.42 . . . . 1.0 111.701 -178.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 9.4 m -143.9 122.19 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 115.682 -0.69 . . . . 1.0 109.449 178.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.46 172.37 24.33 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 111.113 -0.795 . . . . 1.0 111.113 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -72.14 -46.49 0.52 Allowed 'Trans proline' 0 C--N 1.307 -1.646 0 C-N-CA 122.494 2.129 . . . . 1.0 111.143 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1293 ' ' SER . . . . . . . . . . . . . 11.3 t -89.85 165.34 14.18 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.656 -0.702 . . . . 1.0 110.046 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 28.2 m170 -59.73 -18.96 46.9 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.621 -0.511 . . . . 1.0 109.621 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -59.76 144.15 49.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.812 -0.631 . . . . 1.0 109.963 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 85.2 mtm-85 -117.54 143.51 46.01 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.014 0.435 . . . . 1.0 111.038 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1297 ' ' THR . . . . . . . . . . . . . 91.8 m -120.17 127.28 52.33 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.734 -0.666 . . . . 1.0 109.808 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -99.82 116.41 31.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.026 0.441 . . . . 1.0 110.721 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1299 ' ' THR . . . . . . . . . . . . . 91.8 m -127.11 130.31 49.6 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.743 -0.662 . . . . 1.0 110.092 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 83.2 t -111.44 129.86 66.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 N-CA-C 109.734 -0.469 . . . . 1.0 109.734 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -129.25 140.91 51.28 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.077 0.465 . . . . 1.0 110.93 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 43.7 t -113.25 128.36 70.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 N-CA-C 108.65 -0.87 . . . . 1.0 108.65 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -113.66 141.37 47.31 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.029 0.443 . . . . 1.0 110.934 -178.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 79.1 t80 -149.43 109.08 4.02 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.593 -0.731 . . . . 1.0 110.159 -179.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 49.87 30.07 3.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.281 -0.418 . . . . 1.0 110.808 179.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 86.04 1.97 86.33 Favored Glycine 0 CA--C 1.525 0.69 0 C-N-CA 121.317 -0.468 . . . . 1.0 112.06 178.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -106.5 115.95 31.09 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 110.132 -0.322 . . . . 1.0 110.132 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -72.52 130.16 40.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.466 . . . . 1.0 110.302 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 30.5 pt -122.46 23.23 4.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-N 116.484 -0.325 . . . . 1.0 110.906 -179.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -155.96 153.28 24.62 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 111.354 -0.699 . . . . 1.0 111.354 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1311 ' ' CYS . . . . . 0.412 ' SG ' ' OD2' ' A' 1327 ' ' ASP . 31.3 p -167.65 164.23 14.51 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.21 -0.293 . . . . 1.0 110.21 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . 121.92 157.64 10.07 Favored Glycine 0 N--CA 1.468 0.801 0 N-CA-C 110.939 -0.864 . . . . 1.0 110.939 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 68.6 mttm -129.61 151.3 50.37 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.93 0.395 . . . . 1.0 110.758 -179.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -159.49 163.72 33.64 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 110.434 -1.067 . . . . 1.0 110.434 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -64.58 -67.13 0.04 OUTLIER 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 122.408 2.072 . . . . 1.0 111.697 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1316 ' ' SER . . . . . . . . . . . . . 13.6 p -83.89 164.27 19.53 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.361 -0.381 . . . . 1.0 110.328 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 36.7 mm -65.29 -44.31 94.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.12 -0.491 . . . . 1.0 110.836 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -55.36 -42.99 74.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.085 -0.507 . . . . 1.0 111.712 -178.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -60.01 -41.75 92.83 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.593 -0.443 . . . . 1.0 110.708 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -68.55 -37.76 80.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.307 -0.406 . . . . 1.0 110.998 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1321 ' ' GLU . . . . . 0.531 ' OE1' ' CD1' ' A' 1284 ' ' TYR . 64.8 mm-40 -61.58 -45.35 94.51 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.305 -0.407 . . . . 1.0 111.821 -179.11 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1322 ' ' MET . . . . . 0.579 ' SD ' ' N ' ' A' 1322 ' ' MET . 0.1 OUTLIER -64.2 -41.08 97.23 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.805 -0.358 . . . . 1.0 111.366 -179.259 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -64.97 -43.39 95.98 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 120.799 -0.715 . . . . 1.0 111.847 -179.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -66.35 -38.21 87.08 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.737 0.273 . . . . 1.0 111.737 -179.125 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -61.03 -42.69 98.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.477 -0.328 . . . . 1.0 111.862 -178.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1326 ' ' MET . . . . . . . . . . . . . 2.0 tpt -62.74 -41.83 99.37 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.471 -0.492 . . . . 1.0 110.064 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1327 ' ' ASP . . . . . 0.412 ' OD2' ' SG ' ' A' 1311 ' ' CYS . 64.7 m-20 -65.04 -34.7 79.05 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.965 -0.561 . . . . 1.0 110.544 -179.383 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1328 ' ' ALA . . . . . 0.499 ' O ' ' CD2' ' A' 1332 ' ' TYR . . . -58.83 -23.75 61.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.307 -0.406 . . . . 1.0 111.45 -179.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 92.6 mt -62.48 -42.48 99.52 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.727 -0.389 . . . . 1.0 110.838 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -95.11 23.98 5.27 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.357 -0.383 . . . . 1.0 111.955 -178.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 97.3 mttt -137.82 42.55 2.29 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 120.697 -0.401 . . . . 1.0 111.072 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1332 ' ' TYR . . . . . 0.499 ' CD2' ' O ' ' A' 1328 ' ' ALA . 14.0 m-85 -115.15 145.98 41.83 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.285 0.564 . . . . 1.0 110.977 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -117.76 -176.71 3.09 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.368 -0.833 . . . . 1.0 108.819 178.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -41.8 148.7 0.44 Allowed Pre-proline 0 CA--C 1.536 0.405 0 C-N-CA 120.711 -0.396 . . . . 1.0 110.475 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -68.46 154.63 71.4 Favored 'Trans proline' 0 N--CA 1.497 1.72 0 C-N-CA 122.292 1.995 . . . . 1.0 111.763 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 1336 ' ' GLN . . . . . . . . . . . . . 15.3 mm100 . . . . . 0 N--CA 1.462 0.133 0 CA-C-O 120.772 0.32 . . . . 1.0 110.26 -179.615 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 56.8 mttp . . . . . 0 N--CA 1.467 0.397 0 N-CA-C 111.731 0.271 . . . . 1.0 111.731 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A 1263 ' ' SER . . . . . . . . . . . . . 64.8 m -52.09 -39.86 60.39 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.532 -0.467 . . . . 1.0 110.807 -179.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -63.26 -47.89 80.49 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.878 0.37 . . . . 1.0 110.495 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1265 ' ' LEU . . . . . 0.41 HD11 ' CE1' ' A' 1284 ' ' TYR . 88.2 mt -65.71 -39.76 91.54 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.114 -0.494 . . . . 1.0 111.413 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -54.1 -40.27 67.14 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 121.043 -0.263 . . . . 1.0 111.007 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -62.95 -42.41 99.81 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.728 -0.389 . . . . 1.0 110.425 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1268 ' ' CYS . . . . . 0.407 ' O ' ' OG1' ' A' 1271 ' ' THR . 90.4 m -66.28 -37.2 84.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.296 -0.411 . . . . 1.0 110.747 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 99.8 m -59.18 -35.38 73.48 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.261 -0.427 . . . . 1.0 110.964 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 86.2 mt -62.61 -40.89 98.38 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.335 -0.393 . . . . 1.0 110.991 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1271 ' ' THR . . . . . 0.407 ' OG1' ' O ' ' A' 1268 ' ' CYS . 74.3 p -65.68 -31.68 72.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.339 -0.391 . . . . 1.0 111.562 -179.131 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 72.1 mt -74.28 83.69 1.89 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.599 -0.44 . . . . 1.0 110.578 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 7.3 mmp_? -119.51 110.76 17.27 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.244 -0.435 . . . . 1.0 110.842 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1274 ' ' THR . . . . . . . . . . . . . 21.6 m -129.29 129.89 45.46 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 109.94 -0.393 . . . . 1.0 109.94 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -112.42 136.52 51.81 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.937 0.399 . . . . 1.0 110.705 -179.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 88.37 8.27 71.41 Favored Glycine 0 CA--C 1.526 0.747 0 CA-C-N 116.06 -0.518 . . . . 1.0 111.894 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 50.4 mtpt -138.91 -172.27 3.28 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.212 0.529 . . . . 1.0 111.113 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -94.5 108.95 40.29 Favored Pre-proline 0 CA--C 1.537 0.47 0 CA-C-N 115.275 -0.875 . . . . 1.0 109.41 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -80.97 92.95 1.03 Allowed 'Trans proline' 0 N--CA 1.491 1.33 0 C-N-CA 121.769 1.646 . . . . 1.0 112.476 -179.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -80.94 141.43 34.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.163 -0.471 . . . . 1.0 109.742 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 10.5 mt -141.51 133.0 13.48 Favored Pre-proline 0 CA--C 1.536 0.417 0 N-CA-C 110.066 -0.346 . . . . 1.0 110.066 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -76.12 120.0 5.54 Favored 'Trans proline' 0 N--CA 1.491 1.342 0 C-N-CA 121.538 1.492 . . . . 1.0 111.466 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1283 ' ' LEU . . . . . 0.404 HD12 ' N ' ' A' 1283 ' ' LEU . 11.0 mp -106.11 153.22 22.39 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.147 -0.479 . . . . 1.0 109.759 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1284 ' ' TYR . . . . . 0.41 ' CE1' HD11 ' A' 1265 ' ' LEU . 3.0 m-85 -77.14 141.26 40.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.289 0.566 . . . . 1.0 111.042 -179.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 64.3 tttm -136.57 124.89 23.27 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.313 -0.858 . . . . 1.0 109.471 179.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1286 ' ' THR . . . . . . . . . . . . . 59.3 m -85.65 129.87 34.71 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.918 0.389 . . . . 1.0 111.087 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 77.2 mt -82.95 -170.49 3.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.919 -0.582 . . . . 1.0 110.128 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -107.99 152.73 24.08 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.097 -0.502 . . . . 1.0 109.909 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1289 ' ' THR . . . . . . . . . . . . . 73.3 p -86.53 113.21 22.25 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.896 0.379 . . . . 1.0 111.427 -179.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 3.4 m -149.43 122.57 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.916 -0.584 . . . . 1.0 109.915 178.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -141.85 166.85 26.14 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.123 -0.791 . . . . 1.0 111.123 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -63.27 -47.22 8.29 Favored 'Trans proline' 0 C--N 1.307 -1.609 0 C-N-CA 122.761 2.308 . . . . 1.0 111.077 179.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1293 ' ' SER . . . . . . . . . . . . . 31.2 t -85.49 165.36 17.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.537 -0.756 . . . . 1.0 110.416 179.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 17.9 m170 -59.45 -14.91 14.21 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.876 -0.416 . . . . 1.0 109.876 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -65.33 144.49 57.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.835 -0.62 . . . . 1.0 111.317 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -105.67 136.46 45.24 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.059 -0.519 . . . . 1.0 110.409 179.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1297 ' ' THR . . . . . . . . . . . . . 55.5 m -124.33 127.91 48.31 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 109.871 -0.418 . . . . 1.0 109.871 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -96.95 123.5 40.69 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.928 0.395 . . . . 1.0 110.251 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1299 ' ' THR . . . . . . . . . . . . . 99.6 m -126.76 130.5 50.44 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.012 -0.54 . . . . 1.0 110.722 -179.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 56.5 t -117.59 129.88 73.35 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.19 0 N-CA-C 109.076 -0.713 . . . . 1.0 109.076 179.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -129.01 147.73 50.9 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.146 0.498 . . . . 1.0 111.104 -179.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 29.5 t -114.16 129.84 69.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.555 -0.748 . . . . 1.0 109.055 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -113.59 141.44 47.17 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.212 0.53 . . . . 1.0 111.825 -178.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1304 ' ' PHE . . . . . 0.618 ' CE1' ' NE2' ' A' 1336 ' ' GLN . 80.1 t80 -137.58 100.58 4.25 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.242 -0.89 . . . . 1.0 109.355 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 50.7 mtmt 43.75 39.81 2.71 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.233 -0.439 . . . . 1.0 110.883 -178.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 88.53 6.37 73.7 Favored Glycine 0 CA--C 1.528 0.902 0 CA-C-N 116.266 -0.425 . . . . 1.0 112.361 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -112.45 121.47 44.92 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.854 0.359 . . . . 1.0 110.288 179.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 37.5 ttm180 -80.37 134.24 36.01 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.126 -0.488 . . . . 1.0 110.699 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 36.2 pt -131.25 9.71 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-N 116.152 -0.476 . . . . 1.0 110.442 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -159.27 151.7 22.6 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.897 -0.881 . . . . 1.0 110.897 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 9.2 t -170.8 47.1 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.76 0.314 . . . . 1.0 110.723 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1312 ' ' GLY . . . . . 0.555 ' H ' ' HB2' ' A' 1324 ' ' ALA . . . -75.77 149.61 38.4 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 111.231 -0.748 . . . . 1.0 111.231 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -136.2 149.14 48.44 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 110.137 -0.32 . . . . 1.0 110.137 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -177.94 163.47 31.74 Favored Glycine 0 CA--C 1.53 1.018 0 N-CA-C 110.663 -0.975 . . . . 1.0 110.663 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -53.7 -45.8 38.4 Favored 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 121.551 1.501 . . . . 1.0 112.16 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1316 ' ' SER . . . . . . . . . . . . . 91.1 p -105.32 161.99 13.82 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.005 0.431 . . . . 1.0 111.189 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 46.2 mm -64.97 -44.7 96.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.712 -0.677 . . . . 1.0 110.9 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -55.75 -44.04 77.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.146 -0.479 . . . . 1.0 111.124 -178.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -66.77 -39.38 87.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.509 -0.314 . . . . 1.0 110.881 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -65.21 -39.68 93.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 1.0 111.405 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -66.8 -35.54 80.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.588 -0.278 . . . . 1.0 111.291 -179.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1322 ' ' MET . . . . . . . . . . . . . 59.7 mtt -62.38 -42.17 99.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.515 -0.311 . . . . 1.0 110.769 -179.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -67.35 -43.32 88.38 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 111.196 -0.762 . . . . 1.0 111.196 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1324 ' ' ALA . . . . . 0.555 ' HB2' ' H ' ' A' 1312 ' ' GLY . . . -67.48 -39.47 85.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.725 0.298 . . . . 1.0 111.31 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -64.66 -41.22 96.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.438 -0.346 . . . . 1.0 111.599 -179.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1326 ' ' MET . . . . . . . . . . . . . 22.3 tpp -61.37 -48.56 80.72 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.87 -0.332 . . . . 1.0 110.436 -179.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -65.49 -37.46 86.87 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.998 -0.546 . . . . 1.0 111.186 -179.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1328 ' ' ALA . . . . . 0.531 ' O ' ' CD2' ' A' 1332 ' ' TYR . . . -56.47 -25.05 49.83 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 111.973 0.361 . . . . 1.0 111.973 -178.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 78.3 mt -62.61 -42.23 99.46 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.98 0.363 . . . . 1.0 111.98 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -95.19 23.89 5.4 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 111.994 0.368 . . . . 1.0 111.994 -178.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -132.44 34.46 3.72 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 121.197 -0.201 . . . . 1.0 110.973 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1332 ' ' TYR . . . . . 0.531 ' CD2' ' O ' ' A' 1328 ' ' ALA . 29.2 m-85 -111.5 139.38 46.98 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.325 0.583 . . . . 1.0 110.956 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1333 ' ' ASN . . . . . 0.451 ' O ' ' O ' ' A' 1334 ' ' PHE . 11.4 m120 -102.78 -175.46 2.82 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 115.141 -0.936 . . . . 1.0 110.187 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 1334 ' ' PHE . . . . . 0.451 ' O ' ' O ' ' A' 1333 ' ' ASN . 0.5 OUTLIER -49.27 -179.56 0.03 OUTLIER Pre-proline 0 CA--C 1.539 0.542 0 N-CA-C 109.024 -0.732 . . . . 1.0 109.024 179.408 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -59.34 145.11 98.88 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 121.704 1.603 . . . . 1.0 111.693 -179.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 1336 ' ' GLN . . . . . 0.618 ' NE2' ' CE1' ' A' 1304 ' ' PHE . 1.3 mm100 . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.056 -0.52 . . . . 1.0 110.53 -179.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 18.7 pttp . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.795 0.331 . . . . 1.0 110.773 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A 1263 ' ' SER . . . . . . . . . . . . . 58.2 m -61.13 -32.13 71.83 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.133 -0.485 . . . . 1.0 110.623 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1264 ' ' GLN . . . . . 0.501 ' O ' ' SG ' ' A' 1268 ' ' CYS . 28.3 mp0 -57.04 -49.55 75.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.22 -0.446 . . . . 1.0 110.986 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1265 ' ' LEU . . . . . . . . . . . . . 34.4 mt -63.39 -40.6 97.67 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.762 -0.375 . . . . 1.0 110.605 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -63.71 -45.45 89.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.352 -0.386 . . . . 1.0 110.789 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -70.51 -39.61 74.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.447 -0.342 . . . . 1.0 111.236 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1268 ' ' CYS . . . . . 0.501 ' SG ' ' O ' ' A' 1264 ' ' GLN . 89.2 m -60.93 -35.57 77.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.46 -0.336 . . . . 1.0 111.376 -179.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 83.9 m -54.71 -37.95 66.46 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.864 -0.335 . . . . 1.0 111.005 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1270 ' ' LEU . . . . . 0.457 HD22 ' N ' ' A' 1270 ' ' LEU . 3.6 mm? -64.89 -39.86 94.2 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.931 -0.308 . . . . 1.0 111.07 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1271 ' ' THR . . . . . . . . . . . . . 76.6 p -66.06 -31.11 71.79 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.979 0.363 . . . . 1.0 111.979 -178.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 60.4 mt -81.09 89.54 5.98 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 120.626 -0.43 . . . . 1.0 110.83 -179.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -119.19 151.76 37.79 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.088 -0.506 . . . . 1.0 110.57 179.451 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1274 ' ' THR . . . . . . . . . . . . . 1.3 m -126.91 162.03 26.91 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 109.866 -0.42 . . . . 1.0 109.866 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1275 ' ' GLU . . . . . 0.545 ' C ' ' H ' ' A' 1277 ' ' LYS . 79.0 tt0 -87.97 100.18 12.71 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 112.273 0.472 . . . . 1.0 112.273 -178.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 57.83 -13.97 0.02 OUTLIER Glycine 0 CA--C 1.529 0.92 0 CA-C-N 115.729 -0.669 . . . . 1.0 113.353 178.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1277 ' ' LYS . . . . . 0.545 ' H ' ' C ' ' A' 1275 ' ' GLU . 48.9 mtpt -79.17 -166.25 0.9 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 117.694 0.747 . . . . 1.0 110.474 -179.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -93.45 110.14 44.96 Favored Pre-proline 0 CA--C 1.538 0.5 0 CA-C-N 116.039 -0.528 . . . . 1.0 109.813 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -80.65 114.85 3.03 Favored 'Trans proline' 0 N--CA 1.492 1.403 0 C-N-CA 121.867 1.712 . . . . 1.0 112.171 -179.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -83.82 133.54 34.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.001 -0.545 . . . . 1.0 109.982 179.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1281 ' ' ILE . . . . . 0.419 HD13 HG21 ' A' 1281 ' ' ILE . 1.8 mt -144.76 127.89 8.51 Favored Pre-proline 0 CA--C 1.538 0.501 0 CA-C-O 118.991 -0.528 . . . . 1.0 110.138 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 43.3 Cg_exo -52.95 135.57 58.62 Favored 'Trans proline' 0 N--CA 1.493 1.469 0 CA-C-N 120.482 1.208 . . . . 1.0 111.31 177.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 80.5 mt -122.32 152.63 39.91 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 109.596 -0.52 . . . . 1.0 109.596 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1284 ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -81.1 136.41 35.92 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.95 0.405 . . . . 1.0 110.914 -179.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 62.9 tttm -141.17 113.74 8.22 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.922 -0.581 . . . . 1.0 109.92 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1286 ' ' THR . . . . . . . . . . . . . 97.3 m -92.14 127.05 37.47 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.321 -0.399 . . . . 1.0 110.87 -179.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 60.0 mt -74.91 -172.45 1.61 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.276 -0.42 . . . . 1.0 109.948 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -108.13 126.01 52.27 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 120.84 0.352 . . . . 1.0 110.205 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1289 ' ' THR . . . . . . . . . . . . . 18.0 p -62.55 122.56 16.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.052 -0.522 . . . . 1.0 111.392 -179.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 15.8 m -153.25 122.62 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.809 -0.632 . . . . 1.0 109.773 178.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.01 166.67 26.25 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 111.039 -0.824 . . . . 1.0 111.039 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -66.03 -43.46 9.05 Favored 'Trans proline' 0 C--N 1.307 -1.638 0 C-N-CA 122.636 2.224 . . . . 1.0 110.852 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1293 ' ' SER . . . . . . . . . . . . . 30.3 t -89.97 165.26 14.17 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.394 -0.821 . . . . 1.0 110.126 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 71.0 m80 -59.11 -15.37 13.8 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.915 -0.402 . . . . 1.0 109.915 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -63.88 138.66 58.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.929 -0.578 . . . . 1.0 110.783 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 83.5 mtm-85 -101.87 142.41 33.23 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.193 -0.458 . . . . 1.0 110.766 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1297 ' ' THR . . . . . . . . . . . . . 94.6 m -118.73 124.33 47.04 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.958 -0.565 . . . . 1.0 109.8 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -98.51 116.03 29.86 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.362 -0.381 . . . . 1.0 110.491 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1299 ' ' THR . . . . . . . . . . . . . 91.0 m -126.88 132.39 50.93 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.115 -0.493 . . . . 1.0 110.598 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 75.4 t -121.57 131.37 73.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 N-CA-C 109.532 -0.544 . . . . 1.0 109.532 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -129.79 143.74 50.96 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.005 0.431 . . . . 1.0 110.551 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 58.0 t -109.67 129.38 64.64 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 CA-C-N 116.044 -0.526 . . . . 1.0 109.629 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -105.11 133.89 49.14 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.001 0.429 . . . . 1.0 111.332 -179.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 87.7 t80 -147.92 110.37 4.66 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.842 -0.617 . . . . 1.0 110.354 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 72.4 mmtt 54.58 31.19 14.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.313 -0.403 . . . . 1.0 110.647 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 78.93 6.36 88.71 Favored Glycine 0 CA--C 1.523 0.584 0 N-CA-C 111.068 -0.813 . . . . 1.0 111.068 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -112.11 117.06 31.57 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 109.975 -0.38 . . . . 1.0 109.975 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 42.3 ttm180 -73.37 128.24 34.92 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.732 -0.47 . . . . 1.0 109.732 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1309 ' ' ILE . . . . . 0.401 HD13 HG21 ' A' 1309 ' ' ILE . 24.3 pt -118.28 19.73 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-N 116.155 -0.475 . . . . 1.0 111.656 -178.308 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -161.54 147.3 13.57 Favored Glycine 0 CA--C 1.524 0.652 0 C-N-CA 120.499 -0.858 . . . . 1.0 111.418 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 44.9 t -171.11 126.77 0.68 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.719 0.295 . . . . 1.0 110.428 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -177.32 176.15 47.93 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 110.944 -0.862 . . . . 1.0 110.944 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 65.2 mttp -142.39 149.41 39.31 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.804 0.335 . . . . 1.0 110.413 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -164.96 168.5 39.18 Favored Glycine 0 CA--C 1.529 0.949 0 N-CA-C 110.635 -0.986 . . . . 1.0 110.635 179.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -53.92 -69.13 0.06 OUTLIER 'Trans proline' 0 N--CA 1.494 1.516 0 C-N-CA 121.602 1.535 . . . . 1.0 111.878 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1316 ' ' SER . . . . . . . . . . . . . 8.2 p -90.32 169.18 11.31 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.079 -0.509 . . . . 1.0 111.07 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 47.5 mm -63.9 -43.89 97.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.893 -0.594 . . . . 1.0 110.353 179.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 93.9 mm-40 -53.8 -40.79 66.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 1.0 110.967 -179.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -61.36 -42.39 98.62 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.392 -0.367 . . . . 1.0 110.621 -179.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -67.37 -37.68 83.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.25 -0.432 . . . . 1.0 110.991 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -64.84 -43.31 93.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.106 -0.497 . . . . 1.0 111.526 -179.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1322 ' ' MET . . . . . . . . . . . . . 78.2 mtm -64.52 -39.28 93.49 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.782 -0.367 . . . . 1.0 111.406 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -63.31 -48.36 79.76 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 111.037 -0.825 . . . . 1.0 111.037 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -69.92 -35.75 74.81 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.785 0.326 . . . . 1.0 111.083 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -59.71 -49.76 76.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.075 -0.511 . . . . 1.0 111.918 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1326 ' ' MET . . . . . . . . . . . . . 87.1 mmm -64.67 -42.39 95.41 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.723 -0.391 . . . . 1.0 111.67 -178.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -66.18 -33.62 76.17 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.329 -0.396 . . . . 1.0 111.312 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1328 ' ' ALA . . . . . . . . . . . . . . . -56.79 -20.83 24.47 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.169 -0.469 . . . . 1.0 112.194 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1329 ' ' LEU . . . . . 0.449 HD22 ' N ' ' A' 1329 ' ' LEU . 3.7 mm? -61.32 -42.66 99.05 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.585 -0.446 . . . . 1.0 111.16 -178.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1330 ' ' GLU . . . . . 0.521 ' N ' ' OE1' ' A' 1330 ' ' GLU . 50.4 mp0 -92.94 24.59 3.6 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 121.209 -0.196 . . . . 1.0 111.435 -179.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -128.66 10.32 6.06 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 111.702 0.26 . . . . 1.0 111.702 -178.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1332 ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -77.36 137.75 38.92 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 120.492 -0.483 . . . . 1.0 110.602 179.467 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 5.4 m120 -107.32 -177.0 3.23 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.605 -0.725 . . . . 1.0 110.224 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 1334 ' ' PHE . . . . . 0.454 ' O ' ' O ' ' A' 1335 ' ' PRO . 19.3 m-85 -41.39 151.1 0.3 Allowed Pre-proline 0 CA--C 1.539 0.539 0 CA-C-N 116.215 -0.448 . . . . 1.0 110.438 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1335 ' ' PRO . . . . . 0.454 ' O ' ' O ' ' A' 1334 ' ' PHE . 87.9 Cg_exo -41.49 174.12 0.0 OUTLIER 'Trans proline' 0 N--CA 1.495 1.617 0 C-N-CA 122.433 2.088 . . . . 1.0 112.814 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 1336 ' ' GLN . . . . . 0.592 ' H ' ' CD ' ' A' 1336 ' ' GLN . 2.2 mp0 . . . . . 0 C--N 1.331 -0.221 0 CA-C-N 115.816 -0.629 . . . . 1.0 110.378 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 52.7 pttt . . . . . 0 CA--C 1.528 0.103 0 CA-C-O 121.01 0.433 . . . . 1.0 110.659 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A 1263 ' ' SER . . . . . . . . . . . . . 47.8 m -61.45 -35.7 78.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.12 -0.491 . . . . 1.0 111.017 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -58.46 -52.52 65.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.312 -0.404 . . . . 1.0 111.433 -179.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1265 ' ' LEU . . . . . . . . . . . . . 8.8 mt -65.12 -40.03 93.92 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.902 -0.319 . . . . 1.0 110.784 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 20.2 mm100 -62.29 -43.36 99.01 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 121.033 -0.267 . . . . 1.0 110.89 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -65.63 -31.51 72.57 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.792 0.33 . . . . 1.0 110.814 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1268 ' ' CYS . . . . . 0.43 ' O ' ' OG1' ' A' 1271 ' ' THR . 85.3 m -62.8 -36.5 83.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.378 -0.373 . . . . 1.0 111.119 -179.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 93.1 m -60.48 -37.28 80.53 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.88 -0.328 . . . . 1.0 111.036 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1270 ' ' LEU . . . . . 0.489 HD12 ' N ' ' A' 1270 ' ' LEU . 10.9 mp -63.48 -40.42 97.05 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.802 -0.359 . . . . 1.0 110.618 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1271 ' ' THR . . . . . 0.43 ' OG1' ' O ' ' A' 1268 ' ' CYS . 69.2 p -64.67 -31.3 72.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.452 -0.34 . . . . 1.0 111.426 -179.051 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 87.8 mt -69.93 84.04 0.49 Allowed 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.303 -0.559 . . . . 1.0 110.577 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -106.1 136.66 45.39 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.248 -0.433 . . . . 1.0 110.228 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1274 ' ' THR . . . . . . . . . . . . . 7.1 m -127.24 155.65 43.14 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 109.85 -0.426 . . . . 1.0 109.85 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -66.65 90.59 0.17 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.976 0.417 . . . . 1.0 111.469 -178.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 54.62 40.57 70.99 Favored Glycine 0 CA--C 1.525 0.692 0 CA-C-N 115.832 -0.622 . . . . 1.0 112.434 178.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 42.4 mtpt -140.4 178.92 6.96 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.508 0.671 . . . . 1.0 111.885 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -117.74 105.95 46.88 Favored Pre-proline 0 CA--C 1.539 0.538 0 CA-C-N 114.753 -1.112 . . . . 1.0 109.271 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -81.14 163.66 19.95 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 C-N-CA 121.776 1.65 . . . . 1.0 112.203 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1280 ' ' ASP . . . . . 0.5 ' O ' ' NE2' ' A' 1336 ' ' GLN . 97.8 m-20 -79.87 125.82 30.21 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.387 -0.597 . . . . 1.0 109.387 179.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -115.91 140.45 26.24 Favored Pre-proline 0 CA--C 1.541 0.627 0 CA-C-N 115.973 -0.558 . . . . 1.0 110.591 -178.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo -49.18 137.35 30.04 Favored 'Trans proline' 0 N--CA 1.491 1.381 0 C-N-CA 120.973 1.115 . . . . 1.0 110.96 178.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 55.4 mt -117.7 140.43 49.67 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 110.01 -0.367 . . . . 1.0 110.01 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1284 ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -85.17 137.3 33.1 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.237 -0.438 . . . . 1.0 110.241 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 88.6 tttt -140.67 121.2 14.15 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.911 0.386 . . . . 1.0 110.463 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1286 ' ' THR . . . . . . . . . . . . . 34.3 m -89.31 128.66 35.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.485 . . . . 1.0 110.253 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 54.2 mt -81.12 -172.45 3.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.478 -0.328 . . . . 1.0 110.299 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -108.13 141.05 40.44 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.241 -0.436 . . . . 1.0 110.337 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1289 ' ' THR . . . . . . . . . . . . . 5.6 p -91.04 112.74 24.77 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.238 -0.437 . . . . 1.0 110.748 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 5.6 m -143.27 122.17 7.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.185 -0.461 . . . . 1.0 110.202 179.108 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.44 166.09 26.56 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.749 -0.94 . . . . 1.0 110.749 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.01 -40.8 67.59 Favored 'Trans proline' 0 C--N 1.306 -1.688 0 C-N-CA 122.382 2.055 . . . . 1.0 110.946 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1293 ' ' SER . . . . . . . . . . . . . 29.5 t -92.95 164.34 13.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.616 -0.72 . . . . 1.0 110.079 178.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 75.7 m-70 -60.36 -9.97 4.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.084 0.468 . . . . 1.0 110.027 179.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -60.17 141.98 55.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.902 -0.59 . . . . 1.0 110.845 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -113.84 141.91 46.74 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.085 -0.507 . . . . 1.0 110.911 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1297 ' ' THR . . . . . . . . . . . . . 89.1 m -124.0 126.01 45.56 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.965 -0.561 . . . . 1.0 109.816 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -103.38 122.57 45.13 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.978 0.418 . . . . 1.0 110.975 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1299 ' ' THR . . . . . . . . . . . . . 89.9 m -128.03 132.84 49.08 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.875 -0.602 . . . . 1.0 110.142 179.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 55.9 t -118.72 132.82 67.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 N-CA-C 109.671 -0.492 . . . . 1.0 109.671 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -128.82 147.15 50.78 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.089 -0.505 . . . . 1.0 110.7 -179.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 44.4 t -115.21 130.07 70.38 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 N-CA-C 109.513 -0.551 . . . . 1.0 109.513 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -108.93 140.96 41.7 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.092 0.473 . . . . 1.0 111.226 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 92.0 t80 -136.96 103.54 5.19 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.683 -0.69 . . . . 1.0 109.792 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1305 ' ' LYS . . . . . 0.431 ' HE3' HE22 ' A' 1336 ' ' GLN . 98.8 mttt 47.84 34.21 3.77 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.756 -0.378 . . . . 1.0 110.511 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 87.55 10.29 70.69 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 121.26 -0.495 . . . . 1.0 111.901 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -116.11 136.39 53.07 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 120.923 0.392 . . . . 1.0 110.622 179.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 72.6 ttp85 -81.44 135.4 35.63 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.95 -0.568 . . . . 1.0 110.885 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 40.3 pt -135.36 18.22 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-N 116.281 -0.418 . . . . 1.0 110.744 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -161.33 147.83 14.84 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 111.305 -0.718 . . . . 1.0 111.305 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 35.5 t -168.58 134.93 1.87 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.902 0.382 . . . . 1.0 110.625 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . 169.68 170.86 34.66 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 110.799 -0.92 . . . . 1.0 110.799 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -138.59 146.75 42.17 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.973 0.415 . . . . 1.0 110.934 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -162.34 172.54 38.47 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 110.356 -1.097 . . . . 1.0 110.356 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -68.01 -73.03 0.02 OUTLIER 'Trans proline' 0 C--N 1.306 -1.66 0 C-N-CA 122.33 2.02 . . . . 1.0 111.984 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1316 ' ' SER . . . . . 0.419 ' OG ' ' OE1' ' A' 1319 ' ' GLN . 82.5 p -82.48 161.21 22.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.46 . . . . 1.0 110.769 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 44.1 mm -65.02 -43.99 96.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.996 -0.547 . . . . 1.0 110.697 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -54.96 -45.05 74.9 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.388 -0.369 . . . . 1.0 110.338 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1319 ' ' GLN . . . . . 0.419 ' OE1' ' OG ' ' A' 1316 ' ' SER . 1.4 mp0 -64.62 -40.2 95.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.33 -0.396 . . . . 1.0 110.169 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -63.61 -40.06 95.95 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.117 -0.492 . . . . 1.0 111.075 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -67.2 -38.71 85.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.327 -0.397 . . . . 1.0 110.707 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1322 ' ' MET . . . . . . . . . . . . . 78.6 mtp -64.44 -40.56 95.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.469 . . . . 1.0 110.711 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -67.48 -48.43 57.32 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 110.661 -0.976 . . . . 1.0 110.661 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -67.56 -35.13 78.44 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.877 0.37 . . . . 1.0 110.683 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -60.9 -41.24 95.72 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.945 -0.57 . . . . 1.0 111.769 -178.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1326 ' ' MET . . . . . . . . . . . . . 62.6 ttp -63.28 -41.82 99.04 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.877 -0.329 . . . . 1.0 111.316 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -67.48 -29.53 68.99 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.248 -0.433 . . . . 1.0 110.926 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1328 ' ' ALA . . . . . . . . . . . . . . . -61.13 -27.88 68.71 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.125 0.417 . . . . 1.0 112.125 -178.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 3.2 mm? -62.25 -41.26 98.28 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.494 -0.482 . . . . 1.0 110.569 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -88.61 18.71 4.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.354 -0.385 . . . . 1.0 111.24 -179.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 99.5 mttt -135.41 40.11 2.84 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.518 0.562 . . . . 1.0 112.518 -178.219 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1332 ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -106.04 134.94 48.37 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.215 0.531 . . . . 1.0 110.595 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1333 ' ' ASN . . . . . 0.427 ' O ' ' C ' ' A' 1334 ' ' PHE . 52.0 m-20 -111.43 -175.48 2.71 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.35 -0.841 . . . . 1.0 109.92 179.277 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1334 ' ' PHE . . . . . 0.427 ' C ' ' O ' ' A' 1333 ' ' ASN . 52.3 m-85 -30.39 110.59 0.27 Allowed Pre-proline 0 CA--C 1.543 0.702 0 O-C-N 123.476 0.485 . . . . 1.0 111.524 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -52.35 145.99 33.97 Favored 'Trans proline' 0 N--CA 1.496 1.673 0 C-N-CA 121.661 1.574 . . . . 1.0 112.275 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 1336 ' ' GLN . . . . . 0.5 ' NE2' ' O ' ' A' 1280 ' ' ASP . 15.8 mm100 . . . . . 0 N--CA 1.462 0.149 0 CA-C-N 115.894 -0.594 . . . . 1.0 111.205 -179.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 64.3 pttt . . . . . 0 CA--C 1.53 0.183 0 CA-C-O 120.617 0.246 . . . . 1.0 111.371 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A 1263 ' ' SER . . . . . . . . . . . . . 45.7 m -60.45 -28.05 67.99 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.767 0.318 . . . . 1.0 110.638 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1264 ' ' GLN . . . . . 0.45 ' O ' ' SG ' ' A' 1268 ' ' CYS . 99.1 mm-40 -54.51 -44.17 72.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 1.0 110.636 -179.166 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1265 ' ' LEU . . . . . . . . . . . . . 20.4 mt -63.58 -41.48 98.37 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.505 -0.478 . . . . 1.0 110.474 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -63.47 -43.98 95.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.846 0.355 . . . . 1.0 110.492 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -66.58 -40.82 89.13 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.037 -0.529 . . . . 1.0 109.887 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1268 ' ' CYS . . . . . 0.45 ' SG ' ' O ' ' A' 1264 ' ' GLN . 92.9 m -65.14 -35.07 79.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.596 -0.729 . . . . 1.0 110.995 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 98.4 m -56.74 -35.54 68.72 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.992 -0.283 . . . . 1.0 111.096 -179.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 82.9 mt -62.92 -40.98 99.27 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.478 -0.328 . . . . 1.0 110.621 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1271 ' ' THR . . . . . . . . . . . . . 70.3 p -66.77 -33.14 74.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.517 -0.31 . . . . 1.0 110.843 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1272 ' ' LEU . . . . . 0.415 HD22 ' H ' ' A' 1336 ' ' GLN . 85.9 mt -68.19 85.95 0.26 Allowed 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.572 -0.451 . . . . 1.0 110.562 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 79.4 mtp85 -119.67 131.09 55.34 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.307 -0.406 . . . . 1.0 110.75 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1274 ' ' THR . . . . . . . . . . . . . 20.8 m -120.94 128.4 52.72 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 109.992 -0.373 . . . . 1.0 109.992 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 48.4 tp10 -98.07 128.77 44.79 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.255 -0.43 . . . . 1.0 110.468 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 97.19 -9.26 65.2 Favored Glycine 0 CA--C 1.524 0.647 0 N-CA-C 111.439 -0.664 . . . . 1.0 111.439 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 52.0 mtpt -137.43 -175.11 3.95 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.207 0.527 . . . . 1.0 111.145 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -95.79 108.22 38.94 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 115.11 -0.95 . . . . 1.0 108.713 178.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -50.67 129.22 26.31 Favored 'Trans proline' 0 N--CA 1.493 1.445 0 C-N-CA 121.154 1.236 . . . . 1.0 112.251 -178.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -98.65 125.33 43.91 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.696 -0.684 . . . . 1.0 109.858 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 11.9 mt -133.73 133.84 22.8 Favored Pre-proline 0 CA--C 1.538 0.494 0 N-CA-C 110.365 -0.235 . . . . 1.0 110.365 -179.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -77.68 120.55 5.19 Favored 'Trans proline' 0 N--CA 1.493 1.471 0 C-N-CA 121.56 1.507 . . . . 1.0 111.531 178.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1283 ' ' LEU . . . . . 0.419 HD12 ' N ' ' A' 1283 ' ' LEU . 9.4 mp -106.91 155.83 19.34 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.193 -0.458 . . . . 1.0 110.383 -179.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1284 ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -77.33 144.71 37.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.921 -0.581 . . . . 1.0 111.155 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 87.7 tttt -146.12 105.73 3.96 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.837 -0.619 . . . . 1.0 109.989 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1286 ' ' THR . . . . . . . . . . . . . 26.2 m -63.44 130.38 44.19 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.123 -0.49 . . . . 1.0 111.2 -179.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 65.7 mt -81.4 -175.1 5.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.047 -0.524 . . . . 1.0 110.406 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -108.76 146.73 33.1 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.161 -0.472 . . . . 1.0 110.292 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1289 ' ' THR . . . . . . . . . . . . . 17.4 p -94.57 114.21 26.15 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.1 -0.5 . . . . 1.0 111.212 -178.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1290 ' ' VAL . . . . . 0.527 ' O ' HG23 ' A' 1290 ' ' VAL . 30.4 m -138.92 121.56 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-N 116.292 -0.413 . . . . 1.0 110.358 178.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.8 157.83 26.91 Favored Glycine 0 CA--C 1.527 0.82 0 N-CA-C 110.19 -1.164 . . . . 1.0 110.19 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -60.26 -40.56 58.11 Favored 'Trans proline' 0 C--N 1.31 -1.487 0 C-N-CA 122.055 1.837 . . . . 1.0 110.975 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1293 ' ' SER . . . . . . . . . . . . . 11.9 t -93.19 164.79 13.11 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.633 -0.712 . . . . 1.0 110.314 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 62.1 m170 -58.36 -11.39 2.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.274 -0.421 . . . . 1.0 110.018 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -60.3 147.89 38.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.98 -0.554 . . . . 1.0 110.485 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 96.2 mtt-85 -126.89 143.74 51.19 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.164 0.507 . . . . 1.0 111.149 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1297 ' ' THR . . . . . . . . . . . . . 88.4 m -125.24 128.09 47.76 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.57 -0.741 . . . . 1.0 109.366 178.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 95.3 m-85 -99.66 119.32 37.91 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.777 -0.453 . . . . 1.0 109.777 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1299 ' ' THR . . . . . . . . . . . . . 41.1 m -127.24 130.17 49.13 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.939 -0.573 . . . . 1.0 110.427 -179.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 67.2 t -118.31 127.41 75.42 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 N-CA-C 109.189 -0.671 . . . . 1.0 109.189 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -130.83 143.39 50.7 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.351 -0.386 . . . . 1.0 110.894 -179.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 16.9 t -106.55 129.07 60.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 N-CA-C 109.142 -0.688 . . . . 1.0 109.142 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -112.59 144.33 42.26 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.238 0.542 . . . . 1.0 111.671 -178.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1304 ' ' PHE . . . . . 0.432 ' O ' ' N ' ' A' 1307 ' ' GLU . 75.2 t80 -126.69 108.0 10.69 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.388 -0.823 . . . . 1.0 109.234 179.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 38.5 mtpt 46.75 32.24 1.69 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.514 -0.474 . . . . 1.0 109.984 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 88.97 17.29 56.52 Favored Glycine 0 CA--C 1.529 0.956 0 N-CA-C 111.83 -0.508 . . . . 1.0 111.83 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1307 ' ' GLU . . . . . 0.432 ' N ' ' O ' ' A' 1304 ' ' PHE . 99.5 mt-10 -119.47 129.71 54.87 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.964 0.382 . . . . 1.0 110.777 179.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1308 ' ' ARG . . . . . 0.661 HH21 ' CB ' ' A' 1311 ' ' CYS . 77.7 ttt180 -66.53 129.25 39.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.772 -0.649 . . . . 1.0 110.97 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 3.4 pt -138.24 13.01 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 116.064 -0.517 . . . . 1.0 110.874 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -173.57 153.19 16.98 Favored Glycine 0 CA--C 1.524 0.623 0 C-N-CA 120.346 -0.93 . . . . 1.0 111.674 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1311 ' ' CYS . . . . . 0.661 ' CB ' HH21 ' A' 1308 ' ' ARG . 52.4 t -169.9 144.08 2.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.877 0.37 . . . . 1.0 110.789 179.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -170.63 156.35 26.61 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.879 -0.888 . . . . 1.0 110.879 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 99.3 mttt -139.07 142.02 38.18 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.929 0.395 . . . . 1.0 110.595 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -167.11 176.9 41.94 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 110.277 -1.129 . . . . 1.0 110.277 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 18.3 Cg_exo -61.53 -63.23 0.1 Allowed 'Trans proline' 0 C--N 1.311 -1.408 0 C-N-CA 121.487 1.458 . . . . 1.0 111.936 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1316 ' ' SER . . . . . . . . . . . . . 9.8 p -90.95 167.25 12.55 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.8 -0.636 . . . . 1.0 111.061 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 38.1 mm -67.79 -42.43 86.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.914 -0.584 . . . . 1.0 110.088 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -54.5 -43.52 71.9 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.961 -0.563 . . . . 1.0 111.204 -178.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -66.94 -40.05 87.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.999 0.428 . . . . 1.0 110.341 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -62.59 -38.92 92.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.046 -0.525 . . . . 1.0 110.367 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -67.35 -38.17 84.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.245 -0.434 . . . . 1.0 111.445 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1322 ' ' MET . . . . . . . . . . . . . 72.1 mmm -64.13 -40.15 95.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.868 0.366 . . . . 1.0 110.547 -179.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -66.41 -47.42 70.58 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 111.574 -0.61 . . . . 1.0 111.574 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -66.09 -38.87 89.35 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.912 -0.315 . . . . 1.0 111.301 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -59.15 -48.3 82.11 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.358 -0.383 . . . . 1.0 111.206 -179.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1326 ' ' MET . . . . . 0.456 ' O ' ' OE1' ' A' 1330 ' ' GLU . 98.0 mmm -62.59 -43.97 97.49 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.729 -0.388 . . . . 1.0 111.085 -179.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -68.48 -32.78 73.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.528 -0.306 . . . . 1.0 111.694 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1328 ' ' ALA . . . . . . . . . . . . . . . -62.34 -33.65 75.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.677 0.275 . . . . 1.0 111.641 -178.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 98.7 mt -58.75 -26.49 64.04 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.707 0.289 . . . . 1.0 111.095 -179.485 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1330 ' ' GLU . . . . . 0.529 ' N ' ' OE1' ' A' 1330 ' ' GLU . 56.1 mp0 -88.84 -2.08 58.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.357 -0.383 . . . . 1.0 111.544 -179.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 98.4 mttt -120.41 21.46 11.64 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 112.698 0.629 . . . . 1.0 112.698 -177.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1332 ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -104.38 131.03 52.18 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.092 0.472 . . . . 1.0 110.585 179.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -101.13 -176.28 3.11 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.553 -0.749 . . . . 1.0 109.95 178.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -37.05 154.62 0.09 OUTLIER Pre-proline 0 CA--C 1.538 0.496 0 CA-C-N 116.147 -0.479 . . . . 1.0 110.846 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -52.97 157.43 8.08 Favored 'Trans proline' 0 N--CA 1.493 1.481 0 C-N-CA 121.336 1.357 . . . . 1.0 111.483 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 1336 ' ' GLN . . . . . 0.415 ' H ' HD22 ' A' 1272 ' ' LEU . 99.4 mm-40 . . . . . 0 N--CA 1.465 0.288 0 CA-C-O 120.941 0.4 . . . . 1.0 111.095 -179.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 52.1 mtpt . . . . . 0 N--CA 1.465 0.317 0 CA-C-O 120.592 0.234 . . . . 1.0 111.371 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A 1263 ' ' SER . . . . . . . . . . . . . 55.7 m -56.73 -45.23 82.08 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.569 -0.452 . . . . 1.0 110.532 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 28.1 mp0 -67.4 -40.91 85.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.993 0.425 . . . . 1.0 110.552 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1265 ' ' LEU . . . . . 0.474 ' N ' ' CD2' ' A' 1265 ' ' LEU . 2.2 mm? -62.96 -42.97 99.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.905 -0.589 . . . . 1.0 110.574 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -65.31 -44.35 88.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.316 -0.402 . . . . 1.0 111.292 -179.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -63.86 -39.27 93.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.454 -0.339 . . . . 1.0 111.267 -179.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1268 ' ' CYS . . . . . . . . . . . . . 97.4 m -63.94 -35.92 82.26 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.36 -0.382 . . . . 1.0 110.747 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 77.2 m -60.2 -36.23 77.19 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.121 -0.49 . . . . 1.0 111.341 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 90.2 mt -62.9 -41.04 99.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.447 -0.342 . . . . 1.0 111.086 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1271 ' ' THR . . . . . . . . . . . . . 40.4 p -64.83 -30.36 71.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.503 -0.317 . . . . 1.0 111.55 -179.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1272 ' ' LEU . . . . . 0.485 HD22 ' H ' ' A' 1336 ' ' GLN . 70.5 mt -78.71 96.6 5.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.87 0.367 . . . . 1.0 111.175 -179.052 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 46.8 mmm-85 -119.01 111.22 18.04 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.058 -0.519 . . . . 1.0 110.23 179.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1274 ' ' THR . . . . . . . . . . . . . 27.3 m -129.49 139.36 51.59 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 120.733 0.301 . . . . 1.0 110.458 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 78.8 tt0 -129.2 146.73 51.06 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.214 -0.448 . . . . 1.0 110.186 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 82.48 12.97 79.51 Favored Glycine 0 CA--C 1.524 0.651 0 N-CA-C 111.064 -0.814 . . . . 1.0 111.064 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 23.9 mtpp -136.55 -172.84 3.26 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.184 0.516 . . . . 1.0 110.919 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 87.7 mt-10 -96.37 108.57 42.74 Favored Pre-proline 0 CA--C 1.533 0.321 0 CA-C-N 115.259 -0.882 . . . . 1.0 109.046 179.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -50.21 133.12 35.34 Favored 'Trans proline' 0 N--CA 1.491 1.341 0 C-N-CA 121.173 1.249 . . . . 1.0 112.38 -179.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -139.68 124.18 18.18 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.512 -0.767 . . . . 1.0 109.28 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 7.0 mt -143.93 134.82 12.37 Favored Pre-proline 0 CA--C 1.537 0.461 0 CA-C-O 119.154 -0.45 . . . . 1.0 109.939 -178.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -52.24 131.71 40.89 Favored 'Trans proline' 0 N--CA 1.492 1.39 0 CA-C-N 120.322 1.151 . . . . 1.0 111.132 177.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 69.1 mt -130.13 140.65 50.76 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.918 0.389 . . . . 1.0 110.14 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1284 ' ' TYR . . . . . 0.412 ' CE2' HG22 ' A' 1302 ' ' VAL . 29.0 m-85 -82.32 141.8 32.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.877 -0.601 . . . . 1.0 111.785 -178.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -143.49 108.46 4.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.31 -0.859 . . . . 1.0 109.447 179.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1286 ' ' THR . . . . . . . . . . . . . 16.6 m -64.09 142.89 58.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.272 0.558 . . . . 1.0 110.779 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1287 ' ' LEU . . . . . 0.591 ' CD2' ' N ' ' A' 1287 ' ' LEU . 1.0 OUTLIER -80.92 -174.14 4.64 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.216 -0.902 . . . . 1.0 110.015 -179.352 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -108.86 130.59 55.42 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 109.695 -0.483 . . . . 1.0 109.695 179.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1289 ' ' THR . . . . . . . . . . . . . 64.9 p -87.46 116.97 25.93 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.927 0.394 . . . . 1.0 111.359 -179.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1290 ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' 1290 ' ' VAL . 24.1 m -149.99 122.14 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.183 0 CA-C-N 116.04 -0.527 . . . . 1.0 109.99 178.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.14 160.69 27.21 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.516 -1.034 . . . . 1.0 110.516 179.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -59.27 -43.36 41.78 Favored 'Trans proline' 0 C--N 1.308 -1.573 0 C-N-CA 122.214 1.943 . . . . 1.0 111.038 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1293 ' ' SER . . . . . . . . . . . . . 46.9 t -92.3 165.16 13.23 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.569 -0.741 . . . . 1.0 110.331 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 80.8 m80 -59.93 -6.73 1.4 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.334 -0.394 . . . . 1.0 110.389 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -66.7 148.46 51.88 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.081 -0.509 . . . . 1.0 110.612 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -129.9 143.73 50.95 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 116.236 -0.438 . . . . 1.0 110.628 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1297 ' ' THR . . . . . . . . . . . . . 84.8 m -123.54 128.7 50.13 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.933 -0.576 . . . . 1.0 109.526 179.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -102.03 118.98 38.05 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.184 0.516 . . . . 1.0 111.567 -178.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1299 ' ' THR . . . . . . . . . . . . . 91.9 m -127.71 130.13 48.32 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.557 -0.747 . . . . 1.0 109.815 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 53.3 t -117.31 129.94 73.01 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 N-CA-C 109.714 -0.476 . . . . 1.0 109.714 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -130.52 143.82 51.01 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.306 -0.407 . . . . 1.0 111.117 -179.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1302 ' ' VAL . . . . . 0.412 HG22 ' CE2' ' A' 1284 ' ' TYR . 24.9 t -107.37 126.86 63.56 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 CA-C-N 116.019 -0.537 . . . . 1.0 109.599 179.098 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -104.68 130.18 52.76 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.847 0.356 . . . . 1.0 110.539 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 61.8 t80 -142.56 109.03 5.32 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.172 -0.467 . . . . 1.0 110.371 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 68.1 mttm 52.17 27.71 4.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 1.0 110.894 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 80.14 12.22 83.5 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 111.378 -0.689 . . . . 1.0 111.378 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -109.92 120.15 41.56 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 110.023 -0.362 . . . . 1.0 110.023 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 61.6 ttp180 -75.98 126.04 30.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.341 -0.391 . . . . 1.0 110.354 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 31.5 pt -122.26 23.12 4.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-N 116.099 -0.5 . . . . 1.0 110.387 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -156.86 153.4 24.67 Favored Glycine 0 CA--C 1.524 0.639 0 N-CA-C 110.781 -0.928 . . . . 1.0 110.781 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 12.0 t -172.44 105.91 0.17 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.733 0.301 . . . . 1.0 110.557 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -173.48 167.85 40.62 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 111.108 -0.797 . . . . 1.0 111.108 179.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 69.0 mttm -139.61 144.08 37.55 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.811 0.338 . . . . 1.0 110.444 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -157.78 171.95 34.95 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.562 -1.015 . . . . 1.0 110.562 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.78 -76.83 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.66 0 C-N-CA 122.54 2.16 . . . . 1.0 111.759 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1316 ' ' SER . . . . . . . . . . . . . 16.2 p -76.28 162.0 28.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.015 0.436 . . . . 1.0 111.116 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 39.1 mm -63.83 -43.81 97.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.887 -0.597 . . . . 1.0 110.797 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -57.12 -40.27 76.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.305 -0.407 . . . . 1.0 110.877 -179.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 19.0 mm100 -62.85 -42.49 99.77 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.849 0.357 . . . . 1.0 110.66 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -67.08 -37.9 84.79 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.081 -0.508 . . . . 1.0 111.425 -179.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -66.12 -40.02 90.36 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.146 0.424 . . . . 1.0 112.146 -178.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1322 ' ' MET . . . . . . . . . . . . . 74.7 mtm -64.01 -41.35 97.49 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.495 -0.482 . . . . 1.0 111.161 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -64.29 -46.04 91.83 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 120.862 -0.685 . . . . 1.0 111.678 -179.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -66.23 -37.49 85.65 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.891 0.33 . . . . 1.0 111.891 -179.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -62.52 -41.74 99.05 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 111.893 0.331 . . . . 1.0 111.893 -178.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1326 ' ' MET . . . . . . . . . . . . . 74.1 mmm -62.92 -44.39 96.21 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.59 -0.444 . . . . 1.0 111.259 -179.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -68.25 -33.35 74.21 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.858 -0.337 . . . . 1.0 110.278 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1328 ' ' ALA . . . . . . . . . . . . . . . -57.45 -37.33 72.67 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.054 -0.521 . . . . 1.0 111.072 -179.328 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 76.5 mt -62.03 -36.52 81.84 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.78 0.324 . . . . 1.0 110.685 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -82.98 8.32 13.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.29 -0.414 . . . . 1.0 111.273 -179.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 96.5 mttt -135.81 40.51 2.74 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.395 0.517 . . . . 1.0 112.395 -177.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1332 ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -107.18 151.23 25.69 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.075 0.464 . . . . 1.0 110.181 179.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -123.77 -176.74 3.55 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.552 -0.749 . . . . 1.0 109.982 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -37.86 150.54 0.17 Allowed Pre-proline 0 CA--C 1.535 0.387 0 CA-C-N 116.257 -0.428 . . . . 1.0 110.831 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.93 156.77 64.3 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 122.478 2.118 . . . . 1.0 112.252 -179.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 1336 ' ' GLN . . . . . 0.485 ' H ' HD22 ' A' 1272 ' ' LEU . 99.2 mm-40 . . . . . 0 C--N 1.331 -0.205 0 CA-C-N 115.927 -0.579 . . . . 1.0 110.926 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 55.7 mtmt . . . . . 0 N--CA 1.46 0.048 0 N-CA-C 111.628 0.233 . . . . 1.0 111.628 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A 1263 ' ' SER . . . . . . . . . . . . . 45.5 m -58.82 -38.51 78.81 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.71 -0.396 . . . . 1.0 110.419 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -63.37 -47.45 82.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.955 -0.566 . . . . 1.0 111.386 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1265 ' ' LEU . . . . . 0.425 ' CD1' ' OH ' ' A' 1284 ' ' TYR . 91.7 mt -64.23 -42.59 96.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.526 -0.306 . . . . 1.0 111.099 -179.449 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -63.67 -42.8 98.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.327 -0.397 . . . . 1.0 110.908 -179.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -65.85 -39.68 90.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.813 0.34 . . . . 1.0 110.54 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1268 ' ' CYS . . . . . . . . . . . . . 95.4 m -62.82 -34.83 78.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.984 -0.553 . . . . 1.0 111.062 -179.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 77.5 m -54.83 -40.21 69.36 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.773 -0.371 . . . . 1.0 110.738 -179.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1270 ' ' LEU . . . . . 0.499 HD22 ' N ' ' A' 1270 ' ' LEU . 4.0 mm? -65.02 -39.96 94.15 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.079 -0.509 . . . . 1.0 111.241 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1271 ' ' THR . . . . . . . . . . . . . 80.4 p -63.88 -31.96 73.33 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.83 0.307 . . . . 1.0 111.83 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 71.8 mt -77.19 86.14 3.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.618 0.246 . . . . 1.0 111.056 -179.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -120.02 131.81 55.26 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 120.753 0.311 . . . . 1.0 111.07 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1274 ' ' THR . . . . . . . . . . . . . 9.3 m -128.54 139.68 52.18 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 109.176 -0.676 . . . . 1.0 109.176 178.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -107.85 133.01 52.83 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.208 0.528 . . . . 1.0 111.048 -179.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 80.85 5.17 90.24 Favored Glycine 0 CA--C 1.527 0.797 0 CA-C-N 115.705 -0.679 . . . . 1.0 112.474 178.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 43.3 mtpt -139.95 -174.24 3.86 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.614 0.721 . . . . 1.0 112.054 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -99.01 108.84 51.54 Favored Pre-proline 0 CA--C 1.538 0.491 0 CA-C-N 114.752 -1.113 . . . . 1.0 109.946 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -80.86 113.7 2.81 Favored 'Trans proline' 0 N--CA 1.496 1.668 0 C-N-CA 122.0 1.8 . . . . 1.0 112.798 -179.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -83.21 148.88 27.16 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.867 -0.606 . . . . 1.0 109.956 179.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 3.0 mt -140.85 132.41 13.89 Favored Pre-proline 0 CA--C 1.538 0.498 0 N-CA-C 109.303 -0.628 . . . . 1.0 109.303 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -55.2 139.08 80.62 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 CA-C-N 120.787 1.317 . . . . 1.0 110.983 178.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 97.0 mt -126.35 147.96 49.66 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.474 -0.33 . . . . 1.0 110.242 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1284 ' ' TYR . . . . . 0.425 ' OH ' ' CD1' ' A' 1265 ' ' LEU . 36.0 m-85 -78.0 142.79 38.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.094 -0.503 . . . . 1.0 111.132 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 65.0 tttm -145.23 106.64 4.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.472 -0.785 . . . . 1.0 109.49 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1286 ' ' THR . . . . . . . . . . . . . 41.5 m -69.41 133.93 48.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.062 -0.517 . . . . 1.0 111.267 -179.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 67.6 mt -81.23 -172.48 3.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.908 -0.587 . . . . 1.0 110.081 179.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 91.6 mm-40 -109.22 140.91 42.23 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.053 -0.521 . . . . 1.0 110.032 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1289 ' ' THR . . . . . . . . . . . . . 30.1 p -99.35 114.98 28.16 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.166 -0.47 . . . . 1.0 111.085 -179.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1290 ' ' VAL . . . . . 0.476 ' O ' HG23 ' A' 1290 ' ' VAL . 28.0 m -133.09 122.3 45.44 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 N-CA-C 109.927 -0.397 . . . . 1.0 109.927 178.455 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -143.62 167.51 26.61 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 111.056 -0.817 . . . . 1.0 111.056 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.47 -49.5 0.6 Allowed 'Trans proline' 0 C--N 1.308 -1.596 0 C-N-CA 122.688 2.259 . . . . 1.0 111.214 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1293 ' ' SER . . . . . . . . . . . . . 14.8 t -88.52 164.33 15.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.483 -0.781 . . . . 1.0 110.544 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 40.0 m80 -59.5 -11.35 4.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.315 -0.402 . . . . 1.0 110.416 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -67.14 143.28 56.71 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.544 -0.539 . . . . 1.0 109.544 179.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -127.73 149.01 50.42 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.141 0.496 . . . . 1.0 111.69 -178.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1297 ' ' THR . . . . . . . . . . . . . 88.8 m -121.72 122.0 38.56 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.461 -0.79 . . . . 1.0 109.064 178.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -94.34 126.11 39.39 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.189 0.518 . . . . 1.0 111.212 -179.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1299 ' ' THR . . . . . . . . . . . . . 91.1 m -127.24 130.63 49.98 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.765 -0.652 . . . . 1.0 110.17 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 55.4 t -120.84 130.39 74.67 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 N-CA-C 110.078 -0.341 . . . . 1.0 110.078 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -130.56 145.27 51.84 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.127 -0.488 . . . . 1.0 110.616 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 18.7 t -107.82 128.69 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 N-CA-C 109.432 -0.581 . . . . 1.0 109.432 179.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -106.96 137.65 44.62 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.469 -0.332 . . . . 1.0 110.989 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1304 ' ' PHE . . . . . 0.496 ' O ' ' N ' ' A' 1307 ' ' GLU . 50.6 t80 -139.34 119.33 13.45 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.334 -0.394 . . . . 1.0 110.168 179.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1305 ' ' LYS . . . . . 0.412 ' NZ ' ' OE1' ' A' 1336 ' ' GLN . 51.8 mttp 39.51 39.34 0.48 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.367 -0.379 . . . . 1.0 111.566 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 79.09 20.37 70.24 Favored Glycine 0 CA--C 1.528 0.852 0 C-N-CA 121.127 -0.559 . . . . 1.0 112.221 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1307 ' ' GLU . . . . . 0.496 ' N ' ' O ' ' A' 1304 ' ' PHE . 98.1 mt-10 -125.98 147.79 49.43 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.81 0.338 . . . . 1.0 110.309 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 57.1 ttp180 -91.59 126.15 36.58 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.039 -0.528 . . . . 1.0 110.106 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 45.0 pt -132.38 16.37 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-N 116.461 -0.336 . . . . 1.0 110.856 -179.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -157.47 151.63 22.89 Favored Glycine 0 CA--C 1.523 0.574 0 N-CA-C 111.084 -0.806 . . . . 1.0 111.084 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 30.3 p -173.6 138.5 0.67 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.725 0.298 . . . . 1.0 110.445 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . 179.27 162.01 27.75 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.979 -0.849 . . . . 1.0 110.979 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 59.8 mttp -141.93 142.66 33.03 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.735 0.302 . . . . 1.0 110.341 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -164.11 -178.87 37.97 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 110.701 -0.96 . . . . 1.0 110.701 179.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -63.65 -70.79 0.03 OUTLIER 'Trans proline' 0 C--N 1.311 -1.435 0 C-N-CA 121.689 1.593 . . . . 1.0 111.237 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1316 ' ' SER . . . . . . . . . . . . . 4.9 p -90.06 171.57 9.45 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.049 -0.523 . . . . 1.0 110.402 179.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 39.2 mm -64.19 -42.99 97.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.821 -0.627 . . . . 1.0 110.413 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -53.2 -42.0 65.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.776 -0.647 . . . . 1.0 111.833 -178.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 13.8 mp0 -67.3 -40.46 86.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.698 0.285 . . . . 1.0 110.459 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -65.69 -37.81 87.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.225 -0.443 . . . . 1.0 111.455 -179.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -65.92 -38.37 88.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.382 -0.372 . . . . 1.0 111.84 -178.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1322 ' ' MET . . . . . . . . . . . . . 61.6 mtt -62.3 -43.62 98.39 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.865 -0.334 . . . . 1.0 111.403 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -67.7 -40.2 90.16 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 111.634 -0.586 . . . . 1.0 111.634 -179.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -65.94 -38.78 89.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.678 0.275 . . . . 1.0 111.618 -179.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -65.82 -39.63 91.05 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.34 0.496 . . . . 1.0 112.34 -178.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1326 ' ' MET . . . . . . . . . . . . . 8.3 ttt -63.08 -38.83 92.76 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.76 -0.376 . . . . 1.0 110.824 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 56.7 m-20 -64.76 -31.93 73.38 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.203 -0.453 . . . . 1.0 110.645 -179.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1328 ' ' ALA . . . . . 0.545 ' O ' ' CD2' ' A' 1332 ' ' TYR . . . -57.31 -26.59 61.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.584 -0.28 . . . . 1.0 111.475 -179.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1329 ' ' LEU . . . . . 0.489 HD22 ' N ' ' A' 1329 ' ' LEU . 3.7 mm? -61.72 -41.95 98.3 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.84 -0.344 . . . . 1.0 110.946 -179.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -93.16 14.22 18.71 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 121.062 -0.255 . . . . 1.0 111.113 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 64.9 mttm -135.52 42.28 2.7 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 120.685 -0.406 . . . . 1.0 111.706 -178.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1332 ' ' TYR . . . . . 0.545 ' CD2' ' O ' ' A' 1328 ' ' ALA . 8.7 m-85 -108.7 145.5 34.94 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.303 0.573 . . . . 1.0 110.712 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 15.9 m120 -127.08 -176.07 3.61 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.209 -0.905 . . . . 1.0 109.404 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -41.26 141.04 1.13 Allowed Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 121.075 -0.25 . . . . 1.0 110.766 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -75.77 172.64 15.91 Favored 'Trans proline' 0 N--CA 1.498 1.739 0 C-N-CA 122.72 2.28 . . . . 1.0 112.245 179.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 1336 ' ' GLN . . . . . 0.412 ' OE1' ' NZ ' ' A' 1305 ' ' LYS . 14.0 mm100 . . . . . 0 C--N 1.331 -0.223 0 N-CA-C 109.782 -0.451 . . . . 1.0 109.782 179.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 98.8 mttt . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.915 0.388 . . . . 1.0 110.536 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A 1263 ' ' SER . . . . . . . . . . . . . 51.0 m -58.92 -36.88 75.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.134 -0.485 . . . . 1.0 110.616 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 14.3 mp0 -61.15 -42.68 98.99 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.819 -0.352 . . . . 1.0 110.265 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1265 ' ' LEU . . . . . 0.419 ' CD2' ' OH ' ' A' 1332 ' ' TYR . 83.4 mt -62.89 -41.52 99.44 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.742 -0.383 . . . . 1.0 110.031 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -63.82 -43.23 96.85 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.801 -0.36 . . . . 1.0 110.798 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -65.32 -39.52 92.56 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.854 0.359 . . . . 1.0 110.819 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1268 ' ' CYS . . . . . . . . . . . . . 88.5 m -64.5 -37.36 87.26 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.016 -0.538 . . . . 1.0 111.178 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 70.9 m -51.14 -41.38 60.06 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 120.55 -0.46 . . . . 1.0 110.865 -178.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1270 ' ' LEU . . . . . 0.523 HD22 ' N ' ' A' 1270 ' ' LEU . 3.6 mm? -64.39 -41.25 96.77 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.809 0.338 . . . . 1.0 110.801 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1271 ' ' THR . . . . . . . . . . . . . 48.0 p -66.56 -30.19 70.43 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.276 -0.42 . . . . 1.0 111.477 -179.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 92.5 mt -76.34 102.67 6.0 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.435 -0.506 . . . . 1.0 110.725 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 78.3 mtp85 -119.96 142.64 48.57 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.126 -0.488 . . . . 1.0 109.913 179.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1274 ' ' THR . . . . . . . . . . . . . 8.4 m -113.67 128.02 56.27 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 120.808 0.337 . . . . 1.0 110.188 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -129.54 112.06 13.37 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.408 -0.36 . . . . 1.0 110.861 -179.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 74.03 24.63 73.34 Favored Glycine 0 CA--C 1.527 0.823 0 CA-C-N 115.98 -0.555 . . . . 1.0 112.203 178.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 4.1 mtpp -136.58 -163.48 1.42 Allowed 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.335 0.588 . . . . 1.0 110.61 -179.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -95.11 108.24 37.19 Favored Pre-proline 0 CA--C 1.541 0.623 0 CA-C-N 114.865 -1.061 . . . . 1.0 109.277 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1279 ' ' PRO . . . . . 0.437 ' O ' ' OD1' ' A' 1280 ' ' ASP . 50.4 Cg_exo -49.79 122.84 9.63 Favored 'Trans proline' 0 N--CA 1.494 1.524 0 C-N-CA 121.506 1.471 . . . . 1.0 112.657 -179.326 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1280 ' ' ASP . . . . . 0.437 ' OD1' ' O ' ' A' 1279 ' ' PRO . 96.0 m-20 -143.82 124.26 13.94 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.656 -0.702 . . . . 1.0 109.392 178.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1281 ' ' ILE . . . . . 0.462 ' N ' HD12 ' A' 1281 ' ' ILE . 1.5 mp -137.77 135.57 19.09 Favored Pre-proline 0 CA--C 1.541 0.605 0 CA-C-N 116.242 -0.436 . . . . 1.0 110.424 -178.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -54.77 139.65 77.62 Favored 'Trans proline' 0 N--CA 1.496 1.64 0 CA-C-N 120.345 1.159 . . . . 1.0 111.213 178.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 87.4 mt -138.46 153.81 48.83 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.231 -0.44 . . . . 1.0 110.157 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1284 ' ' TYR . . . . . . . . . . . . . 81.9 m-85 -81.66 136.04 35.51 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.438 -0.346 . . . . 1.0 110.814 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 12.3 ttmm -138.83 126.02 21.42 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.204 -0.453 . . . . 1.0 109.869 178.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1286 ' ' THR . . . . . . . . . . . . . 92.3 m -99.15 125.7 44.76 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.967 0.413 . . . . 1.0 110.428 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 82.0 mt -77.54 -169.7 1.54 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.626 -0.716 . . . . 1.0 110.419 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -107.93 141.19 39.93 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.449 -0.341 . . . . 1.0 110.466 -179.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1289 ' ' THR . . . . . . . . . . . . . 16.9 p -87.84 114.47 24.49 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.082 -0.508 . . . . 1.0 110.858 -179.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 17.4 m -131.71 122.1 49.08 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-O 120.968 0.413 . . . . 1.0 110.38 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -144.52 157.71 27.3 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 110.569 -1.013 . . . . 1.0 110.569 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.74 -38.51 7.74 Favored 'Trans proline' 0 C--N 1.308 -1.563 0 C-N-CA 121.886 1.724 . . . . 1.0 110.691 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1293 ' ' SER . . . . . . . . . . . . . 26.7 t -92.74 165.22 13.05 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.503 -0.771 . . . . 1.0 110.211 179.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 78.9 m80 -57.61 -12.93 3.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.055 0.455 . . . . 1.0 109.839 179.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -63.37 145.16 56.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.805 -0.634 . . . . 1.0 110.554 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -128.41 140.13 52.0 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.03 0.443 . . . . 1.0 110.958 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1297 ' ' THR . . . . . . . . . . . . . 80.6 m -123.03 130.25 52.55 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.789 -0.642 . . . . 1.0 109.648 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 92.7 m-85 -100.07 131.46 46.01 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.148 0.499 . . . . 1.0 111.331 -178.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1299 ' ' THR . . . . . . . . . . . . . 90.1 m -127.42 131.91 50.18 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.61 -0.723 . . . . 1.0 110.017 179.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 55.8 t -118.42 129.48 74.66 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 109.963 -0.384 . . . . 1.0 109.963 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -129.69 144.42 51.28 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.09 -0.505 . . . . 1.0 110.589 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 24.3 t -111.61 128.24 68.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 N-CA-C 109.015 -0.735 . . . . 1.0 109.015 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -106.95 139.98 40.48 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.22 0.533 . . . . 1.0 111.622 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 75.5 t80 -140.99 106.64 5.1 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.429 -0.805 . . . . 1.0 110.118 179.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 55.6 mtpt 50.19 34.35 8.49 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.806 0.336 . . . . 1.0 110.736 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 83.81 18.71 62.95 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 121.343 -0.456 . . . . 1.0 111.994 179.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -121.68 144.07 48.98 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 109.887 -0.412 . . . . 1.0 109.887 179.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1308 ' ' ARG . . . . . 0.51 ' NE ' ' O ' ' A' 1310 ' ' GLY . 75.5 ttt180 -96.84 122.06 39.4 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.84 0.352 . . . . 1.0 110.144 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 35.4 pt -118.48 22.93 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-N 116.149 -0.478 . . . . 1.0 110.66 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1310 ' ' GLY . . . . . 0.51 ' O ' ' NE ' ' A' 1308 ' ' ARG . . . -159.38 153.99 25.05 Favored Glycine 0 CA--C 1.524 0.609 0 N-CA-C 110.659 -0.977 . . . . 1.0 110.659 179.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 8.7 p -174.17 121.42 0.29 Allowed 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.712 -0.395 . . . . 1.0 111.068 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -174.33 168.28 40.96 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.945 -0.862 . . . . 1.0 110.945 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 61.7 mttp -138.95 149.41 44.73 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.918 0.389 . . . . 1.0 110.607 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -169.06 167.74 40.69 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.438 -1.065 . . . . 1.0 110.438 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.67 -53.74 0.42 Allowed 'Trans proline' 0 C--N 1.307 -1.654 0 C-N-CA 122.449 2.099 . . . . 1.0 111.545 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1316 ' ' SER . . . . . . . . . . . . . 82.6 p -97.08 161.47 13.81 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.111 0.481 . . . . 1.0 110.98 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 40.3 mm -67.12 -42.6 88.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.655 -0.702 . . . . 1.0 111.317 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -53.06 -47.08 68.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.314 -0.403 . . . . 1.0 111.575 -178.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -67.29 -37.81 84.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.466 -0.333 . . . . 1.0 111.265 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -62.25 -37.5 85.69 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.251 -0.431 . . . . 1.0 111.202 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -67.15 -38.58 85.72 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.288 -0.415 . . . . 1.0 111.901 -179.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1322 ' ' MET . . . . . . . . . . . . . 57.2 mtt -61.59 -43.07 99.53 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.634 -0.426 . . . . 1.0 111.049 -179.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -63.92 -46.99 90.15 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.857 -0.897 . . . . 1.0 110.857 -179.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -65.14 -43.13 92.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.817 0.341 . . . . 1.0 110.561 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -68.29 -41.51 80.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.073 -0.512 . . . . 1.0 111.229 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1326 ' ' MET . . . . . . . . . . . . . 48.2 ttp -63.1 -43.68 97.81 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.011 0.434 . . . . 1.0 110.253 -179.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -68.9 -29.56 67.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.771 -0.65 . . . . 1.0 110.602 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1328 ' ' ALA . . . . . 0.53 ' O ' ' CD2' ' A' 1332 ' ' TYR . . . -59.63 -25.31 64.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.105 -0.498 . . . . 1.0 111.777 -178.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 96.2 mt -61.17 -41.52 96.93 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.943 -0.303 . . . . 1.0 110.967 -179.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -89.29 11.22 19.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.565 -0.289 . . . . 1.0 111.352 -178.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 64.1 mttm -129.52 40.69 3.56 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 112.084 0.402 . . . . 1.0 112.084 -178.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 1332 ' ' TYR . . . . . 0.53 ' CD2' ' O ' ' A' 1328 ' ' ALA . 16.0 m-85 -116.01 137.32 52.22 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 120.95 0.405 . . . . 1.0 110.298 179.202 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1333 ' ' ASN . . . . . 0.425 ' O ' ' C ' ' A' 1334 ' ' PHE . 97.1 m-20 -137.12 167.51 21.41 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.866 -0.607 . . . . 1.0 109.397 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1334 ' ' PHE . . . . . 0.425 ' C ' ' O ' ' A' 1333 ' ' ASN . 75.0 m-85 -30.68 94.06 0.06 OUTLIER Pre-proline 0 N--CA 1.47 0.532 0 O-C-N 123.518 0.511 . . . . 1.0 111.592 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1335 ' ' PRO . . . . . 0.436 ' O ' ' O ' ' A' 1336 ' ' GLN . 44.5 Cg_endo -91.4 -163.98 0.13 Allowed 'Trans proline' 0 N--CA 1.488 1.159 0 C-N-CA 122.942 2.428 . . . . 1.0 112.431 -179.086 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 1336 ' ' GLN . . . . . 0.436 ' O ' ' O ' ' A' 1335 ' ' PRO . 13.5 mm100 . . . . . 0 N--CA 1.465 0.305 0 CA-C-N 115.817 -0.629 . . . . 1.0 110.793 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1259 ' ' ASN . . . . . . . . . . . . . 94.9 m-20 . . . . . 0 N--CA 1.489 1.514 0 N-CA-C 109.461 -0.57 . . . . 1.0 109.461 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A 1260 ' ' ASP . . . . . 0.652 ' H ' ' CD ' ' A' 1261 ' ' PRO . 0.7 OUTLIER -172.71 -40.83 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.294 0 CA-C-N 116.286 -0.416 . . . . 1.0 110.946 179.557 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 1261 ' ' PRO . . . . . 0.652 ' CD ' ' H ' ' A' 1260 ' ' ASP . 15.8 Cg_exo -67.41 153.97 75.21 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 C-N-CA 122.401 2.067 . . . . 1.0 111.782 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 34.6 tptt -60.92 138.56 58.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.01 0.433 . . . . 1.0 110.423 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1263 ' ' SER . . . . . . . . . . . . . 68.3 m -57.5 -41.39 80.7 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.706 -0.679 . . . . 1.0 111.112 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 25.0 mp0 -58.97 -43.99 91.46 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.703 -0.399 . . . . 1.0 110.209 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1265 ' ' LEU . . . . . 0.482 ' CD2' ' OH ' ' A' 1332 ' ' TYR . 36.9 mt -63.61 -41.95 98.27 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 1.0 110.505 179.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -63.46 -44.73 93.63 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.346 -0.388 . . . . 1.0 110.718 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -64.02 -39.76 94.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.127 -0.488 . . . . 1.0 110.689 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1268 ' ' CYS . . . . . . . . . . . . . 98.3 m -64.92 -35.74 82.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.02 -0.536 . . . . 1.0 110.859 -179.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 79.1 m -60.44 -37.51 81.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.443 -0.344 . . . . 1.0 110.771 -179.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 89.1 mt -63.86 -39.31 93.9 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.214 -0.448 . . . . 1.0 111.106 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1271 ' ' THR . . . . . . . . . . . . . 68.7 p -65.06 -30.06 71.0 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.504 -0.316 . . . . 1.0 111.478 -179.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 77.6 mt -77.67 84.48 4.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.496 -0.32 . . . . 1.0 111.492 -178.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -119.74 130.09 54.81 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 110.139 -0.319 . . . . 1.0 110.139 178.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1274 ' ' THR . . . . . . . . . . . . . 21.4 m -129.65 133.4 47.09 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 120.773 0.32 . . . . 1.0 110.434 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 39.9 tp10 -111.54 142.72 43.47 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.356 -0.384 . . . . 1.0 110.202 179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 88.2 7.11 73.82 Favored Glycine 0 CA--C 1.527 0.815 0 N-CA-C 111.201 -0.76 . . . . 1.0 111.201 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 49.4 mtpt -138.63 -164.71 1.69 Allowed 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 110.239 -0.282 . . . . 1.0 110.239 179.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -92.43 151.05 41.01 Favored Pre-proline 0 CA--C 1.531 0.238 0 N-CA-C 109.87 -0.418 . . . . 1.0 109.87 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -70.09 76.13 1.29 Allowed 'Trans proline' 0 N--CA 1.495 1.59 0 C-N-CA 122.278 1.986 . . . . 1.0 112.22 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 99.4 m-20 -90.83 121.5 32.75 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 109.815 -0.439 . . . . 1.0 109.815 179.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 13.1 mt -148.67 133.51 9.12 Favored Pre-proline 0 CA--C 1.535 0.398 0 N-CA-C 109.953 -0.388 . . . . 1.0 109.953 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.09 111.82 3.27 Favored 'Trans proline' 0 N--CA 1.495 1.597 0 C-N-CA 121.323 1.349 . . . . 1.0 111.514 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 89.5 mt -121.59 154.47 36.69 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.033 0.444 . . . . 1.0 110.867 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1284 ' ' TYR . . . . . 0.443 ' CE1' HD13 ' A' 1265 ' ' LEU . 4.2 m-85 -79.0 140.45 37.97 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.876 -0.602 . . . . 1.0 110.892 -179.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 79.7 tttt -145.97 115.13 7.04 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.515 -0.766 . . . . 1.0 109.575 179.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 27.2 m -63.83 131.88 49.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.843 0.354 . . . . 1.0 110.686 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 72.8 mt -87.74 -172.2 3.77 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.046 -0.525 . . . . 1.0 110.302 -179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -107.67 137.61 45.39 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.285 -0.416 . . . . 1.0 110.052 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1289 ' ' THR . . . . . . . . . . . . . 19.0 p -75.49 115.95 15.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.095 -0.502 . . . . 1.0 111.286 -178.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 16.6 m -136.11 122.15 30.31 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-N 116.051 -0.522 . . . . 1.0 109.836 178.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.86 159.25 27.33 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 110.947 -0.861 . . . . 1.0 110.947 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -63.67 -38.91 37.71 Favored 'Trans proline' 0 C--N 1.308 -1.593 0 C-N-CA 122.371 2.047 . . . . 1.0 111.132 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1293 ' ' SER . . . . . . . . . . . . . 14.3 t -91.86 165.13 13.4 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.728 -0.669 . . . . 1.0 110.55 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -61.38 -9.5 5.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.172 0.511 . . . . 1.0 109.75 179.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -62.91 144.98 56.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.481 -0.782 . . . . 1.0 111.11 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -103.01 130.35 50.08 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.097 -0.501 . . . . 1.0 110.685 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1297 ' ' THR . . . . . . . . . . . . . 92.3 m -125.92 127.65 46.33 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.923 -0.58 . . . . 1.0 110.093 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -101.44 127.2 48.21 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.001 0.429 . . . . 1.0 110.819 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1299 ' ' THR . . . . . . . . . . . . . 64.0 m -127.56 130.56 49.3 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.86 -0.609 . . . . 1.0 110.313 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 54.3 t -116.77 128.0 74.26 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 N-CA-C 109.139 -0.689 . . . . 1.0 109.139 179.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -130.49 142.35 50.49 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 121.13 0.49 . . . . 1.0 111.657 -179.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 2.7 t -112.28 127.43 69.49 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 N-CA-C 108.801 -0.814 . . . . 1.0 108.801 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -115.98 139.54 50.15 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.146 0.498 . . . . 1.0 111.449 -178.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 52.7 t80 -128.38 102.31 6.59 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.6 -0.727 . . . . 1.0 110.212 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 64.4 mttp 47.01 36.58 4.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.108 -0.497 . . . . 1.0 111.05 179.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 90.99 4.34 69.22 Favored Glycine 0 CA--C 1.527 0.815 0 N-CA-C 111.946 -0.462 . . . . 1.0 111.946 179.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -110.05 119.77 40.36 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 120.992 0.425 . . . . 1.0 110.356 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 62.0 ttp180 -76.08 136.43 39.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.931 -0.577 . . . . 1.0 110.634 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 42.1 pt -138.56 20.17 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-N 116.36 -0.382 . . . . 1.0 110.169 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -151.03 148.35 19.37 Favored Glycine 0 CA--C 1.523 0.587 0 N-CA-C 111.062 -0.815 . . . . 1.0 111.062 -179.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 25.0 p -171.35 116.37 0.42 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.804 0.335 . . . . 1.0 110.185 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -175.57 131.05 1.83 Allowed Glycine 0 CA--C 1.523 0.583 0 N-CA-C 111.018 -0.833 . . . . 1.0 111.018 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 68.8 mttm -109.95 146.0 35.97 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.778 0.323 . . . . 1.0 110.373 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -167.16 173.2 42.36 Favored Glycine 0 CA--C 1.524 0.634 0 N-CA-C 111.139 -0.785 . . . . 1.0 111.139 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -69.41 -75.08 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.677 0 C-N-CA 122.592 2.195 . . . . 1.0 111.918 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1316 ' ' SER . . . . . . . . . . . . . 95.5 p -79.0 158.2 27.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.926 0.393 . . . . 1.0 110.943 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 47.5 mm -63.88 -44.66 98.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.0 -0.545 . . . . 1.0 111.209 -179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -54.48 -46.34 73.38 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.536 -0.302 . . . . 1.0 111.125 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -62.89 -38.77 92.24 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.842 -0.343 . . . . 1.0 110.865 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -64.63 -38.49 91.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.425 -0.352 . . . . 1.0 111.08 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1321 ' ' GLU . . . . . 0.413 ' O ' ' HB2' ' A' 1325 ' ' ALA . 98.2 mt-10 -66.41 -36.46 82.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.299 -0.41 . . . . 1.0 111.404 -179.381 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1322 ' ' MET . . . . . . . . . . . . . 95.1 mmm -62.74 -42.65 99.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.323 -0.399 . . . . 1.0 111.469 -179.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -66.7 -49.68 53.69 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 120.711 -0.757 . . . . 1.0 111.528 -179.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -70.27 -36.22 74.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.792 0.329 . . . . 1.0 111.534 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1325 ' ' ALA . . . . . 0.413 ' HB2' ' O ' ' A' 1321 ' ' GLU . . . -56.01 -50.27 71.33 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.23 -0.441 . . . . 1.0 111.729 -178.547 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1326 ' ' MET . . . . . . . . . . . . . 66.4 mtt -65.57 -38.56 89.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.744 0.307 . . . . 1.0 111.484 -179.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -63.52 -36.98 85.58 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.348 -0.387 . . . . 1.0 111.549 -179.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1328 ' ' ALA . . . . . 0.524 ' O ' ' CD2' ' A' 1332 ' ' TYR . . . -58.69 -25.76 63.19 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.188 0.44 . . . . 1.0 112.188 -178.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 1.9 mm? -62.05 -41.45 98.14 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.679 -0.408 . . . . 1.0 111.148 -179.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -93.62 4.57 53.75 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.142 0.423 . . . . 1.0 112.142 -178.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 67.5 mttm -117.7 20.65 13.35 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.269 0.47 . . . . 1.0 112.269 -178.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1332 ' ' TYR . . . . . 0.524 ' CD2' ' O ' ' A' 1328 ' ' ALA . 11.4 m-85 -83.54 137.76 33.71 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.122 0.487 . . . . 1.0 110.502 179.249 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -117.33 -175.98 2.91 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.521 -0.763 . . . . 1.0 110.17 179.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 53.8 m-85 -34.99 151.05 0.07 OUTLIER Pre-proline 0 CA--C 1.538 0.484 0 CA-C-N 115.977 -0.556 . . . . 1.0 111.115 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -69.61 -178.9 2.5 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 C-N-CA 122.419 2.079 . . . . 1.0 112.133 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1336 ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -38.1 100.83 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.175 0 CA-C-O 121.168 0.509 . . . . 1.0 111.205 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 1337 ' ' MET . . . . . . . . . . . . . 27.7 ttt . . . . . 0 C--O 1.219 -0.52 0 CA-C-O 117.978 -1.011 . . . . 1.0 110.56 -179.836 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A 1259 ' ' ASN . . . . . . . . . . . . . 24.7 m120 . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 109.481 -0.563 . . . . 1.0 109.481 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A 1260 ' ' ASP . . . . . 0.433 ' OD1' ' O ' ' A' 1260 ' ' ASP . 2.3 p30 41.75 59.23 9.5 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.025 -0.534 . . . . 1.0 111.037 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1261 ' ' PRO . . . . . 0.514 ' C ' ' H ' ' A' 1263 ' ' SER . 72.6 Cg_endo -72.99 141.3 32.86 Favored 'Trans proline' 0 C--N 1.308 -1.571 0 C-N-CA 122.575 2.184 . . . . 1.0 111.722 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 55.0 mtpt 47.38 9.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 1.0 111.156 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1263 ' ' SER . . . . . 0.514 ' H ' ' C ' ' A' 1261 ' ' PRO . 50.4 m -61.0 -42.66 98.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.891 0.376 . . . . 1.0 110.701 -179.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1264 ' ' GLN . . . . . 0.431 ' O ' ' SG ' ' A' 1268 ' ' CYS . 28.0 mm100 -65.08 -46.88 79.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.102 -0.499 . . . . 1.0 111.497 -179.451 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1265 ' ' LEU . . . . . . . . . . . . . 92.7 mt -64.66 -42.03 95.69 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.35 -0.386 . . . . 1.0 111.59 -179.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 -64.9 -43.54 92.52 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.47 -0.492 . . . . 1.0 110.575 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 17.5 mm100 -68.19 -38.61 82.18 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.087 -0.506 . . . . 1.0 110.944 179.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1268 ' ' CYS . . . . . 0.431 ' SG ' ' O ' ' A' 1264 ' ' GLN . 93.5 m -64.9 -36.48 84.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.45 -0.341 . . . . 1.0 111.047 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 84.0 m -56.5 -36.69 69.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.753 0.311 . . . . 1.0 110.839 -179.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 97.2 mt -63.25 -40.87 98.64 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.329 -0.396 . . . . 1.0 111.042 -179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1271 ' ' THR . . . . . 0.409 ' OG1' ' O ' ' A' 1268 ' ' CYS . 68.3 p -67.76 -26.31 66.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.195 -0.457 . . . . 1.0 111.369 -179.345 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 82.2 mt -85.68 86.65 7.35 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.823 0.344 . . . . 1.0 111.382 -178.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -119.19 117.98 30.09 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.071 -0.513 . . . . 1.0 110.112 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1274 ' ' THR . . . . . 0.427 ' OG1' ' OE1' ' A' 1336 ' ' GLN . 6.8 m -129.04 131.24 47.32 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 120.844 0.355 . . . . 1.0 110.268 179.666 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 86.2 tt0 -113.03 134.97 54.28 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.207 -0.451 . . . . 1.0 110.304 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 89.67 7.11 69.32 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 111.38 -0.688 . . . . 1.0 111.38 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 50.6 mtpt -138.41 -168.75 2.44 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.79 0.329 . . . . 1.0 110.613 179.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -93.38 136.02 24.77 Favored Pre-proline 0 CA--C 1.536 0.409 0 CA-C-N 116.11 -0.495 . . . . 1.0 110.104 -179.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -76.49 87.74 1.42 Allowed 'Trans proline' 0 N--CA 1.493 1.461 0 C-N-CA 121.869 1.713 . . . . 1.0 112.353 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1280 ' ' ASP . . . . . 0.48 ' OD2' ' NZ ' ' A' 1305 ' ' LYS . 78.3 m-20 -86.49 124.39 32.76 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.726 -0.472 . . . . 1.0 109.726 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1281 ' ' ILE . . . . . 0.426 HD13 HG21 ' A' 1281 ' ' ILE . 2.5 mt -148.02 124.08 5.34 Favored Pre-proline 0 CA--C 1.54 0.579 0 N-CA-C 109.972 -0.381 . . . . 1.0 109.972 -179.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 45.0 Cg_exo -51.79 131.44 37.97 Favored 'Trans proline' 0 N--CA 1.494 1.501 0 CA-C-N 120.246 1.123 . . . . 1.0 111.828 179.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 55.6 mt -134.74 152.49 51.8 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.028 -0.533 . . . . 1.0 109.871 179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1284 ' ' TYR . . . . . 0.465 ' CD1' ' OE1' ' A' 1321 ' ' GLU . 84.6 m-85 -78.46 137.8 38.14 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.043 0.449 . . . . 1.0 111.152 -179.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 85.7 tttt -139.01 104.81 5.13 Favored 'General case' 0 N--CA 1.462 0.175 0 N-CA-C 108.918 -0.771 . . . . 1.0 108.918 178.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 24.0 m -63.17 134.93 56.77 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.406 0.622 . . . . 1.0 112.174 -178.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 70.3 mt -87.0 -169.22 2.54 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.179 -0.919 . . . . 1.0 109.998 179.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 -106.44 136.88 45.43 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 109.593 -0.521 . . . . 1.0 109.593 179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1289 ' ' THR . . . . . . . . . . . . . 3.5 p -88.87 115.09 26.16 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.156 -0.475 . . . . 1.0 111.452 -178.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 7.1 m -133.55 123.56 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 121.034 0.445 . . . . 1.0 110.153 178.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.29 166.42 26.41 Favored Glycine 0 CA--C 1.524 0.644 0 N-CA-C 110.674 -0.97 . . . . 1.0 110.674 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -67.9 -42.89 5.73 Favored 'Trans proline' 0 C--N 1.306 -1.667 0 C-N-CA 122.467 2.112 . . . . 1.0 111.125 179.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1293 ' ' SER . . . . . . . . . . . . . 31.4 t -90.3 165.51 13.85 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.621 -0.718 . . . . 1.0 110.484 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -58.11 -14.49 6.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.281 -0.418 . . . . 1.0 110.207 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -65.92 142.0 58.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.922 -0.581 . . . . 1.0 110.72 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -110.53 145.19 38.19 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.211 -0.45 . . . . 1.0 110.837 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1297 ' ' THR . . . . . . . . . . . . . 94.9 m -116.25 124.31 49.88 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.264 -0.643 . . . . 1.0 109.264 178.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -96.37 119.83 35.58 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.057 0.456 . . . . 1.0 110.786 -179.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1299 ' ' THR . . . . . . . . . . . . . 88.8 m -127.35 127.97 45.11 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.777 -0.647 . . . . 1.0 110.321 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1300 ' ' VAL . . . . . 0.548 HG11 ' OE2' ' A' 1321 ' ' GLU . 25.3 t -118.26 128.43 75.28 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 N-CA-C 109.58 -0.526 . . . . 1.0 109.58 179.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -130.69 148.7 52.51 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.3 -0.409 . . . . 1.0 110.228 179.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 3.0 t -105.91 125.95 61.37 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 N-CA-C 109.54 -0.541 . . . . 1.0 109.54 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -107.3 129.0 54.94 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.904 0.383 . . . . 1.0 110.878 -179.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 88.7 t80 -139.08 119.73 14.1 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 115.886 -0.597 . . . . 1.0 109.698 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1305 ' ' LYS . . . . . 0.48 ' NZ ' ' OD2' ' A' 1280 ' ' ASP . 72.7 mmtt 49.25 32.51 4.38 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.388 -0.369 . . . . 1.0 110.115 -179.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 78.35 21.48 69.89 Favored Glycine 0 CA--C 1.526 0.74 0 C-N-CA 121.076 -0.583 . . . . 1.0 111.816 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -121.08 130.86 53.94 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 116.987 0.393 . . . . 1.0 110.865 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 44.5 ttm180 -87.44 90.92 8.55 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 109.241 -0.651 . . . . 1.0 109.241 179.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 34.7 pt -81.35 -17.29 12.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 112.715 0.635 . . . . 1.0 112.715 -178.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -147.51 156.8 27.14 Favored Glycine 0 CA--C 1.525 0.669 0 C-N-CA 120.389 -0.91 . . . . 1.0 112.089 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 2.6 p -177.0 144.5 0.44 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.395 -0.403 . . . . 1.0 109.99 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -165.57 158.86 31.9 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 111.093 -0.803 . . . . 1.0 111.093 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 68.2 mttm -129.02 141.2 51.32 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.678 0.275 . . . . 1.0 110.269 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -164.33 -179.76 38.68 Favored Glycine 0 CA--C 1.526 0.76 0 N-CA-C 110.812 -0.915 . . . . 1.0 110.812 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -58.93 -59.82 0.42 Allowed 'Trans proline' 0 N--CA 1.494 1.521 0 C-N-CA 122.132 1.888 . . . . 1.0 112.017 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1316 ' ' SER . . . . . 0.438 ' OG ' ' OE1' ' A' 1319 ' ' GLN . 6.5 p -103.33 168.97 8.82 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.114 -0.494 . . . . 1.0 110.658 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 43.4 mt -67.05 -41.54 87.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.874 -0.603 . . . . 1.0 110.955 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -51.57 -41.41 61.12 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.463 -0.335 . . . . 1.0 111.215 -178.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1319 ' ' GLN . . . . . 0.438 ' OE1' ' OG ' ' A' 1316 ' ' SER . 7.3 mp0 -64.54 -39.77 94.36 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.753 -0.379 . . . . 1.0 110.052 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -65.88 -37.4 86.04 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.169 -0.469 . . . . 1.0 110.99 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1321 ' ' GLU . . . . . 0.548 ' OE2' HG11 ' A' 1300 ' ' VAL . 80.5 mm-40 -61.08 -50.22 74.16 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.452 -0.34 . . . . 1.0 110.862 -179.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1322 ' ' MET . . . . . . . . . . . . . 63.7 mtm -66.51 -38.95 88.33 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.137 -0.483 . . . . 1.0 111.553 -179.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -62.42 -48.28 83.29 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.891 -0.884 . . . . 1.0 110.891 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -66.12 -35.33 80.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.926 0.393 . . . . 1.0 110.601 179.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -57.69 -48.64 78.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.903 -0.589 . . . . 1.0 112.031 -179.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1326 ' ' MET . . . . . . . . . . . . . 93.8 mmm -63.67 -40.57 97.17 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.809 -0.356 . . . . 1.0 111.598 -179.014 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -67.7 -28.79 67.97 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.731 0.3 . . . . 1.0 111.173 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1328 ' ' ALA . . . . . . . . . . . . . . . -62.04 -35.45 78.63 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.414 0.524 . . . . 1.0 112.414 -178.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 3.7 mm? -60.93 -40.47 93.35 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 120.923 -0.311 . . . . 1.0 111.329 -178.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -75.09 15.07 0.45 Allowed 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.258 0.466 . . . . 1.0 112.258 -178.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 97.0 mttt -146.24 45.39 1.24 Allowed 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 113.061 0.763 . . . . 1.0 113.061 -178.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1332 ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -101.96 153.32 19.99 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.145 0.497 . . . . 1.0 110.342 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 9.1 m120 -127.74 -177.47 4.12 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.508 -0.769 . . . . 1.0 110.629 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 1334 ' ' PHE . . . . . 0.477 ' O ' ' O ' ' A' 1335 ' ' PRO . 61.7 m-85 -42.48 153.98 0.29 Allowed Pre-proline 0 CA--C 1.534 0.355 0 CA-C-N 115.815 -0.63 . . . . 1.0 110.662 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1335 ' ' PRO . . . . . 0.477 ' O ' ' O ' ' A' 1334 ' ' PHE . 77.3 Cg_exo -39.73 174.77 0.0 OUTLIER 'Trans proline' 0 N--CA 1.496 1.66 0 C-N-CA 122.826 2.351 . . . . 1.0 113.56 179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1336 ' ' GLN . . . . . 0.427 ' OE1' ' OG1' ' A' 1274 ' ' THR . 11.2 mt-30 -36.89 117.49 0.51 Allowed 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.382 -0.826 . . . . 1.0 110.99 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 1337 ' ' MET . . . . . . . . . . . . . 27.3 ttt . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 117.989 -1.005 . . . . 1.0 110.677 -179.524 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A 1259 ' ' ASN . . . . . . . . . . . . . 54.5 t30 . . . . . 0 N--CA 1.491 1.62 0 N-CA-C 109.319 -0.622 . . . . 1.0 109.319 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A 1260 ' ' ASP . . . . . . . . . . . . . 47.1 t0 -173.07 63.62 0.3 Allowed Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.229 -0.441 . . . . 1.0 110.581 -179.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1261 ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -75.89 -95.14 0.01 OUTLIER 'Trans proline' 0 C--N 1.308 -1.591 0 C-N-CA 122.484 2.123 . . . . 1.0 112.366 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 87.7 mttt -92.01 1.99 56.84 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.975 0.417 . . . . 1.0 110.508 -179.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1263 ' ' SER . . . . . . . . . . . . . 35.9 m -59.16 -31.23 68.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.697 -0.683 . . . . 1.0 111.681 -179.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -56.75 -53.01 62.67 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.705 -0.398 . . . . 1.0 111.49 -178.376 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1265 ' ' LEU . . . . . 0.489 ' O ' ' SG ' ' A' 1269 ' ' CYS . 15.9 mt -67.87 -39.29 83.75 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.671 -0.411 . . . . 1.0 111.037 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 88.6 mt-30 -57.72 -43.9 85.61 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.543 -0.299 . . . . 1.0 111.175 -179.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 87.6 mt-30 -64.06 -42.48 97.0 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.502 -0.479 . . . . 1.0 110.522 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1268 ' ' CYS . . . . . . . . . . . . . 91.5 m -70.7 -36.59 73.33 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.176 -0.466 . . . . 1.0 110.936 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1269 ' ' CYS . . . . . 0.489 ' SG ' ' O ' ' A' 1265 ' ' LEU . 87.9 m -62.43 -35.23 78.62 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.092 -0.503 . . . . 1.0 112.018 -178.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 81.5 mt -61.96 -39.43 92.11 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.889 -0.324 . . . . 1.0 110.738 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1271 ' ' THR . . . . . . . . . . . . . 58.0 p -65.36 -29.19 69.89 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.969 -0.292 . . . . 1.0 111.15 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 87.2 mt -74.66 86.88 2.15 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.798 -0.361 . . . . 1.0 110.59 -179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 100.0 mtt180 -118.41 116.04 25.89 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.269 -0.423 . . . . 1.0 110.131 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1274 ' ' THR . . . . . . . . . . . . . 3.0 m -124.28 124.64 42.85 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.875 0.369 . . . . 1.0 110.162 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -112.71 138.18 49.91 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.024 -0.535 . . . . 1.0 110.194 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 90.38 0.62 76.23 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.677 -0.969 . . . . 1.0 110.677 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 21.5 mtpp -135.31 -167.5 2.02 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.11 0.481 . . . . 1.0 110.589 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -94.28 130.17 34.83 Favored Pre-proline 0 CA--C 1.536 0.423 0 CA-C-N 115.713 -0.676 . . . . 1.0 109.606 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -78.15 110.24 2.84 Favored 'Trans proline' 0 N--CA 1.493 1.466 0 C-N-CA 121.798 1.666 . . . . 1.0 112.683 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -104.24 129.73 52.04 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.887 -0.597 . . . . 1.0 109.584 178.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1281 ' ' ILE . . . . . 0.409 HG21 HD13 ' A' 1281 ' ' ILE . 4.8 mt -147.31 121.95 5.14 Favored Pre-proline 0 CA--C 1.54 0.571 0 CA-C-O 119.303 -0.38 . . . . 1.0 110.308 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -56.27 141.89 88.13 Favored 'Trans proline' 0 N--CA 1.494 1.532 0 CA-C-N 120.337 1.156 . . . . 1.0 111.129 178.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 89.9 mt -139.12 160.67 39.24 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 120.724 0.297 . . . . 1.0 110.393 -179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1284 ' ' TYR . . . . . 0.531 ' CD1' ' OE1' ' A' 1321 ' ' GLU . 62.8 m-85 -78.52 139.73 38.62 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 121.123 0.487 . . . . 1.0 111.46 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 36.1 ttmt -151.34 107.56 3.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.588 -0.733 . . . . 1.0 109.998 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 18.5 m -74.78 140.59 44.13 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.11 0.481 . . . . 1.0 111.063 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 73.3 mt -81.73 -169.93 2.58 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.637 -0.711 . . . . 1.0 110.672 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -107.08 136.4 47.0 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 115.9 -0.591 . . . . 1.0 109.561 179.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1289 ' ' THR . . . . . . . . . . . . . 57.3 p -83.27 115.05 21.8 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.982 0.42 . . . . 1.0 111.701 -178.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 9.4 m -143.9 122.19 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 115.682 -0.69 . . . . 1.0 109.449 178.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.46 172.37 24.33 Favored Glycine 0 CA--C 1.526 0.727 0 N-CA-C 111.113 -0.795 . . . . 1.0 111.113 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -72.14 -46.49 0.52 Allowed 'Trans proline' 0 C--N 1.307 -1.646 0 C-N-CA 122.494 2.129 . . . . 1.0 111.143 179.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1293 ' ' SER . . . . . . . . . . . . . 11.3 t -89.85 165.34 14.18 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.656 -0.702 . . . . 1.0 110.046 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 28.2 m170 -59.73 -18.96 46.9 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.621 -0.511 . . . . 1.0 109.621 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -59.76 144.15 49.07 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.812 -0.631 . . . . 1.0 109.963 179.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 85.2 mtm-85 -117.54 143.51 46.01 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.014 0.435 . . . . 1.0 111.038 -179.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1297 ' ' THR . . . . . . . . . . . . . 91.8 m -120.17 127.28 52.33 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.734 -0.666 . . . . 1.0 109.808 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -99.82 116.41 31.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.026 0.441 . . . . 1.0 110.721 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1299 ' ' THR . . . . . . . . . . . . . 91.8 m -127.11 130.31 49.6 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.743 -0.662 . . . . 1.0 110.092 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 83.2 t -111.44 129.86 66.01 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 N-CA-C 109.734 -0.469 . . . . 1.0 109.734 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -129.25 140.91 51.28 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 121.077 0.465 . . . . 1.0 110.93 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 43.7 t -113.25 128.36 70.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 N-CA-C 108.65 -0.87 . . . . 1.0 108.65 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -113.66 141.37 47.31 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.029 0.443 . . . . 1.0 110.934 -178.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 79.1 t80 -149.43 109.08 4.02 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.593 -0.731 . . . . 1.0 110.159 -179.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 49.87 30.07 3.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.281 -0.418 . . . . 1.0 110.808 179.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 86.04 1.97 86.33 Favored Glycine 0 CA--C 1.525 0.69 0 C-N-CA 121.317 -0.468 . . . . 1.0 112.06 178.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -106.5 115.95 31.09 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 110.132 -0.322 . . . . 1.0 110.132 179.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 42.9 ttm180 -72.52 130.16 40.0 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.466 . . . . 1.0 110.302 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 30.5 pt -122.46 23.23 4.41 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 CA-C-N 116.484 -0.325 . . . . 1.0 110.906 -179.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -155.96 153.28 24.62 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 111.354 -0.699 . . . . 1.0 111.354 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1311 ' ' CYS . . . . . 0.412 ' SG ' ' OD2' ' A' 1327 ' ' ASP . 31.3 p -167.65 164.23 14.51 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.21 -0.293 . . . . 1.0 110.21 179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . 121.92 157.64 10.07 Favored Glycine 0 N--CA 1.468 0.801 0 N-CA-C 110.939 -0.864 . . . . 1.0 110.939 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 68.6 mttm -129.61 151.3 50.37 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.93 0.395 . . . . 1.0 110.758 -179.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -159.49 163.72 33.64 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 110.434 -1.067 . . . . 1.0 110.434 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -64.58 -67.13 0.04 OUTLIER 'Trans proline' 0 C--N 1.307 -1.64 0 C-N-CA 122.408 2.072 . . . . 1.0 111.697 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1316 ' ' SER . . . . . . . . . . . . . 13.6 p -83.89 164.27 19.53 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.361 -0.381 . . . . 1.0 110.328 179.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 36.7 mm -65.29 -44.31 94.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.12 -0.491 . . . . 1.0 110.836 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -55.36 -42.99 74.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.085 -0.507 . . . . 1.0 111.712 -178.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -60.01 -41.75 92.83 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.593 -0.443 . . . . 1.0 110.708 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -68.55 -37.76 80.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.307 -0.406 . . . . 1.0 110.998 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1321 ' ' GLU . . . . . 0.531 ' OE1' ' CD1' ' A' 1284 ' ' TYR . 64.8 mm-40 -61.58 -45.35 94.51 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.305 -0.407 . . . . 1.0 111.821 -179.11 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1322 ' ' MET . . . . . 0.579 ' SD ' ' N ' ' A' 1322 ' ' MET . 0.1 OUTLIER -64.2 -41.08 97.23 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.805 -0.358 . . . . 1.0 111.366 -179.259 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -64.97 -43.39 95.98 Favored Glycine 0 CA--C 1.526 0.756 0 C-N-CA 120.799 -0.715 . . . . 1.0 111.847 -179.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -66.35 -38.21 87.08 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.737 0.273 . . . . 1.0 111.737 -179.125 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -61.03 -42.69 98.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.477 -0.328 . . . . 1.0 111.862 -178.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1326 ' ' MET . . . . . . . . . . . . . 2.0 tpt -62.74 -41.83 99.37 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.471 -0.492 . . . . 1.0 110.064 -179.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1327 ' ' ASP . . . . . 0.412 ' OD2' ' SG ' ' A' 1311 ' ' CYS . 64.7 m-20 -65.04 -34.7 79.05 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.965 -0.561 . . . . 1.0 110.544 -179.383 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1328 ' ' ALA . . . . . 0.499 ' O ' ' CD2' ' A' 1332 ' ' TYR . . . -58.83 -23.75 61.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.307 -0.406 . . . . 1.0 111.45 -179.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 92.6 mt -62.48 -42.48 99.52 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.727 -0.389 . . . . 1.0 110.838 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -95.11 23.98 5.27 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.357 -0.383 . . . . 1.0 111.955 -178.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 97.3 mttt -137.82 42.55 2.29 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 120.697 -0.401 . . . . 1.0 111.072 -179.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1332 ' ' TYR . . . . . 0.499 ' CD2' ' O ' ' A' 1328 ' ' ALA . 14.0 m-85 -115.15 145.98 41.83 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.285 0.564 . . . . 1.0 110.977 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -117.76 -176.71 3.09 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.368 -0.833 . . . . 1.0 108.819 178.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -41.8 148.7 0.44 Allowed Pre-proline 0 CA--C 1.536 0.405 0 C-N-CA 120.711 -0.396 . . . . 1.0 110.475 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -68.46 154.63 71.4 Favored 'Trans proline' 0 N--CA 1.497 1.72 0 C-N-CA 122.292 1.995 . . . . 1.0 111.763 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1336 ' ' GLN . . . . . . . . . . . . . 15.3 mm100 -43.43 114.96 0.7 Allowed 'General case' 0 N--CA 1.462 0.133 0 CA-C-O 120.772 0.32 . . . . 1.0 110.26 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1337 ' ' MET . . . . . . . . . . . . . 94.8 mmm . . . . . 0 C--O 1.22 -0.486 0 CA-C-O 117.78 -1.105 . . . . 1.0 110.652 -179.308 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A 1259 ' ' ASN . . . . . 0.432 ' O ' ' OG ' ' A' 1263 ' ' SER . 61.1 t30 . . . . . 0 N--CA 1.49 1.537 0 N-CA-C 109.504 -0.554 . . . . 1.0 109.504 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1260 ' ' ASP . . . . . 0.577 ' N ' ' CD ' ' A' 1261 ' ' PRO . 0.2 OUTLIER -104.45 -43.27 0.17 Allowed Pre-proline 0 CA--C 1.537 0.471 0 CA-C-N 116.36 -0.382 . . . . 1.0 110.612 -179.773 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A 1261 ' ' PRO . . . . . 0.577 ' CD ' ' N ' ' A' 1260 ' ' ASP . 45.0 Cg_exo -55.59 -37.87 94.74 Favored 'Trans proline' 0 N--CA 1.499 1.812 0 C-N-CA 122.481 2.121 . . . . 1.0 112.727 -179.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 56.8 mttp -94.04 -8.03 41.0 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.428 -0.351 . . . . 1.0 111.731 -178.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1263 ' ' SER . . . . . 0.432 ' OG ' ' O ' ' A' 1259 ' ' ASN . 64.8 m -52.09 -39.86 60.39 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 120.532 -0.467 . . . . 1.0 110.807 -179.398 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -63.26 -47.89 80.49 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.878 0.37 . . . . 1.0 110.495 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1265 ' ' LEU . . . . . 0.41 HD11 ' CE1' ' A' 1284 ' ' TYR . 88.2 mt -65.71 -39.76 91.54 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.114 -0.494 . . . . 1.0 111.413 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -54.1 -40.27 67.14 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 121.043 -0.263 . . . . 1.0 111.007 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -62.95 -42.41 99.81 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.728 -0.389 . . . . 1.0 110.425 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1268 ' ' CYS . . . . . 0.407 ' O ' ' OG1' ' A' 1271 ' ' THR . 90.4 m -66.28 -37.2 84.88 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.296 -0.411 . . . . 1.0 110.747 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 99.8 m -59.18 -35.38 73.48 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.261 -0.427 . . . . 1.0 110.964 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 86.2 mt -62.61 -40.89 98.38 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.335 -0.393 . . . . 1.0 110.991 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1271 ' ' THR . . . . . 0.407 ' OG1' ' O ' ' A' 1268 ' ' CYS . 74.3 p -65.68 -31.68 72.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.339 -0.391 . . . . 1.0 111.562 -179.131 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 72.1 mt -74.28 83.69 1.89 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.599 -0.44 . . . . 1.0 110.578 -179.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 7.3 mmp_? -119.51 110.76 17.27 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.244 -0.435 . . . . 1.0 110.842 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1274 ' ' THR . . . . . . . . . . . . . 21.6 m -129.29 129.89 45.46 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 109.94 -0.393 . . . . 1.0 109.94 179.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 43.6 tp10 -112.42 136.52 51.81 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.937 0.399 . . . . 1.0 110.705 -179.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 88.37 8.27 71.41 Favored Glycine 0 CA--C 1.526 0.747 0 CA-C-N 116.06 -0.518 . . . . 1.0 111.894 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 50.4 mtpt -138.91 -172.27 3.28 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.212 0.529 . . . . 1.0 111.113 179.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -94.5 108.95 40.29 Favored Pre-proline 0 CA--C 1.537 0.47 0 CA-C-N 115.275 -0.875 . . . . 1.0 109.41 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -80.97 92.95 1.03 Allowed 'Trans proline' 0 N--CA 1.491 1.33 0 C-N-CA 121.769 1.646 . . . . 1.0 112.476 -179.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 91.8 m-20 -80.94 141.43 34.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.163 -0.471 . . . . 1.0 109.742 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 10.5 mt -141.51 133.0 13.48 Favored Pre-proline 0 CA--C 1.536 0.417 0 N-CA-C 110.066 -0.346 . . . . 1.0 110.066 -179.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -76.12 120.0 5.54 Favored 'Trans proline' 0 N--CA 1.491 1.342 0 C-N-CA 121.538 1.492 . . . . 1.0 111.466 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1283 ' ' LEU . . . . . 0.404 HD12 ' N ' ' A' 1283 ' ' LEU . 11.0 mp -106.11 153.22 22.39 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.147 -0.479 . . . . 1.0 109.759 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1284 ' ' TYR . . . . . 0.41 ' CE1' HD11 ' A' 1265 ' ' LEU . 3.0 m-85 -77.14 141.26 40.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.289 0.566 . . . . 1.0 111.042 -179.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 64.3 tttm -136.57 124.89 23.27 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.313 -0.858 . . . . 1.0 109.471 179.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 59.3 m -85.65 129.87 34.71 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.918 0.389 . . . . 1.0 111.087 -179.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 77.2 mt -82.95 -170.49 3.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.919 -0.582 . . . . 1.0 110.128 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -107.99 152.73 24.08 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.097 -0.502 . . . . 1.0 109.909 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1289 ' ' THR . . . . . . . . . . . . . 73.3 p -86.53 113.21 22.25 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.896 0.379 . . . . 1.0 111.427 -179.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 3.4 m -149.43 122.57 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 115.916 -0.584 . . . . 1.0 109.915 178.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -141.85 166.85 26.14 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.123 -0.791 . . . . 1.0 111.123 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -63.27 -47.22 8.29 Favored 'Trans proline' 0 C--N 1.307 -1.609 0 C-N-CA 122.761 2.308 . . . . 1.0 111.077 179.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1293 ' ' SER . . . . . . . . . . . . . 31.2 t -85.49 165.36 17.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.537 -0.756 . . . . 1.0 110.416 179.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 17.9 m170 -59.45 -14.91 14.21 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.876 -0.416 . . . . 1.0 109.876 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -65.33 144.49 57.08 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.835 -0.62 . . . . 1.0 111.317 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -105.67 136.46 45.24 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.059 -0.519 . . . . 1.0 110.409 179.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1297 ' ' THR . . . . . . . . . . . . . 55.5 m -124.33 127.91 48.31 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 109.871 -0.418 . . . . 1.0 109.871 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -96.95 123.5 40.69 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.928 0.395 . . . . 1.0 110.251 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1299 ' ' THR . . . . . . . . . . . . . 99.6 m -126.76 130.5 50.44 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.012 -0.54 . . . . 1.0 110.722 -179.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 56.5 t -117.59 129.88 73.35 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.19 0 N-CA-C 109.076 -0.713 . . . . 1.0 109.076 179.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -129.01 147.73 50.9 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.146 0.498 . . . . 1.0 111.104 -179.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 29.5 t -114.16 129.84 69.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.555 -0.748 . . . . 1.0 109.055 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -113.59 141.44 47.17 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.212 0.53 . . . . 1.0 111.825 -178.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1304 ' ' PHE . . . . . 0.618 ' CE1' ' NE2' ' A' 1336 ' ' GLN . 80.1 t80 -137.58 100.58 4.25 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.242 -0.89 . . . . 1.0 109.355 179.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 50.7 mtmt 43.75 39.81 2.71 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.233 -0.439 . . . . 1.0 110.883 -178.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 88.53 6.37 73.7 Favored Glycine 0 CA--C 1.528 0.902 0 CA-C-N 116.266 -0.425 . . . . 1.0 112.361 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -112.45 121.47 44.92 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 120.854 0.359 . . . . 1.0 110.288 179.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 37.5 ttm180 -80.37 134.24 36.01 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.126 -0.488 . . . . 1.0 110.699 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 36.2 pt -131.25 9.71 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-N 116.152 -0.476 . . . . 1.0 110.442 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -159.27 151.7 22.6 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.897 -0.881 . . . . 1.0 110.897 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 9.2 t -170.8 47.1 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.76 0.314 . . . . 1.0 110.723 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1312 ' ' GLY . . . . . 0.555 ' H ' ' HB2' ' A' 1324 ' ' ALA . . . -75.77 149.61 38.4 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 111.231 -0.748 . . . . 1.0 111.231 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -136.2 149.14 48.44 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 110.137 -0.32 . . . . 1.0 110.137 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -177.94 163.47 31.74 Favored Glycine 0 CA--C 1.53 1.018 0 N-CA-C 110.663 -0.975 . . . . 1.0 110.663 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -53.7 -45.8 38.4 Favored 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 121.551 1.501 . . . . 1.0 112.16 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1316 ' ' SER . . . . . . . . . . . . . 91.1 p -105.32 161.99 13.82 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.005 0.431 . . . . 1.0 111.189 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 46.2 mm -64.97 -44.7 96.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.712 -0.677 . . . . 1.0 110.9 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 76.3 mt-30 -55.75 -44.04 77.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.146 -0.479 . . . . 1.0 111.124 -178.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -66.77 -39.38 87.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.509 -0.314 . . . . 1.0 110.881 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -65.21 -39.68 93.13 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.206 -0.452 . . . . 1.0 111.405 -179.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -66.8 -35.54 80.3 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.588 -0.278 . . . . 1.0 111.291 -179.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1322 ' ' MET . . . . . . . . . . . . . 59.7 mtt -62.38 -42.17 99.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.515 -0.311 . . . . 1.0 110.769 -179.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -67.35 -43.32 88.38 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 111.196 -0.762 . . . . 1.0 111.196 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1324 ' ' ALA . . . . . 0.555 ' HB2' ' H ' ' A' 1312 ' ' GLY . . . -67.48 -39.47 85.26 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.725 0.298 . . . . 1.0 111.31 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -64.66 -41.22 96.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.438 -0.346 . . . . 1.0 111.599 -179.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1326 ' ' MET . . . . . . . . . . . . . 22.3 tpp -61.37 -48.56 80.72 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.87 -0.332 . . . . 1.0 110.436 -179.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -65.49 -37.46 86.87 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.998 -0.546 . . . . 1.0 111.186 -179.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1328 ' ' ALA . . . . . 0.531 ' O ' ' CD2' ' A' 1332 ' ' TYR . . . -56.47 -25.05 49.83 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 111.973 0.361 . . . . 1.0 111.973 -178.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 78.3 mt -62.61 -42.23 99.46 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.98 0.363 . . . . 1.0 111.98 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -95.19 23.89 5.4 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 111.994 0.368 . . . . 1.0 111.994 -178.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -132.44 34.46 3.72 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 121.197 -0.201 . . . . 1.0 110.973 -179.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1332 ' ' TYR . . . . . 0.531 ' CD2' ' O ' ' A' 1328 ' ' ALA . 29.2 m-85 -111.5 139.38 46.98 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.325 0.583 . . . . 1.0 110.956 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1333 ' ' ASN . . . . . 0.451 ' O ' ' O ' ' A' 1334 ' ' PHE . 11.4 m120 -102.78 -175.46 2.82 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 115.141 -0.936 . . . . 1.0 110.187 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1334 ' ' PHE . . . . . 0.451 ' O ' ' O ' ' A' 1333 ' ' ASN . 0.5 OUTLIER -49.27 -179.56 0.03 OUTLIER Pre-proline 0 CA--C 1.539 0.542 0 N-CA-C 109.024 -0.732 . . . . 1.0 109.024 179.408 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -59.34 145.11 98.88 Favored 'Trans proline' 0 N--CA 1.497 1.689 0 C-N-CA 121.704 1.603 . . . . 1.0 111.693 -179.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1336 ' ' GLN . . . . . 0.618 ' NE2' ' CE1' ' A' 1304 ' ' PHE . 1.3 mm100 -63.05 125.99 25.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.056 -0.52 . . . . 1.0 110.53 -179.293 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 1337 ' ' MET . . . . . . . . . . . . . 98.7 mtp . . . . . 0 C--O 1.22 -0.48 0 CA-C-O 117.971 -1.014 . . . . 1.0 110.406 -179.935 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A 1259 ' ' ASN . . . . . . . . . . . . . 56.4 m-20 . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 109.003 -0.74 . . . . 1.0 109.003 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A 1260 ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -177.02 74.28 0.24 Allowed Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.422 -0.354 . . . . 1.0 110.824 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1261 ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -53.33 -41.12 75.17 Favored 'Trans proline' 0 C--N 1.307 -1.657 0 C-N-CA 122.645 2.23 . . . . 1.0 112.104 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 18.7 pttp -162.29 31.69 0.11 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.303 -0.408 . . . . 1.0 110.773 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1263 ' ' SER . . . . . . . . . . . . . 58.2 m -61.13 -32.13 71.83 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.133 -0.485 . . . . 1.0 110.623 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1264 ' ' GLN . . . . . 0.501 ' O ' ' SG ' ' A' 1268 ' ' CYS . 28.3 mp0 -57.04 -49.55 75.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.22 -0.446 . . . . 1.0 110.986 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1265 ' ' LEU . . . . . . . . . . . . . 34.4 mt -63.39 -40.6 97.67 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.762 -0.375 . . . . 1.0 110.605 179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -63.71 -45.45 89.94 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.352 -0.386 . . . . 1.0 110.789 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -70.51 -39.61 74.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.447 -0.342 . . . . 1.0 111.236 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1268 ' ' CYS . . . . . 0.501 ' SG ' ' O ' ' A' 1264 ' ' GLN . 89.2 m -60.93 -35.57 77.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.46 -0.336 . . . . 1.0 111.376 -179.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 83.9 m -54.71 -37.95 66.46 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.864 -0.335 . . . . 1.0 111.005 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1270 ' ' LEU . . . . . 0.457 HD22 ' N ' ' A' 1270 ' ' LEU . 3.6 mm? -64.89 -39.86 94.2 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.931 -0.308 . . . . 1.0 111.07 179.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1271 ' ' THR . . . . . . . . . . . . . 76.6 p -66.06 -31.11 71.79 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.979 0.363 . . . . 1.0 111.979 -178.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 60.4 mt -81.09 89.54 5.98 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 120.626 -0.43 . . . . 1.0 110.83 -179.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -119.19 151.76 37.79 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.088 -0.506 . . . . 1.0 110.57 179.451 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1274 ' ' THR . . . . . . . . . . . . . 1.3 m -126.91 162.03 26.91 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 109.866 -0.42 . . . . 1.0 109.866 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1275 ' ' GLU . . . . . 0.545 ' C ' ' H ' ' A' 1277 ' ' LYS . 79.0 tt0 -87.97 100.18 12.71 Favored 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 112.273 0.472 . . . . 1.0 112.273 -178.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 57.83 -13.97 0.02 OUTLIER Glycine 0 CA--C 1.529 0.92 0 CA-C-N 115.729 -0.669 . . . . 1.0 113.353 178.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1277 ' ' LYS . . . . . 0.545 ' H ' ' C ' ' A' 1275 ' ' GLU . 48.9 mtpt -79.17 -166.25 0.9 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 117.694 0.747 . . . . 1.0 110.474 -179.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -93.45 110.14 44.96 Favored Pre-proline 0 CA--C 1.538 0.5 0 CA-C-N 116.039 -0.528 . . . . 1.0 109.813 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -80.65 114.85 3.03 Favored 'Trans proline' 0 N--CA 1.492 1.403 0 C-N-CA 121.867 1.712 . . . . 1.0 112.171 -179.099 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1280 ' ' ASP . . . . . 0.518 ' OD2' ' NZ ' ' A' 1305 ' ' LYS . 66.0 m-20 -83.82 133.54 34.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.001 -0.545 . . . . 1.0 109.982 179.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1281 ' ' ILE . . . . . 0.419 HD13 HG21 ' A' 1281 ' ' ILE . 1.8 mt -144.76 127.89 8.51 Favored Pre-proline 0 CA--C 1.538 0.501 0 CA-C-O 118.991 -0.528 . . . . 1.0 110.138 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 43.3 Cg_exo -52.95 135.57 58.62 Favored 'Trans proline' 0 N--CA 1.493 1.469 0 CA-C-N 120.482 1.208 . . . . 1.0 111.31 177.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 80.5 mt -122.32 152.63 39.91 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 109.596 -0.52 . . . . 1.0 109.596 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1284 ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -81.1 136.41 35.92 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.95 0.405 . . . . 1.0 110.914 -179.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 62.9 tttm -141.17 113.74 8.22 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.922 -0.581 . . . . 1.0 109.92 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 97.3 m -92.14 127.05 37.47 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.321 -0.399 . . . . 1.0 110.87 -179.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 60.0 mt -74.91 -172.45 1.61 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.276 -0.42 . . . . 1.0 109.948 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -108.13 126.01 52.27 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 120.84 0.352 . . . . 1.0 110.205 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1289 ' ' THR . . . . . . . . . . . . . 18.0 p -62.55 122.56 16.1 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.052 -0.522 . . . . 1.0 111.392 -179.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 15.8 m -153.25 122.62 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.809 -0.632 . . . . 1.0 109.773 178.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.01 166.67 26.25 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 111.039 -0.824 . . . . 1.0 111.039 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -66.03 -43.46 9.05 Favored 'Trans proline' 0 C--N 1.307 -1.638 0 C-N-CA 122.636 2.224 . . . . 1.0 110.852 179.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1293 ' ' SER . . . . . . . . . . . . . 30.3 t -89.97 165.26 14.17 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.394 -0.821 . . . . 1.0 110.126 179.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 71.0 m80 -59.11 -15.37 13.8 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.915 -0.402 . . . . 1.0 109.915 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -63.88 138.66 58.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.929 -0.578 . . . . 1.0 110.783 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 83.5 mtm-85 -101.87 142.41 33.23 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.193 -0.458 . . . . 1.0 110.766 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1297 ' ' THR . . . . . . . . . . . . . 94.6 m -118.73 124.33 47.04 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.958 -0.565 . . . . 1.0 109.8 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 93.7 m-85 -98.51 116.03 29.86 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.362 -0.381 . . . . 1.0 110.491 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1299 ' ' THR . . . . . . . . . . . . . 91.0 m -126.88 132.39 50.93 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.115 -0.493 . . . . 1.0 110.598 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 75.4 t -121.57 131.37 73.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 N-CA-C 109.532 -0.544 . . . . 1.0 109.532 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -129.79 143.74 50.96 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.005 0.431 . . . . 1.0 110.551 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 58.0 t -109.67 129.38 64.64 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 CA-C-N 116.044 -0.526 . . . . 1.0 109.629 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -105.11 133.89 49.14 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.001 0.429 . . . . 1.0 111.332 -179.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 87.7 t80 -147.92 110.37 4.66 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.842 -0.617 . . . . 1.0 110.354 179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1305 ' ' LYS . . . . . 0.518 ' NZ ' ' OD2' ' A' 1280 ' ' ASP . 72.4 mmtt 54.58 31.19 14.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.313 -0.403 . . . . 1.0 110.647 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 78.93 6.36 88.71 Favored Glycine 0 CA--C 1.523 0.584 0 N-CA-C 111.068 -0.813 . . . . 1.0 111.068 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 80.0 mm-40 -112.11 117.06 31.57 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 109.975 -0.38 . . . . 1.0 109.975 179.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 42.3 ttm180 -73.37 128.24 34.92 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.732 -0.47 . . . . 1.0 109.732 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1309 ' ' ILE . . . . . 0.401 HD13 HG21 ' A' 1309 ' ' ILE . 24.3 pt -118.28 19.73 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-N 116.155 -0.475 . . . . 1.0 111.656 -178.308 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -161.54 147.3 13.57 Favored Glycine 0 CA--C 1.524 0.652 0 C-N-CA 120.499 -0.858 . . . . 1.0 111.418 179.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 44.9 t -171.11 126.77 0.68 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.719 0.295 . . . . 1.0 110.428 179.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -177.32 176.15 47.93 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 110.944 -0.862 . . . . 1.0 110.944 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 65.2 mttp -142.39 149.41 39.31 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 120.804 0.335 . . . . 1.0 110.413 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -164.96 168.5 39.18 Favored Glycine 0 CA--C 1.529 0.949 0 N-CA-C 110.635 -0.986 . . . . 1.0 110.635 179.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -53.92 -69.13 0.06 OUTLIER 'Trans proline' 0 N--CA 1.494 1.516 0 C-N-CA 121.602 1.535 . . . . 1.0 111.878 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1316 ' ' SER . . . . . . . . . . . . . 8.2 p -90.32 169.18 11.31 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.079 -0.509 . . . . 1.0 111.07 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 47.5 mm -63.9 -43.89 97.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.893 -0.594 . . . . 1.0 110.353 179.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 93.9 mm-40 -53.8 -40.79 66.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 1.0 110.967 -179.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -61.36 -42.39 98.62 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.392 -0.367 . . . . 1.0 110.621 -179.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -67.37 -37.68 83.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.25 -0.432 . . . . 1.0 110.991 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 98.3 mt-10 -64.84 -43.31 93.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.106 -0.497 . . . . 1.0 111.526 -179.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1322 ' ' MET . . . . . . . . . . . . . 78.2 mtm -64.52 -39.28 93.49 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.782 -0.367 . . . . 1.0 111.406 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -63.31 -48.36 79.76 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 111.037 -0.825 . . . . 1.0 111.037 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -69.92 -35.75 74.81 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.785 0.326 . . . . 1.0 111.083 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -59.71 -49.76 76.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.075 -0.511 . . . . 1.0 111.918 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1326 ' ' MET . . . . . . . . . . . . . 87.1 mmm -64.67 -42.39 95.41 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.723 -0.391 . . . . 1.0 111.67 -178.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 64.5 m-20 -66.18 -33.62 76.17 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.329 -0.396 . . . . 1.0 111.312 -179.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1328 ' ' ALA . . . . . . . . . . . . . . . -56.79 -20.83 24.47 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.169 -0.469 . . . . 1.0 112.194 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1329 ' ' LEU . . . . . 0.449 HD22 ' N ' ' A' 1329 ' ' LEU . 3.7 mm? -61.32 -42.66 99.05 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.585 -0.446 . . . . 1.0 111.16 -178.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1330 ' ' GLU . . . . . 0.521 ' N ' ' OE1' ' A' 1330 ' ' GLU . 50.4 mp0 -92.94 24.59 3.6 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 121.209 -0.196 . . . . 1.0 111.435 -179.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -128.66 10.32 6.06 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 111.702 0.26 . . . . 1.0 111.702 -178.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1332 ' ' TYR . . . . . . . . . . . . . 2.6 m-85 -77.36 137.75 38.92 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 120.492 -0.483 . . . . 1.0 110.602 179.467 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 5.4 m120 -107.32 -177.0 3.23 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.605 -0.725 . . . . 1.0 110.224 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 1334 ' ' PHE . . . . . 0.454 ' O ' ' O ' ' A' 1335 ' ' PRO . 19.3 m-85 -41.39 151.1 0.3 Allowed Pre-proline 0 CA--C 1.539 0.539 0 CA-C-N 116.215 -0.448 . . . . 1.0 110.438 179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1335 ' ' PRO . . . . . 0.454 ' O ' ' O ' ' A' 1334 ' ' PHE . 87.9 Cg_exo -41.49 174.12 0.0 OUTLIER 'Trans proline' 0 N--CA 1.495 1.617 0 C-N-CA 122.433 2.088 . . . . 1.0 112.814 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1336 ' ' GLN . . . . . 0.592 ' H ' ' CD ' ' A' 1336 ' ' GLN . 2.2 mp0 -55.93 122.58 11.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.816 -0.629 . . . . 1.0 110.378 179.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 1337 ' ' MET . . . . . . . . . . . . . 98.8 mtp . . . . . 0 C--O 1.22 -0.497 0 CA-C-O 117.909 -1.043 . . . . 1.0 110.591 179.913 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A 1259 ' ' ASN . . . . . . . . . . . . . 42.9 p-10 . . . . . 0 N--CA 1.491 1.597 0 N-CA-C 109.785 -0.45 . . . . 1.0 109.785 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A 1260 ' ' ASP . . . . . . . . . . . . . 14.6 m-20 55.67 66.47 3.67 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 115.803 -0.635 . . . . 1.0 110.99 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1261 ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -55.17 -39.6 90.11 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 C-N-CA 122.484 2.123 . . . . 1.0 111.551 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 52.7 pttt -162.36 59.42 0.23 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.019 -0.537 . . . . 1.0 110.659 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1263 ' ' SER . . . . . . . . . . . . . 47.8 m -61.45 -35.7 78.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.12 -0.491 . . . . 1.0 111.017 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -58.46 -52.52 65.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.312 -0.404 . . . . 1.0 111.433 -179.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1265 ' ' LEU . . . . . . . . . . . . . 8.8 mt -65.12 -40.03 93.92 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.902 -0.319 . . . . 1.0 110.784 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 20.2 mm100 -62.29 -43.36 99.01 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 121.033 -0.267 . . . . 1.0 110.89 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -65.63 -31.51 72.57 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.792 0.33 . . . . 1.0 110.814 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1268 ' ' CYS . . . . . 0.43 ' O ' ' OG1' ' A' 1271 ' ' THR . 85.3 m -62.8 -36.5 83.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.378 -0.373 . . . . 1.0 111.119 -179.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 93.1 m -60.48 -37.28 80.53 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.88 -0.328 . . . . 1.0 111.036 -179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1270 ' ' LEU . . . . . 0.489 HD12 ' N ' ' A' 1270 ' ' LEU . 10.9 mp -63.48 -40.42 97.05 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.802 -0.359 . . . . 1.0 110.618 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1271 ' ' THR . . . . . 0.43 ' OG1' ' O ' ' A' 1268 ' ' CYS . 69.2 p -64.67 -31.3 72.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.452 -0.34 . . . . 1.0 111.426 -179.051 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 87.8 mt -69.93 84.04 0.49 Allowed 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.303 -0.559 . . . . 1.0 110.577 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -106.1 136.66 45.39 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.248 -0.433 . . . . 1.0 110.228 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1274 ' ' THR . . . . . . . . . . . . . 7.1 m -127.24 155.65 43.14 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 109.85 -0.426 . . . . 1.0 109.85 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -66.65 90.59 0.17 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.976 0.417 . . . . 1.0 111.469 -178.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 54.62 40.57 70.99 Favored Glycine 0 CA--C 1.525 0.692 0 CA-C-N 115.832 -0.622 . . . . 1.0 112.434 178.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 42.4 mtpt -140.4 178.92 6.96 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.508 0.671 . . . . 1.0 111.885 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -117.74 105.95 46.88 Favored Pre-proline 0 CA--C 1.539 0.538 0 CA-C-N 114.753 -1.112 . . . . 1.0 109.271 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -81.14 163.66 19.95 Favored 'Trans proline' 0 N--CA 1.49 1.311 0 C-N-CA 121.776 1.65 . . . . 1.0 112.203 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1280 ' ' ASP . . . . . 0.5 ' O ' ' NE2' ' A' 1336 ' ' GLN . 97.8 m-20 -79.87 125.82 30.21 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.387 -0.597 . . . . 1.0 109.387 179.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -115.91 140.45 26.24 Favored Pre-proline 0 CA--C 1.541 0.627 0 CA-C-N 115.973 -0.558 . . . . 1.0 110.591 -178.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo -49.18 137.35 30.04 Favored 'Trans proline' 0 N--CA 1.491 1.381 0 C-N-CA 120.973 1.115 . . . . 1.0 110.96 178.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 55.4 mt -117.7 140.43 49.67 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 110.01 -0.367 . . . . 1.0 110.01 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1284 ' ' TYR . . . . . . . . . . . . . 76.8 m-85 -85.17 137.3 33.1 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.237 -0.438 . . . . 1.0 110.241 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 88.6 tttt -140.67 121.2 14.15 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.911 0.386 . . . . 1.0 110.463 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 34.3 m -89.31 128.66 35.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.132 -0.485 . . . . 1.0 110.253 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 54.2 mt -81.12 -172.45 3.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.478 -0.328 . . . . 1.0 110.299 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -108.13 141.05 40.44 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.241 -0.436 . . . . 1.0 110.337 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1289 ' ' THR . . . . . . . . . . . . . 5.6 p -91.04 112.74 24.77 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.238 -0.437 . . . . 1.0 110.748 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 5.6 m -143.27 122.17 7.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.185 -0.461 . . . . 1.0 110.202 179.108 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.44 166.09 26.56 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 110.749 -0.94 . . . . 1.0 110.749 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.01 -40.8 67.59 Favored 'Trans proline' 0 C--N 1.306 -1.688 0 C-N-CA 122.382 2.055 . . . . 1.0 110.946 179.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1293 ' ' SER . . . . . . . . . . . . . 29.5 t -92.95 164.34 13.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.616 -0.72 . . . . 1.0 110.079 178.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 75.7 m-70 -60.36 -9.97 4.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.084 0.468 . . . . 1.0 110.027 179.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -60.17 141.98 55.08 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.902 -0.59 . . . . 1.0 110.845 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -113.84 141.91 46.74 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.085 -0.507 . . . . 1.0 110.911 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1297 ' ' THR . . . . . . . . . . . . . 89.1 m -124.0 126.01 45.56 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.965 -0.561 . . . . 1.0 109.816 179.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -103.38 122.57 45.13 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.978 0.418 . . . . 1.0 110.975 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1299 ' ' THR . . . . . . . . . . . . . 89.9 m -128.03 132.84 49.08 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.875 -0.602 . . . . 1.0 110.142 179.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 55.9 t -118.72 132.82 67.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 N-CA-C 109.671 -0.492 . . . . 1.0 109.671 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -128.82 147.15 50.78 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.089 -0.505 . . . . 1.0 110.7 -179.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 44.4 t -115.21 130.07 70.38 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 N-CA-C 109.513 -0.551 . . . . 1.0 109.513 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -108.93 140.96 41.7 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.092 0.473 . . . . 1.0 111.226 -179.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 92.0 t80 -136.96 103.54 5.19 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.683 -0.69 . . . . 1.0 109.792 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1305 ' ' LYS . . . . . 0.431 ' HE3' HE22 ' A' 1336 ' ' GLN . 98.8 mttt 47.84 34.21 3.77 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.756 -0.378 . . . . 1.0 110.511 -179.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 87.55 10.29 70.69 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 121.26 -0.495 . . . . 1.0 111.901 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -116.11 136.39 53.07 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 120.923 0.392 . . . . 1.0 110.622 179.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 72.6 ttp85 -81.44 135.4 35.63 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.95 -0.568 . . . . 1.0 110.885 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 40.3 pt -135.36 18.22 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 CA-C-N 116.281 -0.418 . . . . 1.0 110.744 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -161.33 147.83 14.84 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 111.305 -0.718 . . . . 1.0 111.305 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 35.5 t -168.58 134.93 1.87 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.902 0.382 . . . . 1.0 110.625 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . 169.68 170.86 34.66 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 110.799 -0.92 . . . . 1.0 110.799 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -138.59 146.75 42.17 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.973 0.415 . . . . 1.0 110.934 -179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -162.34 172.54 38.47 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 110.356 -1.097 . . . . 1.0 110.356 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -68.01 -73.03 0.02 OUTLIER 'Trans proline' 0 C--N 1.306 -1.66 0 C-N-CA 122.33 2.02 . . . . 1.0 111.984 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1316 ' ' SER . . . . . 0.419 ' OG ' ' OE1' ' A' 1319 ' ' GLN . 82.5 p -82.48 161.21 22.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.46 . . . . 1.0 110.769 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 44.1 mm -65.02 -43.99 96.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.996 -0.547 . . . . 1.0 110.697 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -54.96 -45.05 74.9 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.388 -0.369 . . . . 1.0 110.338 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1319 ' ' GLN . . . . . 0.419 ' OE1' ' OG ' ' A' 1316 ' ' SER . 1.4 mp0 -64.62 -40.2 95.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.33 -0.396 . . . . 1.0 110.169 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -63.61 -40.06 95.95 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.117 -0.492 . . . . 1.0 111.075 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 97.5 mt-10 -67.2 -38.71 85.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.327 -0.397 . . . . 1.0 110.707 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1322 ' ' MET . . . . . . . . . . . . . 78.6 mtp -64.44 -40.56 95.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.167 -0.469 . . . . 1.0 110.711 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -67.48 -48.43 57.32 Favored Glycine 0 CA--C 1.528 0.882 0 N-CA-C 110.661 -0.976 . . . . 1.0 110.661 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -67.56 -35.13 78.44 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.877 0.37 . . . . 1.0 110.683 179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -60.9 -41.24 95.72 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.945 -0.57 . . . . 1.0 111.769 -178.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1326 ' ' MET . . . . . . . . . . . . . 62.6 ttp -63.28 -41.82 99.04 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.877 -0.329 . . . . 1.0 111.316 -179.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -67.48 -29.53 68.99 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.248 -0.433 . . . . 1.0 110.926 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1328 ' ' ALA . . . . . . . . . . . . . . . -61.13 -27.88 68.71 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.125 0.417 . . . . 1.0 112.125 -178.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 3.2 mm? -62.25 -41.26 98.28 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.494 -0.482 . . . . 1.0 110.569 -179.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -88.61 18.71 4.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.354 -0.385 . . . . 1.0 111.24 -179.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 99.5 mttt -135.41 40.11 2.84 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 112.518 0.562 . . . . 1.0 112.518 -178.219 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1332 ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -106.04 134.94 48.37 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.215 0.531 . . . . 1.0 110.595 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1333 ' ' ASN . . . . . 0.427 ' O ' ' C ' ' A' 1334 ' ' PHE . 52.0 m-20 -111.43 -175.48 2.71 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.35 -0.841 . . . . 1.0 109.92 179.277 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1334 ' ' PHE . . . . . 0.427 ' C ' ' O ' ' A' 1333 ' ' ASN . 52.3 m-85 -30.39 110.59 0.27 Allowed Pre-proline 0 CA--C 1.543 0.702 0 O-C-N 123.476 0.485 . . . . 1.0 111.524 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -52.35 145.99 33.97 Favored 'Trans proline' 0 N--CA 1.496 1.673 0 C-N-CA 121.661 1.574 . . . . 1.0 112.275 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1336 ' ' GLN . . . . . 0.5 ' NE2' ' O ' ' A' 1280 ' ' ASP . 15.8 mm100 -38.35 117.27 0.61 Allowed 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 115.894 -0.594 . . . . 1.0 111.205 -179.375 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 1337 ' ' MET . . . . . . . . . . . . . 65.9 mtt . . . . . 0 C--O 1.219 -0.517 0 CA-C-O 117.907 -1.044 . . . . 1.0 110.602 179.782 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A 1259 ' ' ASN . . . . . . . . . . . . . 43.4 t-20 . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.525 -0.546 . . . . 1.0 109.525 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A 1260 ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -138.72 79.08 29.5 Favored Pre-proline 0 N--CA 1.465 0.278 0 CA-C-N 116.068 -0.515 . . . . 1.0 109.963 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1261 ' ' PRO . . . . . 0.569 ' C ' ' H ' ' A' 1263 ' ' SER . 16.9 Cg_exo -65.22 154.1 75.13 Favored 'Trans proline' 0 C--N 1.308 -1.569 0 C-N-CA 122.668 2.246 . . . . 1.0 112.486 -179.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 64.3 pttt -62.25 11.42 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.812 -0.631 . . . . 1.0 111.371 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1263 ' ' SER . . . . . 0.569 ' H ' ' C ' ' A' 1261 ' ' PRO . 45.7 m -60.45 -28.05 67.99 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.767 0.318 . . . . 1.0 110.638 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1264 ' ' GLN . . . . . 0.45 ' O ' ' SG ' ' A' 1268 ' ' CYS . 99.1 mm-40 -54.51 -44.17 72.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.232 -0.44 . . . . 1.0 110.636 -179.166 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1265 ' ' LEU . . . . . . . . . . . . . 20.4 mt -63.58 -41.48 98.37 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.505 -0.478 . . . . 1.0 110.474 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -63.47 -43.98 95.75 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.846 0.355 . . . . 1.0 110.492 179.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 98.9 mm-40 -66.58 -40.82 89.13 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.037 -0.529 . . . . 1.0 109.887 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1268 ' ' CYS . . . . . 0.45 ' SG ' ' O ' ' A' 1264 ' ' GLN . 92.9 m -65.14 -35.07 79.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.596 -0.729 . . . . 1.0 110.995 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 98.4 m -56.74 -35.54 68.72 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.992 -0.283 . . . . 1.0 111.096 -179.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 82.9 mt -62.92 -40.98 99.27 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.478 -0.328 . . . . 1.0 110.621 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1271 ' ' THR . . . . . . . . . . . . . 70.3 p -66.77 -33.14 74.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.517 -0.31 . . . . 1.0 110.843 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1272 ' ' LEU . . . . . 0.415 HD22 ' H ' ' A' 1336 ' ' GLN . 85.9 mt -68.19 85.95 0.26 Allowed 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.572 -0.451 . . . . 1.0 110.562 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 79.4 mtp85 -119.67 131.09 55.34 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.307 -0.406 . . . . 1.0 110.75 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1274 ' ' THR . . . . . . . . . . . . . 20.8 m -120.94 128.4 52.72 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 109.992 -0.373 . . . . 1.0 109.992 179.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 48.4 tp10 -98.07 128.77 44.79 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.255 -0.43 . . . . 1.0 110.468 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 97.19 -9.26 65.2 Favored Glycine 0 CA--C 1.524 0.647 0 N-CA-C 111.439 -0.664 . . . . 1.0 111.439 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 52.0 mtpt -137.43 -175.11 3.95 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.207 0.527 . . . . 1.0 111.145 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -95.79 108.22 38.94 Favored Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 115.11 -0.95 . . . . 1.0 108.713 178.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 45.4 Cg_exo -50.67 129.22 26.31 Favored 'Trans proline' 0 N--CA 1.493 1.445 0 C-N-CA 121.154 1.236 . . . . 1.0 112.251 -178.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -98.65 125.33 43.91 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.696 -0.684 . . . . 1.0 109.858 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 11.9 mt -133.73 133.84 22.8 Favored Pre-proline 0 CA--C 1.538 0.494 0 N-CA-C 110.365 -0.235 . . . . 1.0 110.365 -179.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -77.68 120.55 5.19 Favored 'Trans proline' 0 N--CA 1.493 1.471 0 C-N-CA 121.56 1.507 . . . . 1.0 111.531 178.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1283 ' ' LEU . . . . . 0.419 HD12 ' N ' ' A' 1283 ' ' LEU . 9.4 mp -106.91 155.83 19.34 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 116.193 -0.458 . . . . 1.0 110.383 -179.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1284 ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -77.33 144.71 37.83 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.921 -0.581 . . . . 1.0 111.155 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 87.7 tttt -146.12 105.73 3.96 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.837 -0.619 . . . . 1.0 109.989 179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 26.2 m -63.44 130.38 44.19 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.123 -0.49 . . . . 1.0 111.2 -179.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 65.7 mt -81.4 -175.1 5.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.047 -0.524 . . . . 1.0 110.406 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -108.76 146.73 33.1 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.161 -0.472 . . . . 1.0 110.292 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1289 ' ' THR . . . . . . . . . . . . . 17.4 p -94.57 114.21 26.15 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.1 -0.5 . . . . 1.0 111.212 -178.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1290 ' ' VAL . . . . . 0.527 ' O ' HG23 ' A' 1290 ' ' VAL . 30.4 m -138.92 121.56 17.96 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-N 116.292 -0.413 . . . . 1.0 110.358 178.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.8 157.83 26.91 Favored Glycine 0 CA--C 1.527 0.82 0 N-CA-C 110.19 -1.164 . . . . 1.0 110.19 179.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -60.26 -40.56 58.11 Favored 'Trans proline' 0 C--N 1.31 -1.487 0 C-N-CA 122.055 1.837 . . . . 1.0 110.975 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1293 ' ' SER . . . . . . . . . . . . . 11.9 t -93.19 164.79 13.11 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.633 -0.712 . . . . 1.0 110.314 179.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 62.1 m170 -58.36 -11.39 2.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.274 -0.421 . . . . 1.0 110.018 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -60.3 147.89 38.79 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.98 -0.554 . . . . 1.0 110.485 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 96.2 mtt-85 -126.89 143.74 51.19 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.164 0.507 . . . . 1.0 111.149 -179.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1297 ' ' THR . . . . . . . . . . . . . 88.4 m -125.24 128.09 47.76 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.57 -0.741 . . . . 1.0 109.366 178.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 95.3 m-85 -99.66 119.32 37.91 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.777 -0.453 . . . . 1.0 109.777 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1299 ' ' THR . . . . . . . . . . . . . 41.1 m -127.24 130.17 49.13 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.939 -0.573 . . . . 1.0 110.427 -179.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 67.2 t -118.31 127.41 75.42 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 N-CA-C 109.189 -0.671 . . . . 1.0 109.189 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -130.83 143.39 50.7 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.351 -0.386 . . . . 1.0 110.894 -179.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 16.9 t -106.55 129.07 60.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 N-CA-C 109.142 -0.688 . . . . 1.0 109.142 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -112.59 144.33 42.26 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.238 0.542 . . . . 1.0 111.671 -178.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1304 ' ' PHE . . . . . 0.432 ' O ' ' N ' ' A' 1307 ' ' GLU . 75.2 t80 -126.69 108.0 10.69 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.388 -0.823 . . . . 1.0 109.234 179.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 38.5 mtpt 46.75 32.24 1.69 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.514 -0.474 . . . . 1.0 109.984 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 88.97 17.29 56.52 Favored Glycine 0 CA--C 1.529 0.956 0 N-CA-C 111.83 -0.508 . . . . 1.0 111.83 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1307 ' ' GLU . . . . . 0.432 ' N ' ' O ' ' A' 1304 ' ' PHE . 99.5 mt-10 -119.47 129.71 54.87 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 116.964 0.382 . . . . 1.0 110.777 179.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1308 ' ' ARG . . . . . 0.661 HH21 ' CB ' ' A' 1311 ' ' CYS . 77.7 ttt180 -66.53 129.25 39.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.772 -0.649 . . . . 1.0 110.97 179.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 3.4 pt -138.24 13.01 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-N 116.064 -0.517 . . . . 1.0 110.874 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -173.57 153.19 16.98 Favored Glycine 0 CA--C 1.524 0.623 0 C-N-CA 120.346 -0.93 . . . . 1.0 111.674 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1311 ' ' CYS . . . . . 0.661 ' CB ' HH21 ' A' 1308 ' ' ARG . 52.4 t -169.9 144.08 2.7 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.877 0.37 . . . . 1.0 110.789 179.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -170.63 156.35 26.61 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.879 -0.888 . . . . 1.0 110.879 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 99.3 mttt -139.07 142.02 38.18 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.929 0.395 . . . . 1.0 110.595 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -167.11 176.9 41.94 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 110.277 -1.129 . . . . 1.0 110.277 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 18.3 Cg_exo -61.53 -63.23 0.1 Allowed 'Trans proline' 0 C--N 1.311 -1.408 0 C-N-CA 121.487 1.458 . . . . 1.0 111.936 -179.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1316 ' ' SER . . . . . . . . . . . . . 9.8 p -90.95 167.25 12.55 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.8 -0.636 . . . . 1.0 111.061 -179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 38.1 mm -67.79 -42.43 86.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.914 -0.584 . . . . 1.0 110.088 179.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -54.5 -43.52 71.9 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.961 -0.563 . . . . 1.0 111.204 -178.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -66.94 -40.05 87.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.999 0.428 . . . . 1.0 110.341 179.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -62.59 -38.92 92.01 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.046 -0.525 . . . . 1.0 110.367 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -67.35 -38.17 84.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.245 -0.434 . . . . 1.0 111.445 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1322 ' ' MET . . . . . . . . . . . . . 72.1 mmm -64.13 -40.15 95.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.868 0.366 . . . . 1.0 110.547 -179.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -66.41 -47.42 70.58 Favored Glycine 0 CA--C 1.527 0.816 0 N-CA-C 111.574 -0.61 . . . . 1.0 111.574 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -66.09 -38.87 89.35 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.912 -0.315 . . . . 1.0 111.301 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -59.15 -48.3 82.11 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.358 -0.383 . . . . 1.0 111.206 -179.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1326 ' ' MET . . . . . 0.456 ' O ' ' OE1' ' A' 1330 ' ' GLU . 98.0 mmm -62.59 -43.97 97.49 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.729 -0.388 . . . . 1.0 111.085 -179.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -68.48 -32.78 73.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.528 -0.306 . . . . 1.0 111.694 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1328 ' ' ALA . . . . . . . . . . . . . . . -62.34 -33.65 75.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.677 0.275 . . . . 1.0 111.641 -178.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 98.7 mt -58.75 -26.49 64.04 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.707 0.289 . . . . 1.0 111.095 -179.485 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1330 ' ' GLU . . . . . 0.529 ' N ' ' OE1' ' A' 1330 ' ' GLU . 56.1 mp0 -88.84 -2.08 58.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.357 -0.383 . . . . 1.0 111.544 -179.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 98.4 mttt -120.41 21.46 11.64 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 112.698 0.629 . . . . 1.0 112.698 -177.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1332 ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -104.38 131.03 52.18 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 121.092 0.472 . . . . 1.0 110.585 179.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -101.13 -176.28 3.11 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.553 -0.749 . . . . 1.0 109.95 178.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -37.05 154.62 0.09 OUTLIER Pre-proline 0 CA--C 1.538 0.496 0 CA-C-N 116.147 -0.479 . . . . 1.0 110.846 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -52.97 157.43 8.08 Favored 'Trans proline' 0 N--CA 1.493 1.481 0 C-N-CA 121.336 1.357 . . . . 1.0 111.483 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 1336 ' ' GLN . . . . . 0.415 ' H ' HD22 ' A' 1272 ' ' LEU . 99.4 mm-40 -37.17 109.9 0.11 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 120.941 0.4 . . . . 1.0 111.095 -179.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 1337 ' ' MET . . . . . . . . . . . . . 94.1 mmm . . . . . 0 C--O 1.219 -0.518 0 CA-C-O 117.847 -1.073 . . . . 1.0 110.659 179.785 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A 1259 ' ' ASN . . . . . . . . . . . . . 91.4 m-20 . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.301 -0.629 . . . . 1.0 109.301 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A 1260 ' ' ASP . . . . . 0.713 ' H ' ' CD ' ' A' 1261 ' ' PRO . 0.0 OUTLIER -154.66 -43.49 0.0 OUTLIER Pre-proline 0 CA--C 1.537 0.448 0 CA-C-N 116.416 -0.356 . . . . 1.0 111.319 -179.966 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A 1261 ' ' PRO . . . . . 0.713 ' CD ' ' H ' ' A' 1260 ' ' ASP . 45.7 Cg_exo -58.62 -31.55 94.87 Favored 'Trans proline' 0 N--CA 1.499 1.84 0 C-N-CA 122.33 2.02 . . . . 1.0 112.811 -179.108 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 52.1 mtpt -94.42 8.25 42.69 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.497 -0.32 . . . . 1.0 111.371 -179.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1263 ' ' SER . . . . . . . . . . . . . 55.7 m -56.73 -45.23 82.08 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.569 -0.452 . . . . 1.0 110.532 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 28.1 mp0 -67.4 -40.91 85.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.993 0.425 . . . . 1.0 110.552 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1265 ' ' LEU . . . . . 0.474 ' N ' ' CD2' ' A' 1265 ' ' LEU . 2.2 mm? -62.96 -42.97 99.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.905 -0.589 . . . . 1.0 110.574 -179.645 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -65.31 -44.35 88.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.316 -0.402 . . . . 1.0 111.292 -179.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -63.86 -39.27 93.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.454 -0.339 . . . . 1.0 111.267 -179.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1268 ' ' CYS . . . . . . . . . . . . . 97.4 m -63.94 -35.92 82.26 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.36 -0.382 . . . . 1.0 110.747 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 77.2 m -60.2 -36.23 77.19 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.121 -0.49 . . . . 1.0 111.341 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1270 ' ' LEU . . . . . . . . . . . . . 90.2 mt -62.9 -41.04 99.29 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.447 -0.342 . . . . 1.0 111.086 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1271 ' ' THR . . . . . . . . . . . . . 40.4 p -64.83 -30.36 71.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.503 -0.317 . . . . 1.0 111.55 -179.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1272 ' ' LEU . . . . . 0.485 HD22 ' H ' ' A' 1336 ' ' GLN . 70.5 mt -78.71 96.6 5.6 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.87 0.367 . . . . 1.0 111.175 -179.052 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 46.8 mmm-85 -119.01 111.22 18.04 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.058 -0.519 . . . . 1.0 110.23 179.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1274 ' ' THR . . . . . . . . . . . . . 27.3 m -129.49 139.36 51.59 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 120.733 0.301 . . . . 1.0 110.458 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 78.8 tt0 -129.2 146.73 51.06 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.214 -0.448 . . . . 1.0 110.186 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 82.48 12.97 79.51 Favored Glycine 0 CA--C 1.524 0.651 0 N-CA-C 111.064 -0.814 . . . . 1.0 111.064 179.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 23.9 mtpp -136.55 -172.84 3.26 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.184 0.516 . . . . 1.0 110.919 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 87.7 mt-10 -96.37 108.57 42.74 Favored Pre-proline 0 CA--C 1.533 0.321 0 CA-C-N 115.259 -0.882 . . . . 1.0 109.046 179.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -50.21 133.12 35.34 Favored 'Trans proline' 0 N--CA 1.491 1.341 0 C-N-CA 121.173 1.249 . . . . 1.0 112.38 -179.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -139.68 124.18 18.18 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.512 -0.767 . . . . 1.0 109.28 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 7.0 mt -143.93 134.82 12.37 Favored Pre-proline 0 CA--C 1.537 0.461 0 CA-C-O 119.154 -0.45 . . . . 1.0 109.939 -178.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -52.24 131.71 40.89 Favored 'Trans proline' 0 N--CA 1.492 1.39 0 CA-C-N 120.322 1.151 . . . . 1.0 111.132 177.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 69.1 mt -130.13 140.65 50.76 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.918 0.389 . . . . 1.0 110.14 179.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1284 ' ' TYR . . . . . 0.412 ' CE2' HG22 ' A' 1302 ' ' VAL . 29.0 m-85 -82.32 141.8 32.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.877 -0.601 . . . . 1.0 111.785 -178.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -143.49 108.46 4.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.31 -0.859 . . . . 1.0 109.447 179.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 16.6 m -64.09 142.89 58.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.272 0.558 . . . . 1.0 110.779 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1287 ' ' LEU . . . . . 0.591 ' CD2' ' N ' ' A' 1287 ' ' LEU . 1.0 OUTLIER -80.92 -174.14 4.64 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.216 -0.902 . . . . 1.0 110.015 -179.352 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 99.3 mm-40 -108.86 130.59 55.42 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 109.695 -0.483 . . . . 1.0 109.695 179.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1289 ' ' THR . . . . . . . . . . . . . 64.9 p -87.46 116.97 25.93 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.927 0.394 . . . . 1.0 111.359 -179.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1290 ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' 1290 ' ' VAL . 24.1 m -149.99 122.14 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.183 0 CA-C-N 116.04 -0.527 . . . . 1.0 109.99 178.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -142.14 160.69 27.21 Favored Glycine 0 CA--C 1.524 0.653 0 N-CA-C 110.516 -1.034 . . . . 1.0 110.516 179.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 22.1 Cg_endo -59.27 -43.36 41.78 Favored 'Trans proline' 0 C--N 1.308 -1.573 0 C-N-CA 122.214 1.943 . . . . 1.0 111.038 179.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1293 ' ' SER . . . . . . . . . . . . . 46.9 t -92.3 165.16 13.23 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.569 -0.741 . . . . 1.0 110.331 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 80.8 m80 -59.93 -6.73 1.4 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.334 -0.394 . . . . 1.0 110.389 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -66.7 148.46 51.88 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.081 -0.509 . . . . 1.0 110.612 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -129.9 143.73 50.95 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 116.236 -0.438 . . . . 1.0 110.628 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1297 ' ' THR . . . . . . . . . . . . . 84.8 m -123.54 128.7 50.13 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 115.933 -0.576 . . . . 1.0 109.526 179.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -102.03 118.98 38.05 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.184 0.516 . . . . 1.0 111.567 -178.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1299 ' ' THR . . . . . . . . . . . . . 91.9 m -127.71 130.13 48.32 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.557 -0.747 . . . . 1.0 109.815 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 53.3 t -117.31 129.94 73.01 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 N-CA-C 109.714 -0.476 . . . . 1.0 109.714 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -130.52 143.82 51.01 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.306 -0.407 . . . . 1.0 111.117 -179.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1302 ' ' VAL . . . . . 0.412 HG22 ' CE2' ' A' 1284 ' ' TYR . 24.9 t -107.37 126.86 63.56 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 CA-C-N 116.019 -0.537 . . . . 1.0 109.599 179.098 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -104.68 130.18 52.76 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.847 0.356 . . . . 1.0 110.539 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 61.8 t80 -142.56 109.03 5.32 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.172 -0.467 . . . . 1.0 110.371 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 68.1 mttm 52.17 27.71 4.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.12 -0.491 . . . . 1.0 110.894 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 80.14 12.22 83.5 Favored Glycine 0 CA--C 1.524 0.654 0 N-CA-C 111.378 -0.689 . . . . 1.0 111.378 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -109.92 120.15 41.56 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 110.023 -0.362 . . . . 1.0 110.023 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 61.6 ttp180 -75.98 126.04 30.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.341 -0.391 . . . . 1.0 110.354 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 31.5 pt -122.26 23.12 4.49 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-N 116.099 -0.5 . . . . 1.0 110.387 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -156.86 153.4 24.67 Favored Glycine 0 CA--C 1.524 0.639 0 N-CA-C 110.781 -0.928 . . . . 1.0 110.781 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 12.0 t -172.44 105.91 0.17 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.733 0.301 . . . . 1.0 110.557 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -173.48 167.85 40.62 Favored Glycine 0 CA--C 1.524 0.604 0 N-CA-C 111.108 -0.797 . . . . 1.0 111.108 179.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 69.0 mttm -139.61 144.08 37.55 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.811 0.338 . . . . 1.0 110.444 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -157.78 171.95 34.95 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 110.562 -1.015 . . . . 1.0 110.562 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.78 -76.83 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.66 0 C-N-CA 122.54 2.16 . . . . 1.0 111.759 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1316 ' ' SER . . . . . . . . . . . . . 16.2 p -76.28 162.0 28.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.015 0.436 . . . . 1.0 111.116 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 39.1 mm -63.83 -43.81 97.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.887 -0.597 . . . . 1.0 110.797 -179.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 -57.12 -40.27 76.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.305 -0.407 . . . . 1.0 110.877 -179.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 19.0 mm100 -62.85 -42.49 99.77 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.849 0.357 . . . . 1.0 110.66 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -67.08 -37.9 84.79 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.081 -0.508 . . . . 1.0 111.425 -179.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -66.12 -40.02 90.36 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.146 0.424 . . . . 1.0 112.146 -178.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1322 ' ' MET . . . . . . . . . . . . . 74.7 mtm -64.01 -41.35 97.49 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.495 -0.482 . . . . 1.0 111.161 -179.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -64.29 -46.04 91.83 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 120.862 -0.685 . . . . 1.0 111.678 -179.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -66.23 -37.49 85.65 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 111.891 0.33 . . . . 1.0 111.891 -179.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -62.52 -41.74 99.05 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 111.893 0.331 . . . . 1.0 111.893 -178.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1326 ' ' MET . . . . . . . . . . . . . 74.1 mmm -62.92 -44.39 96.21 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.59 -0.444 . . . . 1.0 111.259 -179.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -68.25 -33.35 74.21 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.858 -0.337 . . . . 1.0 110.278 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1328 ' ' ALA . . . . . . . . . . . . . . . -57.45 -37.33 72.67 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.054 -0.521 . . . . 1.0 111.072 -179.328 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 76.5 mt -62.03 -36.52 81.84 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.78 0.324 . . . . 1.0 110.685 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -82.98 8.32 13.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.29 -0.414 . . . . 1.0 111.273 -179.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 96.5 mttt -135.81 40.51 2.74 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.395 0.517 . . . . 1.0 112.395 -177.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1332 ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -107.18 151.23 25.69 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 121.075 0.464 . . . . 1.0 110.181 179.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 80.2 m-20 -123.77 -176.74 3.55 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.552 -0.749 . . . . 1.0 109.982 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -37.86 150.54 0.17 Allowed Pre-proline 0 CA--C 1.535 0.387 0 CA-C-N 116.257 -0.428 . . . . 1.0 110.831 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -68.93 156.77 64.3 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 122.478 2.118 . . . . 1.0 112.252 -179.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 1336 ' ' GLN . . . . . 0.485 ' H ' HD22 ' A' 1272 ' ' LEU . 99.2 mm-40 -39.22 117.82 0.73 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.927 -0.579 . . . . 1.0 110.926 -179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 1337 ' ' MET . . . . . . . . . . . . . 3.3 ttt . . . . . 0 C--O 1.22 -0.472 0 CA-C-O 117.959 -1.02 . . . . 1.0 110.477 -179.76 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A 1259 ' ' ASN . . . . . . . . . . . . . 23.8 t-20 . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 109.477 -0.564 . . . . 1.0 109.477 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A 1260 ' ' ASP . . . . . . . . . . . . . 5.6 t70 59.83 55.55 4.52 Favored Pre-proline 0 CA--C 1.533 0.292 0 CA-C-N 116.179 -0.464 . . . . 1.0 110.602 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1261 ' ' PRO . . . . . 0.43 ' C ' ' H ' ' A' 1263 ' ' SER . 91.9 Cg_endo -75.99 153.2 37.0 Favored 'Trans proline' 0 N--CA 1.496 1.627 0 C-N-CA 123.006 2.471 . . . . 1.0 113.037 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 55.7 mtmt 52.55 8.52 0.08 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.972 -0.558 . . . . 1.0 111.628 178.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1263 ' ' SER . . . . . 0.43 ' H ' ' C ' ' A' 1261 ' ' PRO . 45.5 m -58.82 -38.51 78.81 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.71 -0.396 . . . . 1.0 110.419 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -63.37 -47.45 82.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.955 -0.566 . . . . 1.0 111.386 -179.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1265 ' ' LEU . . . . . 0.425 ' CD1' ' OH ' ' A' 1284 ' ' TYR . 91.7 mt -64.23 -42.59 96.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.526 -0.306 . . . . 1.0 111.099 -179.449 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -63.67 -42.8 98.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.327 -0.397 . . . . 1.0 110.908 -179.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -65.85 -39.68 90.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.813 0.34 . . . . 1.0 110.54 179.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1268 ' ' CYS . . . . . . . . . . . . . 95.4 m -62.82 -34.83 78.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.984 -0.553 . . . . 1.0 111.062 -179.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 77.5 m -54.83 -40.21 69.36 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 120.773 -0.371 . . . . 1.0 110.738 -179.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1270 ' ' LEU . . . . . 0.499 HD22 ' N ' ' A' 1270 ' ' LEU . 4.0 mm? -65.02 -39.96 94.15 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.079 -0.509 . . . . 1.0 111.241 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1271 ' ' THR . . . . . . . . . . . . . 80.4 p -63.88 -31.96 73.33 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.83 0.307 . . . . 1.0 111.83 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 71.8 mt -77.19 86.14 3.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.618 0.246 . . . . 1.0 111.056 -179.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -120.02 131.81 55.26 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 120.753 0.311 . . . . 1.0 111.07 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1274 ' ' THR . . . . . . . . . . . . . 9.3 m -128.54 139.68 52.18 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 109.176 -0.676 . . . . 1.0 109.176 178.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -107.85 133.01 52.83 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.208 0.528 . . . . 1.0 111.048 -179.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 80.85 5.17 90.24 Favored Glycine 0 CA--C 1.527 0.797 0 CA-C-N 115.705 -0.679 . . . . 1.0 112.474 178.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 43.3 mtpt -139.95 -174.24 3.86 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.614 0.721 . . . . 1.0 112.054 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 16.5 mp0 -99.01 108.84 51.54 Favored Pre-proline 0 CA--C 1.538 0.491 0 CA-C-N 114.752 -1.113 . . . . 1.0 109.946 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1279 ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -80.86 113.7 2.81 Favored 'Trans proline' 0 N--CA 1.496 1.668 0 C-N-CA 122.0 1.8 . . . . 1.0 112.798 -179.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1280 ' ' ASP . . . . . . . . . . . . . 90.7 m-20 -83.21 148.88 27.16 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.867 -0.606 . . . . 1.0 109.956 179.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1281 ' ' ILE . . . . . . . . . . . . . 3.0 mt -140.85 132.41 13.89 Favored Pre-proline 0 CA--C 1.538 0.498 0 N-CA-C 109.303 -0.628 . . . . 1.0 109.303 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -55.2 139.08 80.62 Favored 'Trans proline' 0 N--CA 1.492 1.43 0 CA-C-N 120.787 1.317 . . . . 1.0 110.983 178.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 97.0 mt -126.35 147.96 49.66 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.474 -0.33 . . . . 1.0 110.242 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1284 ' ' TYR . . . . . 0.425 ' OH ' ' CD1' ' A' 1265 ' ' LEU . 36.0 m-85 -78.0 142.79 38.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.094 -0.503 . . . . 1.0 111.132 -179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 65.0 tttm -145.23 106.64 4.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.472 -0.785 . . . . 1.0 109.49 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 41.5 m -69.41 133.93 48.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.062 -0.517 . . . . 1.0 111.267 -179.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 67.6 mt -81.23 -172.48 3.8 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.908 -0.587 . . . . 1.0 110.081 179.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 91.6 mm-40 -109.22 140.91 42.23 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.053 -0.521 . . . . 1.0 110.032 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1289 ' ' THR . . . . . . . . . . . . . 30.1 p -99.35 114.98 28.16 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.166 -0.47 . . . . 1.0 111.085 -179.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1290 ' ' VAL . . . . . 0.476 ' O ' HG23 ' A' 1290 ' ' VAL . 28.0 m -133.09 122.3 45.44 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 N-CA-C 109.927 -0.397 . . . . 1.0 109.927 178.455 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -143.62 167.51 26.61 Favored Glycine 0 CA--C 1.526 0.72 0 N-CA-C 111.056 -0.817 . . . . 1.0 111.056 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.47 -49.5 0.6 Allowed 'Trans proline' 0 C--N 1.308 -1.596 0 C-N-CA 122.688 2.259 . . . . 1.0 111.214 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1293 ' ' SER . . . . . . . . . . . . . 14.8 t -88.52 164.33 15.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.483 -0.781 . . . . 1.0 110.544 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 40.0 m80 -59.5 -11.35 4.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.315 -0.402 . . . . 1.0 110.416 179.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -67.14 143.28 56.71 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.544 -0.539 . . . . 1.0 109.544 179.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -127.73 149.01 50.42 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.141 0.496 . . . . 1.0 111.69 -178.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1297 ' ' THR . . . . . . . . . . . . . 88.8 m -121.72 122.0 38.56 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.461 -0.79 . . . . 1.0 109.064 178.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -94.34 126.11 39.39 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.189 0.518 . . . . 1.0 111.212 -179.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1299 ' ' THR . . . . . . . . . . . . . 91.1 m -127.24 130.63 49.98 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.765 -0.652 . . . . 1.0 110.17 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 55.4 t -120.84 130.39 74.67 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 N-CA-C 110.078 -0.341 . . . . 1.0 110.078 179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -130.56 145.27 51.84 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.127 -0.488 . . . . 1.0 110.616 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 18.7 t -107.82 128.69 62.89 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 N-CA-C 109.432 -0.581 . . . . 1.0 109.432 179.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -106.96 137.65 44.62 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 116.469 -0.332 . . . . 1.0 110.989 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1304 ' ' PHE . . . . . 0.496 ' O ' ' N ' ' A' 1307 ' ' GLU . 50.6 t80 -139.34 119.33 13.45 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.334 -0.394 . . . . 1.0 110.168 179.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1305 ' ' LYS . . . . . 0.412 ' NZ ' ' OE1' ' A' 1336 ' ' GLN . 51.8 mttp 39.51 39.34 0.48 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.367 -0.379 . . . . 1.0 111.566 -179.813 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 79.09 20.37 70.24 Favored Glycine 0 CA--C 1.528 0.852 0 C-N-CA 121.127 -0.559 . . . . 1.0 112.221 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1307 ' ' GLU . . . . . 0.496 ' N ' ' O ' ' A' 1304 ' ' PHE . 98.1 mt-10 -125.98 147.79 49.43 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.81 0.338 . . . . 1.0 110.309 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1308 ' ' ARG . . . . . . . . . . . . . 57.1 ttp180 -91.59 126.15 36.58 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.039 -0.528 . . . . 1.0 110.106 179.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 45.0 pt -132.38 16.37 1.63 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-N 116.461 -0.336 . . . . 1.0 110.856 -179.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1310 ' ' GLY . . . . . . . . . . . . . . . -157.47 151.63 22.89 Favored Glycine 0 CA--C 1.523 0.574 0 N-CA-C 111.084 -0.806 . . . . 1.0 111.084 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 30.3 p -173.6 138.5 0.67 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.725 0.298 . . . . 1.0 110.445 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . 179.27 162.01 27.75 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.979 -0.849 . . . . 1.0 110.979 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 59.8 mttp -141.93 142.66 33.03 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-O 120.735 0.302 . . . . 1.0 110.341 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -164.11 -178.87 37.97 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 110.701 -0.96 . . . . 1.0 110.701 179.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -63.65 -70.79 0.03 OUTLIER 'Trans proline' 0 C--N 1.311 -1.435 0 C-N-CA 121.689 1.593 . . . . 1.0 111.237 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1316 ' ' SER . . . . . . . . . . . . . 4.9 p -90.06 171.57 9.45 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.049 -0.523 . . . . 1.0 110.402 179.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 39.2 mm -64.19 -42.99 97.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.821 -0.627 . . . . 1.0 110.413 179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -53.2 -42.0 65.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.776 -0.647 . . . . 1.0 111.833 -178.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 13.8 mp0 -67.3 -40.46 86.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.698 0.285 . . . . 1.0 110.459 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -65.69 -37.81 87.51 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.225 -0.443 . . . . 1.0 111.455 -179.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -65.92 -38.37 88.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.382 -0.372 . . . . 1.0 111.84 -178.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1322 ' ' MET . . . . . . . . . . . . . 61.6 mtt -62.3 -43.62 98.39 Favored 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 120.865 -0.334 . . . . 1.0 111.403 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -67.7 -40.2 90.16 Favored Glycine 0 CA--C 1.526 0.745 0 N-CA-C 111.634 -0.586 . . . . 1.0 111.634 -179.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -65.94 -38.78 89.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.678 0.275 . . . . 1.0 111.618 -179.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -65.82 -39.63 91.05 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.34 0.496 . . . . 1.0 112.34 -178.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1326 ' ' MET . . . . . . . . . . . . . 8.3 ttt -63.08 -38.83 92.76 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.76 -0.376 . . . . 1.0 110.824 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 56.7 m-20 -64.76 -31.93 73.38 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.203 -0.453 . . . . 1.0 110.645 -179.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1328 ' ' ALA . . . . . 0.545 ' O ' ' CD2' ' A' 1332 ' ' TYR . . . -57.31 -26.59 61.15 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.584 -0.28 . . . . 1.0 111.475 -179.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1329 ' ' LEU . . . . . 0.489 HD22 ' N ' ' A' 1329 ' ' LEU . 3.7 mm? -61.72 -41.95 98.3 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.84 -0.344 . . . . 1.0 110.946 -179.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -93.16 14.22 18.71 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 121.062 -0.255 . . . . 1.0 111.113 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 64.9 mttm -135.52 42.28 2.7 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 120.685 -0.406 . . . . 1.0 111.706 -178.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1332 ' ' TYR . . . . . 0.545 ' CD2' ' O ' ' A' 1328 ' ' ALA . 8.7 m-85 -108.7 145.5 34.94 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.303 0.573 . . . . 1.0 110.712 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1333 ' ' ASN . . . . . . . . . . . . . 15.9 m120 -127.08 -176.07 3.61 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.209 -0.905 . . . . 1.0 109.404 179.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1334 ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -41.26 141.04 1.13 Allowed Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 121.075 -0.25 . . . . 1.0 110.766 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1335 ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -75.77 172.64 15.91 Favored 'Trans proline' 0 N--CA 1.498 1.739 0 C-N-CA 122.72 2.28 . . . . 1.0 112.245 179.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 1336 ' ' GLN . . . . . 0.412 ' OE1' ' NZ ' ' A' 1305 ' ' LYS . 14.0 mm100 -50.41 115.1 1.31 Allowed 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.782 -0.451 . . . . 1.0 109.782 179.385 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 1337 ' ' MET . . . . . . . . . . . . . 1.5 tpt . . . . . 0 C--O 1.22 -0.483 0 CA-C-O 118.026 -0.988 . . . . 1.0 110.167 -179.692 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A 1259 ' ' ASN . . . . . 0.431 ' OD1' ' O ' ' A' 1259 ' ' ASN . 27.0 p30 . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 109.631 -0.507 . . . . 1.0 109.631 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1260 ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -79.59 151.04 74.02 Favored Pre-proline 0 CA--C 1.534 0.356 0 CA-C-N 116.021 -0.536 . . . . 1.0 110.188 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1261 ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -66.55 -20.92 53.44 Favored 'Trans proline' 0 N--CA 1.497 1.688 0 C-N-CA 122.421 2.081 . . . . 1.0 111.784 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1262 ' ' LYS . . . . . . . . . . . . . 98.8 mttt -63.47 -41.85 98.61 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.045 -0.525 . . . . 1.0 110.536 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1263 ' ' SER . . . . . . . . . . . . . 51.0 m -58.92 -36.88 75.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.134 -0.485 . . . . 1.0 110.616 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1264 ' ' GLN . . . . . . . . . . . . . 14.3 mp0 -61.15 -42.68 98.99 Favored 'General case' 0 C--N 1.33 -0.277 0 C-N-CA 120.819 -0.352 . . . . 1.0 110.265 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1265 ' ' LEU . . . . . 0.419 ' CD2' ' OH ' ' A' 1332 ' ' TYR . 83.4 mt -62.89 -41.52 99.44 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 120.742 -0.383 . . . . 1.0 110.031 179.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1266 ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -63.82 -43.23 96.85 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 120.801 -0.36 . . . . 1.0 110.798 179.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1267 ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -65.32 -39.52 92.56 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.854 0.359 . . . . 1.0 110.819 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1268 ' ' CYS . . . . . . . . . . . . . 88.5 m -64.5 -37.36 87.26 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.016 -0.538 . . . . 1.0 111.178 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1269 ' ' CYS . . . . . . . . . . . . . 70.9 m -51.14 -41.38 60.06 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 120.55 -0.46 . . . . 1.0 110.865 -178.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1270 ' ' LEU . . . . . 0.523 HD22 ' N ' ' A' 1270 ' ' LEU . 3.6 mm? -64.39 -41.25 96.77 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.809 0.338 . . . . 1.0 110.801 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1271 ' ' THR . . . . . . . . . . . . . 48.0 p -66.56 -30.19 70.43 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.276 -0.42 . . . . 1.0 111.477 -179.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1272 ' ' LEU . . . . . . . . . . . . . 92.5 mt -76.34 102.67 6.0 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.435 -0.506 . . . . 1.0 110.725 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1273 ' ' ARG . . . . . . . . . . . . . 78.3 mtp85 -119.96 142.64 48.57 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.126 -0.488 . . . . 1.0 109.913 179.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1274 ' ' THR . . . . . . . . . . . . . 8.4 m -113.67 128.02 56.27 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 120.808 0.337 . . . . 1.0 110.188 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1275 ' ' GLU . . . . . . . . . . . . . 50.4 tp10 -129.54 112.06 13.37 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.408 -0.36 . . . . 1.0 110.861 -179.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1276 ' ' GLY . . . . . . . . . . . . . . . 74.03 24.63 73.34 Favored Glycine 0 CA--C 1.527 0.823 0 CA-C-N 115.98 -0.555 . . . . 1.0 112.203 178.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1277 ' ' LYS . . . . . . . . . . . . . 4.1 mtpp -136.58 -163.48 1.42 Allowed 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.335 0.588 . . . . 1.0 110.61 -179.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1278 ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -95.11 108.24 37.19 Favored Pre-proline 0 CA--C 1.541 0.623 0 CA-C-N 114.865 -1.061 . . . . 1.0 109.277 179.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1279 ' ' PRO . . . . . 0.437 ' O ' ' OD1' ' A' 1280 ' ' ASP . 50.4 Cg_exo -49.79 122.84 9.63 Favored 'Trans proline' 0 N--CA 1.494 1.524 0 C-N-CA 121.506 1.471 . . . . 1.0 112.657 -179.326 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1280 ' ' ASP . . . . . 0.437 ' OD1' ' O ' ' A' 1279 ' ' PRO . 96.0 m-20 -143.82 124.26 13.94 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.656 -0.702 . . . . 1.0 109.392 178.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1281 ' ' ILE . . . . . 0.462 ' N ' HD12 ' A' 1281 ' ' ILE . 1.5 mp -137.77 135.57 19.09 Favored Pre-proline 0 CA--C 1.541 0.605 0 CA-C-N 116.242 -0.436 . . . . 1.0 110.424 -178.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1282 ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -54.77 139.65 77.62 Favored 'Trans proline' 0 N--CA 1.496 1.64 0 CA-C-N 120.345 1.159 . . . . 1.0 111.213 178.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1283 ' ' LEU . . . . . . . . . . . . . 87.4 mt -138.46 153.81 48.83 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.231 -0.44 . . . . 1.0 110.157 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1284 ' ' TYR . . . . . . . . . . . . . 81.9 m-85 -81.66 136.04 35.51 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.438 -0.346 . . . . 1.0 110.814 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1285 ' ' LYS . . . . . . . . . . . . . 12.3 ttmm -138.83 126.02 21.42 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.204 -0.453 . . . . 1.0 109.869 178.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1286 ' ' THR . . . . . . . . . . . . . 92.3 m -99.15 125.7 44.76 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.967 0.413 . . . . 1.0 110.428 -179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1287 ' ' LEU . . . . . . . . . . . . . 82.0 mt -77.54 -169.7 1.54 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.626 -0.716 . . . . 1.0 110.419 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1288 ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -107.93 141.19 39.93 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.449 -0.341 . . . . 1.0 110.466 -179.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1289 ' ' THR . . . . . . . . . . . . . 16.9 p -87.84 114.47 24.49 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.082 -0.508 . . . . 1.0 110.858 -179.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1290 ' ' VAL . . . . . . . . . . . . . 17.4 m -131.71 122.1 49.08 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-O 120.968 0.413 . . . . 1.0 110.38 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1291 ' ' GLY . . . . . . . . . . . . . . . -144.52 157.71 27.3 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 110.569 -1.013 . . . . 1.0 110.569 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1292 ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.74 -38.51 7.74 Favored 'Trans proline' 0 C--N 1.308 -1.563 0 C-N-CA 121.886 1.724 . . . . 1.0 110.691 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1293 ' ' SER . . . . . . . . . . . . . 26.7 t -92.74 165.22 13.05 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.503 -0.771 . . . . 1.0 110.211 179.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1294 ' ' HIS . . . . . . . . . . . . . 78.9 m80 -57.61 -12.93 3.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.055 0.455 . . . . 1.0 109.839 179.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1295 ' ' ALA . . . . . . . . . . . . . . . -63.37 145.16 56.16 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.805 -0.634 . . . . 1.0 110.554 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1296 ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -128.41 140.13 52.0 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.03 0.443 . . . . 1.0 110.958 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1297 ' ' THR . . . . . . . . . . . . . 80.6 m -123.03 130.25 52.55 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.789 -0.642 . . . . 1.0 109.648 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1298 ' ' TYR . . . . . . . . . . . . . 92.7 m-85 -100.07 131.46 46.01 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.148 0.499 . . . . 1.0 111.331 -178.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1299 ' ' THR . . . . . . . . . . . . . 90.1 m -127.42 131.91 50.18 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.61 -0.723 . . . . 1.0 110.017 179.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1300 ' ' VAL . . . . . . . . . . . . . 55.8 t -118.42 129.48 74.66 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 109.963 -0.384 . . . . 1.0 109.963 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1301 ' ' ALA . . . . . . . . . . . . . . . -129.69 144.42 51.28 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.09 -0.505 . . . . 1.0 110.589 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1302 ' ' VAL . . . . . . . . . . . . . 24.3 t -111.61 128.24 68.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 N-CA-C 109.015 -0.735 . . . . 1.0 109.015 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1303 ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -106.95 139.98 40.48 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 121.22 0.533 . . . . 1.0 111.622 -178.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1304 ' ' PHE . . . . . . . . . . . . . 75.5 t80 -140.99 106.64 5.1 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 115.429 -0.805 . . . . 1.0 110.118 179.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1305 ' ' LYS . . . . . . . . . . . . . 55.6 mtpt 50.19 34.35 8.49 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.806 0.336 . . . . 1.0 110.736 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1306 ' ' GLY . . . . . . . . . . . . . . . 83.81 18.71 62.95 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 121.343 -0.456 . . . . 1.0 111.994 179.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1307 ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -121.68 144.07 48.98 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 109.887 -0.412 . . . . 1.0 109.887 179.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1308 ' ' ARG . . . . . 0.51 ' NE ' ' O ' ' A' 1310 ' ' GLY . 75.5 ttt180 -96.84 122.06 39.4 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.84 0.352 . . . . 1.0 110.144 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1309 ' ' ILE . . . . . . . . . . . . . 35.4 pt -118.48 22.93 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-N 116.149 -0.478 . . . . 1.0 110.66 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1310 ' ' GLY . . . . . 0.51 ' O ' ' NE ' ' A' 1308 ' ' ARG . . . -159.38 153.99 25.05 Favored Glycine 0 CA--C 1.524 0.609 0 N-CA-C 110.659 -0.977 . . . . 1.0 110.659 179.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1311 ' ' CYS . . . . . . . . . . . . . 8.7 p -174.17 121.42 0.29 Allowed 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.712 -0.395 . . . . 1.0 111.068 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1312 ' ' GLY . . . . . . . . . . . . . . . -174.33 168.28 40.96 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.945 -0.862 . . . . 1.0 110.945 179.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1313 ' ' LYS . . . . . . . . . . . . . 61.7 mttp -138.95 149.41 44.73 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.918 0.389 . . . . 1.0 110.607 -179.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1314 ' ' GLY . . . . . . . . . . . . . . . -169.06 167.74 40.69 Favored Glycine 0 CA--C 1.525 0.678 0 N-CA-C 110.438 -1.065 . . . . 1.0 110.438 179.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1315 ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.67 -53.74 0.42 Allowed 'Trans proline' 0 C--N 1.307 -1.654 0 C-N-CA 122.449 2.099 . . . . 1.0 111.545 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1316 ' ' SER . . . . . . . . . . . . . 82.6 p -97.08 161.47 13.81 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.111 0.481 . . . . 1.0 110.98 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1317 ' ' ILE . . . . . . . . . . . . . 40.3 mm -67.12 -42.6 88.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.655 -0.702 . . . . 1.0 111.317 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1318 ' ' GLN . . . . . . . . . . . . . 98.6 mm-40 -53.06 -47.08 68.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.314 -0.403 . . . . 1.0 111.575 -178.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1319 ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -67.29 -37.81 84.02 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.466 -0.333 . . . . 1.0 111.265 -179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1320 ' ' ALA . . . . . . . . . . . . . . . -62.25 -37.5 85.69 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.251 -0.431 . . . . 1.0 111.202 -179.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1321 ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -67.15 -38.58 85.72 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.288 -0.415 . . . . 1.0 111.901 -179.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1322 ' ' MET . . . . . . . . . . . . . 57.2 mtt -61.59 -43.07 99.53 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 120.634 -0.426 . . . . 1.0 111.049 -179.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1323 ' ' GLY . . . . . . . . . . . . . . . -63.92 -46.99 90.15 Favored Glycine 0 CA--C 1.524 0.628 0 N-CA-C 110.857 -0.897 . . . . 1.0 110.857 -179.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1324 ' ' ALA . . . . . . . . . . . . . . . -65.14 -43.13 92.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.817 0.341 . . . . 1.0 110.561 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1325 ' ' ALA . . . . . . . . . . . . . . . -68.29 -41.51 80.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.073 -0.512 . . . . 1.0 111.229 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1326 ' ' MET . . . . . . . . . . . . . 48.2 ttp -63.1 -43.68 97.81 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.011 0.434 . . . . 1.0 110.253 -179.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1327 ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -68.9 -29.56 67.86 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.771 -0.65 . . . . 1.0 110.602 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1328 ' ' ALA . . . . . 0.53 ' O ' ' CD2' ' A' 1332 ' ' TYR . . . -59.63 -25.31 64.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.105 -0.498 . . . . 1.0 111.777 -178.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1329 ' ' LEU . . . . . . . . . . . . . 96.2 mt -61.17 -41.52 96.93 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.943 -0.303 . . . . 1.0 110.967 -179.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1330 ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -89.29 11.22 19.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.565 -0.289 . . . . 1.0 111.352 -178.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1331 ' ' LYS . . . . . . . . . . . . . 64.1 mttm -129.52 40.69 3.56 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 112.084 0.402 . . . . 1.0 112.084 -178.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 1332 ' ' TYR . . . . . 0.53 ' CD2' ' O ' ' A' 1328 ' ' ALA . 16.0 m-85 -116.01 137.32 52.22 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 120.95 0.405 . . . . 1.0 110.298 179.202 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1333 ' ' ASN . . . . . 0.425 ' O ' ' C ' ' A' 1334 ' ' PHE . 97.1 m-20 -137.12 167.51 21.41 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.866 -0.607 . . . . 1.0 109.397 179.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1334 ' ' PHE . . . . . 0.425 ' C ' ' O ' ' A' 1333 ' ' ASN . 75.0 m-85 -30.68 94.06 0.06 OUTLIER Pre-proline 0 N--CA 1.47 0.532 0 O-C-N 123.518 0.511 . . . . 1.0 111.592 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1335 ' ' PRO . . . . . 0.436 ' O ' ' O ' ' A' 1336 ' ' GLN . 44.5 Cg_endo -91.4 -163.98 0.13 Allowed 'Trans proline' 0 N--CA 1.488 1.159 0 C-N-CA 122.942 2.428 . . . . 1.0 112.431 -179.086 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1336 ' ' GLN . . . . . 0.436 ' O ' ' O ' ' A' 1335 ' ' PRO . 13.5 mm100 -37.49 159.33 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.817 -0.629 . . . . 1.0 110.793 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 1337 ' ' MET . . . . . . . . . . . . . 27.4 ttt . . . . . 0 C--O 1.22 -0.476 0 CA-C-O 117.884 -1.055 . . . . 1.0 110.625 -179.665 . . . . . . . . 0 0 . 1 stop_ save_