data_2l5e_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 2l5e _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 ' 26' ' ' VAL . . . . . . . . . . . . . 9.2 p . . . . . 0 N--CA 1.453 -0.315 0 CA-C-O 121.808 0.813 . . . . 1.5 108.853 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -147.8 132.7 18.08 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 114.504 -1.225 . . . . 1.85 109.06 177.218 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.403 ' O ' ' HE3' ' A' ' 31' ' ' LYS . 23.8 t-20 -153.05 125.85 4.05 Favored Pre-proline 0 C--N 1.316 -0.876 0 CA-C-N 116.037 -0.529 . . . . 1.62 109.933 -178.252 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -65.85 -46.44 4.92 Favored 'Trans proline' 0 N--CA 1.474 0.378 0 C-N-CA 123.421 2.747 . . . . 2.05 113.271 -176.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.8 m -66.11 -32.53 74.04 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.293 0.568 . . . . 2.24 110.535 -177.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.403 ' HE3' ' O ' ' A' ' 28' ' ' ASN . 0.8 OUTLIER -78.52 123.66 85.55 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 115.379 -0.828 . . . . 3.33 109.73 178.215 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -48.16 136.25 24.38 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.811 2.341 . . . . 1.8 112.97 178.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.433 ' HA2' ' O ' ' A' ' 95' ' ' TYR . . . -162.64 62.32 0.27 Allowed Glycine 0 N--CA 1.444 -0.809 0 N-CA-C 110.816 -0.914 . . . . 0.97 110.816 179.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -80.09 167.9 19.81 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.006 0.431 . . . . 2.37 110.488 -177.468 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.8 mmtm -102.95 108.44 19.63 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 116.332 -0.395 . . . . 3.13 110.048 178.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.7 p -109.0 171.65 7.31 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 120.774 -0.37 . . . . 1.29 110.826 174.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -61.69 -50.51 72.19 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.801 -0.636 . . . . 1.47 110.937 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.568 ' HG2' ' SD ' ' A' ' 140' ' ' MET . 1.3 mt-30 -56.68 -44.37 81.38 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.714 0.292 . . . . 1.04 110.983 179.115 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.419 ' HB2' ' HA ' ' A' ' 97' ' ' SER . 0.8 OUTLIER -59.42 -56.0 27.52 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.088 -0.505 . . . . 1.39 111.13 -178.53 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -65.54 -33.48 76.02 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.013 -0.539 . . . . 1.75 110.48 -179.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.647 ' CE1' ' HG2' ' A' ' 140' ' ' MET . 61.2 t80 -58.17 -63.89 1.1 Allowed 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.758 -0.656 . . . . 1.2 110.858 178.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.65 -29.61 70.75 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.721 -0.392 . . . . 1.76 110.932 -171.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -62.16 -55.83 24.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.778 -0.646 . . . . 1.47 110.874 -179.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -87.2 -29.63 21.6 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.928 0.394 . . . . 0.53 111.91 -177.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 93.7 t -88.39 -57.66 4.07 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 N-CA-C 112.443 0.534 . . . . 1.11 112.443 -174.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 81.7 t -79.24 -66.27 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 C-N-CA 120.782 -0.367 . . . . 1.07 111.953 -170.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.2 p -67.72 -35.43 72.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 C-N-CA 120.518 -0.473 . . . . 1.44 111.498 -174.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.8 mttt -67.31 -31.31 71.52 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 122.013 -0.43 . . . . 2.85 111.619 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 48.1 m -81.34 -36.88 29.16 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.84 -0.344 . . . . 1.23 110.634 176.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.45 -40.46 71.6 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 108.703 -0.851 . . . . 1.11 108.703 171.326 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 10.5 t-105 -60.14 -37.69 80.84 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.441 -1.254 . . . . 0.44 111.912 178.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -77.23 -5.15 48.21 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.212 0.449 . . . . 2.75 112.212 -172.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.435 ' ND1' HD13 ' A' ' 129' ' ' LEU . 3.1 t-80 -72.62 130.41 40.51 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.672 -0.492 . . . . 0.47 109.672 176.329 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -75.55 -4.76 41.73 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.284 -0.416 . . . . 1.91 111.214 -174.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -100.06 -3.71 31.4 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.203 0.525 . . . . 1.24 109.866 175.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -93.81 10.06 34.67 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.856 -0.611 . . . . 1.09 110.913 -178.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.546 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 48.9 p-90 -65.46 -33.01 6.89 Favored Pre-proline 0 CA--C 1.548 0.889 0 N-CA-C 113.57 0.952 . . . . 0.65 113.57 -175.471 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.546 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 12.7 Cg_exo -71.54 -6.93 20.2 Favored 'Trans proline' 0 C--N 1.365 1.44 0 CA-C-N 121.088 1.424 . . . . 0.61 112.104 177.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -105.97 14.2 28.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.125 0.488 . . . . 1.52 110.137 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 10.4 m-30 -82.0 -11.21 58.95 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.839 -0.618 . . . . 1.01 110.714 179.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -122.19 125.09 26.7 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 116.281 -0.418 . . . . 2.11 111.06 -175.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.624 ' HA ' ' OD1' ' A' ' 82' ' ' ASP . 50.3 Cg_endo -71.07 150.93 61.06 Favored 'Trans proline' 0 C--O 1.236 0.422 0 C-N-CA 122.795 2.33 . . . . 1.1 112.49 -179.116 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 38.3 t -73.34 92.24 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 122.061 0.934 . . . . 1.46 110.395 176.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -87.11 -10.18 53.5 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.683 -1.144 . . . . 1.85 109.229 175.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 76.18 -45.26 0.51 Allowed 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 114.573 -1.194 . . . . 1.43 111.745 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 41.5 mm -80.04 -53.01 13.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 120.751 0.31 . . . . 2.38 110.639 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -53.28 -52.86 57.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.742 -0.663 . . . . 3.34 112.328 -177.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.2 tp -90.66 0.24 57.46 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.26 -0.427 . . . . 2.3 111.108 -177.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 57.23 56.6 5.05 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.688 -0.687 . . . . 1.89 112.083 178.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.5 mt -121.21 79.05 34.87 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 115.664 -0.698 . . . . 2.18 110.357 178.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -78.63 -37.52 0.65 Allowed 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.575 2.183 . . . . 1.42 113.131 -175.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.3 p-10 -86.62 -3.96 59.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.284 0.564 . . . . 1.97 110.604 -178.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -58.83 -39.34 80.94 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.328 -0.851 . . . . 1.53 110.496 175.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . 0.404 ' ND1' ' HG2' ' A' ' 80' ' ' PRO . 3.2 m-70 -76.94 0.77 19.82 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.228 -0.896 . . . . 1.22 111.417 -176.584 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.9 mttt -109.81 -41.38 4.53 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.448 -0.342 . . . . 3.34 111.099 -178.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.2 mt -86.43 -49.85 14.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 120.901 0.381 . . . . 1.5 111.082 -178.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 20.0 mm -80.57 131.8 33.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.329 -0.396 . . . . 1.19 110.324 -177.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.4 -56.68 8.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.029 -0.532 . . . . 2.35 111.214 -175.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . 0.431 ' OD1' HG21 ' A' ' 107' ' ' THR . 0.3 OUTLIER -122.27 89.75 49.05 Favored Pre-proline 0 C--N 1.324 -0.538 0 N-CA-C 110.067 -0.345 . . . . 2.05 110.067 178.432 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.404 ' HG2' ' ND1' ' A' ' 74' ' ' HIS . 32.4 Cg_exo -60.99 91.97 0.1 OUTLIER 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 123.038 2.492 . . . . 1.24 112.345 177.617 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 1.7 mmt -134.05 167.29 20.9 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.736 -0.665 . . . . 1.39 109.763 -179.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.624 ' OD1' ' HA ' ' A' ' 62' ' ' PRO . 5.6 p-10 -143.05 -116.71 0.1 Allowed 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.289 -0.869 . . . . 1.42 109.696 -173.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -128.33 -22.95 3.31 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.954 0.407 . . . . 1.14 110.337 177.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -82.75 -23.12 56.77 Favored Glycine 0 N--CA 1.441 -1.026 0 N-CA-C 110.738 -0.945 . . . . 0.33 110.738 -178.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.85 -41.66 22.82 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.304 -0.448 . . . . 1.6 110.552 177.305 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.419 HD11 ' O ' ' A' ' 82' ' ' ASP . 47.0 mt -58.42 -51.0 76.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.827 -0.624 . . . . 1.63 110.153 175.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.418 ' HZ3' ' CD ' ' A' ' 91' ' ' GLU . 0.1 OUTLIER -66.53 -24.68 66.42 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.903 -0.59 . . . . 1.71 111.185 -178.69 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.35 -45.42 76.41 Favored 'General case' 0 C--O 1.23 0.045 0 CA-C-O 120.772 0.32 . . . . 2.93 110.752 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.581 ' HD2' ' CD2' ' A' ' 94' ' ' TYR . 6.3 mtm180 -69.31 -30.54 68.62 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.345 -0.388 . . . . 1.49 110.757 177.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 12.6 mt -70.54 -49.62 46.24 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.441 -0.345 . . . . 1.14 111.284 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.418 ' CD ' ' HZ3' ' A' ' 87' ' ' LYS . 16.4 pt-20 -70.04 -21.53 63.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.812 0.339 . . . . 1.39 111.174 -177.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -96.53 5.66 50.33 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.181 -0.463 . . . . 1.66 110.618 179.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 53.36 54.25 10.46 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.84 -0.618 . . . . 1.75 111.478 178.295 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . 0.581 ' CD2' ' HD2' ' A' ' 89' ' ' ARG . 8.5 t80 -70.67 -44.19 67.56 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.292 -0.413 . . . . 1.3 111.786 -178.448 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . 0.457 ' CD1' ' HB3' ' A' ' 100' ' ' GLU . 0.3 OUTLIER -91.7 -172.35 3.19 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.67 0.748 . . . . 1.72 111.39 -179.272 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -94.59 -42.81 8.61 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 114.132 -1.395 . . . . 1.15 108.898 175.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.419 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 9.4 t -145.95 170.66 16.16 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.014 -0.994 . . . . 1.05 109.619 -176.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -69.16 -12.12 61.4 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.978 0.362 . . . . 1.31 111.978 -174.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.27 -26.76 68.93 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.845 0.355 . . . . 1.12 111.094 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.457 ' HB3' ' CD1' ' A' ' 95' ' ' TYR . 4.4 tp10 -82.13 -22.92 35.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.014 0.435 . . . . 2.44 110.37 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.6 t -76.65 -21.76 55.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.75 -0.659 . . . . 1.24 110.112 178.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -21.18 59.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.798 -0.637 . . . . 1.66 110.778 178.402 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -73.64 -57.18 4.17 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 116.022 -0.536 . . . . 3.72 110.602 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.99 -36.98 80.94 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.042 -0.526 . . . . 1.87 111.005 -176.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.19 -39.59 90.74 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.062 0.458 . . . . 0.45 110.847 177.021 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -67.46 -39.37 85.31 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.921 -0.581 . . . . 1.23 110.709 -178.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' THR . . . . . 0.431 HG21 ' OD1' ' A' ' 79' ' ' ASN . 47.5 m -70.69 -39.74 73.3 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.236 -0.438 . . . . 1.09 111.675 -177.444 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.519 ' HG3' ' N ' ' A' ' 109' ' ' PHE . 0.0 OUTLIER -54.05 -37.86 64.59 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.745 0.307 . . . . 1.44 111.278 -178.913 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . 0.519 ' N ' ' HG3' ' A' ' 108' ' ' MET . 7.3 m-85 -76.95 -43.73 34.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.362 -0.381 . . . . 0.29 110.98 -178.218 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -67.19 -39.96 86.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.042 0.449 . . . . 1.33 110.716 -177.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -49.85 -46.53 51.45 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.246 -0.888 . . . . 2.36 111.139 177.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.76 -39.98 91.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.325 -0.398 . . . . 1.09 110.773 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -67.14 -29.85 69.69 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.339 -0.391 . . . . 1.17 111.25 -177.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 37.0 mt -84.64 -54.95 7.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.174 -0.466 . . . . 1.18 111.739 -176.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -67.4 -40.04 85.58 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.763 0.316 . . . . 1.6 110.849 -176.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -97.56 152.74 18.72 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.132 -0.486 . . . . 1.37 110.592 -176.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.52 151.71 85.22 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 116.228 -0.442 . . . . 3.92 110.264 179.282 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -64.49 -7.15 13.52 Favored 'Trans proline' 0 CA--C 1.533 0.435 0 C-N-CA 122.978 2.452 . . . . 1.32 113.068 -177.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -102.46 5.51 39.58 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.793 0.33 . . . . 1.71 111.281 178.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -82.93 155.4 24.06 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.098 0.475 . . . . 1.34 110.851 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.82 -40.54 88.05 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.458 -0.792 . . . . 1.44 110.423 -177.342 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.3 tp -62.04 -36.95 77.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.99 -0.55 . . . . 1.16 110.67 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 2.3 t -67.72 -46.38 82.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 109.877 -0.416 . . . . 1.1 109.877 177.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.37 -38.38 74.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.541 -0.754 . . . . 1.22 110.031 178.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' MET . . . . . 0.524 ' O ' HD12 ' A' ' 129' ' ' LEU . 25.9 mtt -69.78 -48.81 57.81 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.309 -0.86 . . . . 1.25 110.785 178.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.27 -40.46 67.85 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.274 -0.421 . . . . 1.1 111.372 -179.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -58.23 -42.54 86.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.021 -0.536 . . . . 2.08 111.039 179.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -77.58 -38.26 48.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.985 0.422 . . . . 1.04 110.66 -179.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.524 HD12 ' O ' ' A' ' 125' ' ' MET . 4.6 mp -56.48 -38.1 71.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.52 -0.764 . . . . 1.16 110.676 177.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -62.23 -23.78 66.86 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.423 -0.808 . . . . 1.47 111.953 -178.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.424 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 1.3 mptt -68.18 -47.57 67.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.69 0.281 . . . . 2.7 110.46 -176.102 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 129' ' ' LEU . 0.1 OUTLIER -71.98 -23.2 21.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.308 -0.405 . . . . 1.79 110.467 179.601 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.531 ' O ' HG22 ' A' ' 137' ' ' VAL . 24.7 t80 -61.56 -62.02 2.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.091 -0.504 . . . . 0.52 110.213 175.136 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 2.2 pp -65.98 -28.41 68.88 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.928 0.394 . . . . 1.26 110.818 -178.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.439 ' HB2' ' HA ' ' A' ' 132' ' ' ILE . 0.1 OUTLIER -54.62 -50.93 66.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.571 -0.741 . . . . 2.07 111.383 178.997 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.28 -24.42 34.71 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.47 -0.786 . . . . 2.11 110.981 -176.236 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.531 HG22 ' O ' ' A' ' 133' ' ' PHE . 41.1 t -74.01 -36.4 44.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.809 -0.632 . . . . 1.09 110.852 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.19 -19.29 65.54 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.081 0.467 . . . . 1.21 110.238 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -100.42 6.04 44.36 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.55 -0.75 . . . . 1.94 110.447 -178.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' MET . . . . . 0.647 ' HG2' ' CE1' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -61.18 150.38 79.43 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 115.865 -0.607 . . . . 1.34 110.898 177.218 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -61.23 103.22 0.24 Allowed 'Trans proline' 0 N--CA 1.461 -0.426 0 C-N-CA 122.161 1.907 . . . . 0.67 110.88 173.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -73.4 3.2 6.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.899 -0.591 . . . . 3.68 112.122 -173.308 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . 0.401 ' O ' ' HB3' ' A' ' 144' ' ' GLU . 0.9 OUTLIER -112.44 -36.72 5.18 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 116.049 -0.523 . . . . 2.7 110.949 -176.148 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.557 ' OE2' ' HB2' ' A' ' 38' ' ' GLN . 5.9 tp10 74.28 135.37 0.05 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 114.991 -1.004 . . . . 2.34 110.845 -178.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 39.5 t -139.39 108.6 3.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.23 -0.896 . . . . 1.66 109.268 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -67.27 130.92 44.64 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.464 -0.569 . . . . 1.53 109.464 177.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 11.1 mt . . . . . 0 C--O 1.252 1.216 0 CA-C-O 118.493 -0.765 . . . . 1.57 110.27 -175.145 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 7.9 p . . . . . 0 C--O 1.236 0.343 0 CA-C-O 121.784 0.802 . . . . 1.5 108.994 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -151.47 145.31 25.12 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 114.713 -1.131 . . . . 1.85 108.997 178.574 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.435 ' HB3' ' CB ' ' A' ' 31' ' ' LYS . 11.9 t-20 -156.15 125.52 3.13 Favored Pre-proline 0 C--N 1.314 -0.935 0 CA-C-N 116.568 -0.287 . . . . 1.62 110.41 176.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -73.94 -39.96 1.55 Allowed 'Trans proline' 0 N--CA 1.473 0.308 0 C-N-CA 123.23 2.62 . . . . 2.05 113.231 -178.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.5 m -80.25 -21.03 43.23 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.208 0.528 . . . . 2.24 110.529 -175.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.435 ' CB ' ' HB3' ' A' ' 28' ' ' ASN . 9.2 tttp -74.46 135.45 75.56 Favored Pre-proline 0 C--N 1.319 -0.734 0 CA-C-N 114.917 -1.038 . . . . 3.33 111.027 179.34 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -57.97 137.21 79.74 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.142 1.895 . . . . 1.8 111.49 169.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -173.17 90.93 0.09 OUTLIER Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 111.221 -0.752 . . . . 0.97 111.221 -176.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -110.35 177.9 4.55 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.923 0.392 . . . . 2.37 110.434 -177.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.4 mtpp -108.1 104.38 13.79 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.219 -0.446 . . . . 3.13 110.276 179.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.6 p -99.11 168.52 10.02 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.821 0.343 . . . . 1.29 110.466 177.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.471 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 6.7 t30 -62.08 -40.0 94.32 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 115.932 -0.576 . . . . 1.47 110.35 178.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -67.71 -40.6 84.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.764 0.316 . . . . 1.04 110.883 -178.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.34 -49.83 74.01 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.117 0.484 . . . . 1.39 110.541 179.461 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 21.7 mm100 -70.38 -28.84 65.41 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.739 -0.664 . . . . 1.75 110.587 179.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.485 ' CE1' ' HG2' ' A' ' 140' ' ' MET . 52.7 t80 -59.83 -63.9 1.14 Allowed 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.754 -0.657 . . . . 1.2 110.762 176.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.33 -31.9 69.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.579 0.228 . . . . 1.76 110.462 -174.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.486 ' O ' HG12 ' A' ' 47' ' ' VAL . 9.9 tt0 -56.12 -58.7 6.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.604 -0.726 . . . . 1.47 111.087 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -87.11 -27.19 23.25 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.105 -0.498 . . . . 0.53 112.323 -177.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 97.0 t -89.12 -57.59 4.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 112.347 0.499 . . . . 1.11 112.347 -175.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 60.7 t -80.12 -65.93 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 C-N-CA 120.931 -0.308 . . . . 1.07 111.637 -170.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.486 HG12 ' O ' ' A' ' 43' ' ' GLN . 0.2 OUTLIER -66.1 -37.09 79.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.284 0 C-N-CA 120.7 -0.4 . . . . 1.44 111.266 -174.535 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -36.34 82.94 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.751 0.278 . . . . 2.85 111.751 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.9 m -79.05 -33.44 44.69 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.835 -0.346 . . . . 1.23 110.87 178.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.59 -36.17 83.36 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 121.486 0.66 . . . . 1.11 109.371 174.046 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 12.4 t-105 -61.96 -28.12 69.33 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.127 -0.942 . . . . 0.44 111.272 177.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 37.5 mtpt -92.41 28.81 1.85 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.104 0.478 . . . . 2.75 111.439 -176.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.425 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 14.5 t-80 -103.11 133.87 47.49 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.212 -0.449 . . . . 0.47 110.054 176.1 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.69 -11.4 60.92 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.306 -0.406 . . . . 1.91 111.789 -176.085 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.476 ' CG ' ' HG2' ' A' ' 125' ' ' MET . 0.2 OUTLIER -101.97 -4.46 26.08 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.912 0.387 . . . . 1.24 110.407 178.799 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -94.58 16.39 15.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.201 0.524 . . . . 1.09 110.802 -179.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.589 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 42.1 p-90 -70.44 -30.89 1.99 Allowed Pre-proline 0 CA--C 1.545 0.766 0 N-CA-C 113.706 1.002 . . . . 0.65 113.706 -174.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.589 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 6.4 Cg_exo -76.17 -4.92 15.71 Favored 'Trans proline' 0 C--N 1.359 1.108 0 C-N-CA 121.273 1.315 . . . . 0.61 111.252 172.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -109.15 45.81 1.03 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.246 -0.888 . . . . 1.52 109.893 -176.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.47 ' CE2' ' HA ' ' A' ' 57' ' ' TRP . 11.2 m-30 -120.99 -12.48 8.74 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.502 -0.772 . . . . 1.01 110.987 -176.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -123.28 113.37 29.48 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 116.252 -0.431 . . . . 2.11 110.816 -169.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -56.45 129.81 36.72 Favored 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.418 2.079 . . . . 1.1 111.608 -178.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 20.5 t -65.02 103.39 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.708 0.766 . . . . 1.46 111.188 -176.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -110.21 30.54 6.66 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.029 -0.987 . . . . 1.85 109.283 174.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 55.68 -88.29 0.02 OUTLIER 'General case' 0 C--O 1.226 -0.18 0 CA-C-N 114.687 -1.142 . . . . 1.43 111.716 -178.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 40.7 mm -62.78 -34.47 65.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.475 -0.33 . . . . 2.38 111.397 -173.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -57.81 -29.83 65.23 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.952 -0.567 . . . . 3.34 112.025 -177.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.7 tp -128.06 14.91 6.81 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.864 0.364 . . . . 2.3 110.825 -177.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 61.26 56.08 2.78 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.474 -0.785 . . . . 1.89 111.351 179.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -120.15 71.4 16.68 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 115.959 -0.564 . . . . 2.18 110.564 174.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -84.43 -39.87 0.1 Allowed 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.638 2.225 . . . . 1.42 112.218 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -81.25 -14.69 57.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.337 0.589 . . . . 1.97 109.962 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.41 ' HA ' ' CE1' ' A' ' 115' ' ' TYR . 44.7 t80 -58.74 -40.51 84.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.139 -0.937 . . . . 1.53 110.593 177.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -77.72 1.9 18.53 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.49 -0.777 . . . . 1.22 111.557 -175.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -91.13 -47.42 7.54 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.397 0.618 . . . . 3.34 109.415 178.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.5 mp -88.92 -43.87 15.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.14 -0.936 . . . . 1.5 110.608 -177.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 35.2 mm -87.46 126.78 41.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.027 -0.533 . . . . 1.19 110.449 -178.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.9 mtmt -89.97 -23.34 21.57 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.725 -0.67 . . . . 2.35 110.948 -177.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -123.24 90.47 50.42 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 116.14 -0.482 . . . . 2.05 109.975 179.09 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -67.19 93.44 0.34 Allowed 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.614 2.21 . . . . 1.24 112.5 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 22.4 mmt -125.96 169.59 12.54 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.392 0.615 . . . . 1.39 111.036 -177.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.5 ' CG ' ' H ' ' A' ' 83' ' ' MET . 23.0 t70 -151.06 -142.15 0.12 Allowed 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.18 -1.373 . . . . 1.42 107.349 -177.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' MET . . . . . 0.5 ' H ' ' CG ' ' A' ' 82' ' ' ASP . 0.1 OUTLIER -115.64 -15.17 11.42 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 108.3 -1.0 . . . . 1.14 108.3 176.177 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -80.04 -24.49 59.58 Favored Glycine 0 N--CA 1.441 -0.967 0 N-CA-C 109.653 -1.379 . . . . 0.33 109.653 178.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.99 -34.82 43.8 Favored 'General case' 0 N--CA 1.44 -0.953 0 CA-C-N 114.81 -0.695 . . . . 1.6 110.421 176.306 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 36.4 mm -58.3 -56.76 14.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.325 -0.852 . . . . 1.63 109.996 175.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.25 -34.49 66.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.247 -0.888 . . . . 1.71 110.891 177.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.599 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 0.1 OUTLIER -63.19 -52.98 60.16 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-O 120.599 0.238 . . . . 2.93 111.121 -176.868 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.422 ' HB2' ' HH ' ' A' ' 95' ' ' TYR . 8.0 mmm-85 -64.4 -32.98 74.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.516 -0.311 . . . . 1.49 111.135 -178.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 10.1 mt -69.81 -52.27 26.53 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.275 -0.42 . . . . 1.14 111.162 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -71.78 -26.23 62.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.911 0.386 . . . . 1.39 110.711 -177.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . 0.599 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 1.2 t30 -76.14 -15.6 60.04 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.375 -0.375 . . . . 1.66 110.509 176.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 59.31 54.79 4.56 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 115.544 -0.753 . . . . 1.75 109.712 -176.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 25.1 t80 -74.72 -46.58 36.65 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.194 -0.912 . . . . 1.3 111.486 -176.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . 0.422 ' HH ' ' HB2' ' A' ' 89' ' ' ARG . 0.1 OUTLIER -107.17 -176.89 3.2 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.212 0.53 . . . . 1.72 111.208 -179.65 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -77.66 -43.34 31.63 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.228 -0.896 . . . . 1.15 111.307 -176.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -147.05 170.12 17.8 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-O 121.154 0.502 . . . . 1.05 111.825 -168.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.54 -10.55 59.66 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.788 -0.642 . . . . 1.31 111.527 -178.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 48.9 m -64.75 -24.09 67.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.273 0.559 . . . . 1.12 110.045 177.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -80.77 -38.56 28.35 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.785 -0.643 . . . . 2.44 110.195 175.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -69.11 -23.4 63.99 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.623 -0.717 . . . . 1.24 111.029 -178.05 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.4 ttm -61.29 -29.9 70.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.195 -0.457 . . . . 1.66 110.282 177.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -73.96 -34.69 64.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.868 -0.605 . . . . 3.72 109.935 178.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -71.78 -47.05 56.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.806 -0.634 . . . . 1.87 110.317 -179.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -55.3 -46.73 76.22 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.808 -0.633 . . . . 0.45 110.634 177.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -59.21 -44.95 92.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.747 -0.661 . . . . 1.23 110.611 178.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 80.9 m -62.2 -46.76 87.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.941 -0.572 . . . . 1.09 111.112 179.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.63 -41.09 69.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.19 -0.459 . . . . 1.44 111.108 178.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -73.06 -45.42 57.52 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.357 -0.383 . . . . 0.29 111.219 -177.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.1 p -67.45 -33.25 74.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.351 -0.386 . . . . 1.33 111.067 -177.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 -49.31 -47.41 47.09 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.643 -0.708 . . . . 2.36 111.192 178.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -65.69 -38.1 88.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.803 -0.635 . . . . 1.09 110.792 -178.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -72.6 -25.83 61.47 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.112 -0.494 . . . . 1.17 111.202 -177.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 62.0 mt -88.32 -50.82 13.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.059 0.457 . . . . 1.18 111.18 -179.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . 0.41 ' CE1' ' HA ' ' A' ' 73' ' ' TYR . 63.8 t80 -70.9 -34.87 71.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.136 -0.484 . . . . 1.6 111.495 -175.537 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 44.0 m-20 -110.85 157.81 19.42 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.891 0.377 . . . . 1.37 111.542 -172.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . 0.529 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 0.2 OUTLIER -74.3 149.8 87.02 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 115.771 -0.65 . . . . 3.92 110.767 -177.468 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -62.24 -16.64 52.33 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.933 2.422 . . . . 1.32 112.976 -178.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.52 6.42 48.14 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.994 0.426 . . . . 1.71 111.25 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . 0.529 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 0.5 OUTLIER -78.56 157.39 28.8 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 116.162 -0.472 . . . . 1.34 110.618 -178.414 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -67.5 -42.16 83.33 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.598 -0.728 . . . . 1.44 110.345 -177.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 5.5 tp -60.29 -35.84 64.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.972 -0.558 . . . . 1.16 111.009 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 2.4 t -68.97 -45.76 79.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.963 -0.384 . . . . 1.1 109.963 178.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.82 -29.69 67.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.906 -0.588 . . . . 1.22 110.13 177.617 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' MET . . . . . 0.476 ' HG2' ' CG ' ' A' ' 55' ' ' PHE . 32.8 mtt -76.42 -42.21 44.97 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.376 -0.829 . . . . 1.25 110.654 178.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.38 -45.17 72.77 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.073 -0.512 . . . . 1.1 112.095 -177.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.44 -44.18 92.97 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.913 0.387 . . . . 2.08 110.86 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -68.38 -37.69 80.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 1.04 110.627 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.475 HD12 ' N ' ' A' ' 129' ' ' LEU . 5.0 mp -64.83 -40.93 95.99 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.394 -0.821 . . . . 1.16 110.734 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -59.27 -24.75 63.51 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.662 -0.699 . . . . 1.47 111.849 -176.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.566 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -62.66 -44.0 97.37 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 110.158 -0.312 . . . . 2.7 110.158 -177.895 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . 0.5 HG21 HD11 ' A' ' 132' ' ' ILE . 22.1 mt -66.96 -35.61 75.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.128 -0.487 . . . . 1.79 110.343 -179.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.558 ' O ' HG22 ' A' ' 137' ' ' VAL . 36.1 t80 -59.89 -62.71 1.67 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.819 -0.628 . . . . 0.52 110.77 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 2.0 pp -64.74 -28.38 69.55 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.954 0.407 . . . . 1.26 110.782 -177.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.566 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.3 OUTLIER -60.82 -51.72 68.14 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.673 -0.694 . . . . 2.07 111.024 178.992 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.36 -26.51 35.47 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.852 -0.613 . . . . 2.11 110.885 -175.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.558 HG22 ' O ' ' A' ' 133' ' ' PHE . 52.4 t -68.86 -29.7 44.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.128 0.489 . . . . 1.09 110.262 176.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.51 -14.77 63.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.162 -0.472 . . . . 1.21 110.531 177.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -106.88 -0.57 23.17 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.895 -0.593 . . . . 1.94 110.325 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' MET . . . . . 0.485 ' HG2' ' CE1' ' A' ' 41' ' ' TYR . 0.3 OUTLIER -70.07 147.29 95.63 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 115.874 -0.603 . . . . 1.34 110.752 -178.287 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . 0.463 ' C ' ' H ' ' A' ' 143' ' ' GLU . 50.6 Cg_endo -86.18 79.95 1.85 Allowed 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 122.308 2.005 . . . . 0.67 111.324 178.118 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -76.08 21.39 0.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.273 0.558 . . . . 3.68 111.234 -177.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . 0.463 ' H ' ' C ' ' A' ' 141' ' ' PRO . 2.4 mt-10 -90.62 -32.92 16.06 Favored 'General case' 0 N--CA 1.439 -0.982 0 N-CA-C 108.218 -1.031 . . . . 2.7 108.218 170.41 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 75.18 113.03 0.07 Allowed 'General case' 0 C--O 1.228 -0.064 0 CA-C-N 113.569 -1.651 . . . . 2.34 111.227 176.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 15.3 t -125.83 116.73 47.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.825 -0.625 . . . . 1.66 109.613 176.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -73.62 147.11 44.11 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.724 0.297 . . . . 1.53 110.499 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 64.6 mt . . . . . 0 C--O 1.247 0.931 0 CA-C-O 118.834 -0.603 . . . . 1.57 109.991 179.521 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.4 p . . . . . 0 N--CA 1.454 -0.27 0 CA-C-O 121.216 0.531 . . . . 1.5 110.387 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -178.44 154.01 0.77 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.341 -0.845 . . . . 1.85 109.661 177.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.516 ' HB3' ' HB2' ' A' ' 31' ' ' LYS . 42.8 t-20 -160.53 124.38 2.0 Allowed Pre-proline 0 C--N 1.318 -0.779 0 CA-C-N 115.846 -0.616 . . . . 1.62 109.52 -179.397 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -65.06 -33.87 48.96 Favored 'Trans proline' 0 N--CA 1.48 0.729 0 C-N-CA 123.407 2.738 . . . . 2.05 112.994 -177.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.4 t -74.3 -20.7 60.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.577 0.703 . . . . 2.24 109.678 -179.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.516 ' HB2' ' HB3' ' A' ' 28' ' ' ASN . 2.1 tttp -87.11 134.75 36.03 Favored Pre-proline 0 C--N 1.319 -0.736 0 CA-C-N 115.0 -1.0 . . . . 3.33 109.755 178.464 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.487 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 35.9 Cg_endo -65.66 137.72 51.14 Favored 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.256 1.971 . . . . 1.8 112.317 177.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -153.88 109.27 0.4 Allowed Glycine 0 N--CA 1.442 -0.939 0 N-CA-C 110.788 -0.925 . . . . 0.97 110.788 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -123.81 155.77 37.36 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.789 0.328 . . . . 2.37 110.57 -176.312 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.62 84.36 5.04 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.191 0.52 . . . . 3.13 110.292 176.486 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.465 ' HA ' ' HA ' ' A' ' 146' ' ' GLU . 1.2 p -92.02 165.55 13.13 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.228 -0.442 . . . . 1.29 110.826 -179.225 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.421 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 64.0 t30 -63.99 -40.88 97.38 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.282 -0.417 . . . . 1.47 110.591 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -64.51 -38.97 92.86 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 110.203 -0.295 . . . . 1.04 110.203 177.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' A' ' 43' ' ' GLN . 0.7 OUTLIER -63.52 -55.68 22.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.916 -0.584 . . . . 1.39 110.501 178.838 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.476 ' HA ' ' OE1' ' A' ' 43' ' ' GLN . 2.7 mm-40 -63.81 -31.53 72.73 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.966 -0.561 . . . . 1.75 110.891 -179.166 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.421 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 63.8 t80 -53.57 -62.68 1.5 Allowed 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.52 -0.764 . . . . 1.2 110.922 176.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 3.5 ttm -59.07 -29.98 67.73 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.428 -0.351 . . . . 1.76 111.645 -173.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.483 ' HG3' ' O ' ' A' ' 39' ' ' LEU . 24.9 mt-30 -60.12 -58.56 7.98 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.097 0.475 . . . . 1.47 110.502 178.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -84.27 -29.7 26.23 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.702 -0.681 . . . . 0.53 111.534 -174.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 97.9 t -87.9 -56.63 5.02 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 N-CA-C 112.336 0.495 . . . . 1.11 112.336 -175.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 53.6 t -83.03 -67.26 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 112.076 0.399 . . . . 1.07 112.076 -171.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.419 HG11 ' O ' ' A' ' 43' ' ' GLN . 2.5 p -72.76 -34.13 46.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 C-N-CA 120.822 -0.351 . . . . 1.44 111.7 -171.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 43' ' ' GLN . 0.0 OUTLIER -61.48 -35.4 77.55 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.778 0.323 . . . . 2.85 110.779 179.196 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 27.3 m -80.75 -37.77 29.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.454 -0.339 . . . . 1.23 110.878 178.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.47 -40.78 95.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.903 0.383 . . . . 1.11 110.03 177.417 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 23.2 t-105 -64.73 -31.63 72.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.932 -0.576 . . . . 0.44 111.385 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.6 mttt -79.74 -9.83 59.7 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 111.815 0.302 . . . . 2.75 111.815 -175.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.414 ' ND1' HD12 ' A' ' 129' ' ' LEU . 10.5 t-80 -69.1 129.67 40.56 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.588 -0.523 . . . . 0.47 109.588 176.234 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -81.34 9.4 7.23 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.938 0.399 . . . . 1.91 111.658 -173.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -110.45 -3.52 16.02 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.303 0.573 . . . . 1.24 109.626 173.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -92.79 9.11 36.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.607 -0.724 . . . . 1.09 110.642 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.467 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 55.9 p-90 -64.31 -31.43 5.93 Favored Pre-proline 0 CA--C 1.546 0.803 0 N-CA-C 113.954 1.094 . . . . 0.65 113.954 -175.313 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.467 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 10.8 Cg_exo -73.11 -4.4 15.35 Favored 'Trans proline' 0 C--N 1.363 1.324 0 CA-C-N 121.151 1.447 . . . . 0.61 111.946 176.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -110.19 19.38 18.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.173 0.511 . . . . 1.52 110.008 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -85.84 -8.86 57.81 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.722 -0.672 . . . . 1.01 110.434 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.09 131.42 19.78 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.282 -0.417 . . . . 2.11 110.877 -172.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -67.58 154.74 72.68 Favored 'Trans proline' 0 C--O 1.236 0.398 0 C-N-CA 122.689 2.26 . . . . 1.1 113.044 -178.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 9.4 t -97.61 101.94 12.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.672 -0.694 . . . . 1.46 109.491 -178.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -108.48 7.33 26.83 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.619 -0.719 . . . . 1.85 110.84 -178.26 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 86.05 -21.62 0.21 Allowed 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 114.737 -1.12 . . . . 1.43 112.29 178.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.7 mt -113.11 -42.69 4.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 O-C-N 122.224 -0.297 . . . . 2.38 111.105 -178.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 53.7 tptt -52.91 -54.61 32.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.14 -0.482 . . . . 3.34 110.975 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 9.4 tp -93.48 2.01 56.6 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.263 -0.426 . . . . 2.3 110.605 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . 0.43 ' O ' HD12 ' A' ' 70' ' ' LEU . 3.4 t-20 56.29 71.78 0.54 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.618 -0.719 . . . . 1.89 110.648 -177.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.533 ' HG ' ' CD1' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -132.35 75.01 74.98 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.168 -0.924 . . . . 2.18 109.921 -175.614 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -73.17 -37.06 3.65 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.561 2.174 . . . . 1.42 113.416 -173.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -91.48 -0.91 57.67 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.244 0.545 . . . . 1.97 110.937 -176.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.533 ' CD1' ' HG ' ' A' ' 70' ' ' LEU . 0.9 OUTLIER -65.71 -43.34 89.44 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.491 -0.777 . . . . 1.53 110.768 179.369 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -76.86 10.41 2.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.664 -0.698 . . . . 1.22 112.006 -173.573 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.6 mmtt -97.87 -47.85 5.4 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.125 -0.694 . . . . 3.34 109.125 176.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.7 mp -89.09 -52.63 10.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.322 -0.854 . . . . 1.5 110.608 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.9 mm -91.01 97.43 7.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.043 0.449 . . . . 1.19 109.879 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.3 mtmt -75.04 -11.19 60.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.887 -0.597 . . . . 2.35 111.13 -177.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -122.13 82.67 44.64 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 115.985 -0.552 . . . . 2.05 110.212 177.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -76.71 72.7 5.57 Favored 'Trans proline' 0 CA--C 1.53 0.28 0 C-N-CA 122.91 2.406 . . . . 1.24 112.016 -178.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -110.06 154.39 23.29 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.49 0.662 . . . . 1.39 110.924 -175.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.437 ' O ' HG12 ' A' ' 86' ' ' ILE . 13.9 p-10 -133.61 -129.21 0.17 Allowed 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 114.635 -1.166 . . . . 1.42 109.23 -173.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -120.44 -18.21 7.94 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.514 -0.55 . . . . 1.14 109.514 177.322 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -78.41 -35.59 32.79 Favored Glycine 0 N--CA 1.439 -1.13 0 N-CA-C 109.642 -1.383 . . . . 0.33 109.642 177.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 23.4 m -71.68 -35.54 70.31 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.254 -0.473 . . . . 1.6 110.63 174.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.437 HG12 ' O ' ' A' ' 82' ' ' ASP . 0.2 OUTLIER -62.83 -52.88 53.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.256 -0.646 . . . . 1.63 109.256 176.914 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.68 -25.5 67.36 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.945 -0.57 . . . . 1.71 111.104 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.456 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 14.9 tttp -68.54 -51.43 42.97 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 120.518 0.199 . . . . 2.93 110.65 179.386 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 11.4 mtp180 -66.54 -28.8 68.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.911 0.386 . . . . 1.49 110.683 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.711 ' HG ' ' SG ' ' A' ' 101' ' ' CYS . 5.6 mt -66.44 -58.55 5.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.936 -0.574 . . . . 1.14 110.96 173.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -68.19 -22.94 64.79 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.204 -0.453 . . . . 1.39 111.384 -176.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . 0.456 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 7.6 t30 -89.38 -7.32 55.48 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.294 -0.412 . . . . 1.66 110.715 178.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 56.76 67.0 1.05 Allowed 'General case' 0 N--CA 1.464 0.251 0 O-C-N 123.648 0.593 . . . . 1.75 110.713 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . 0.419 ' HD2' ' CE2' ' A' ' 95' ' ' TYR . 14.1 t80 -77.87 -32.25 51.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.556 -0.747 . . . . 1.3 111.664 -178.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . 0.419 ' CE2' ' HD2' ' A' ' 94' ' ' TYR . 0.0 OUTLIER -127.68 -172.72 2.74 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.612 0.72 . . . . 1.72 111.717 -175.897 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . 0.487 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 2.2 t-105 -76.17 -59.8 2.61 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 114.236 -1.347 . . . . 1.15 111.087 -177.283 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 8.2 m -128.31 166.37 18.75 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.999 0.428 . . . . 1.05 111.567 -172.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -70.5 -12.56 61.65 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.297 -0.411 . . . . 1.31 111.358 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -62.13 -22.79 66.13 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.387 0.613 . . . . 1.12 109.887 174.499 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -81.14 -44.95 17.15 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.411 -0.813 . . . . 2.44 110.348 176.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . 0.711 ' SG ' ' HG ' ' A' ' 90' ' ' LEU . 1.6 t -69.49 -25.21 63.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.106 -0.497 . . . . 1.24 111.53 -176.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.1 ptm -66.74 -16.75 64.46 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.637 -0.425 . . . . 1.66 110.292 177.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -78.5 -44.01 25.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 3.72 110.594 177.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . 0.559 ' OD1' ' HA ' ' A' ' 101' ' ' CYS . 0.4 OUTLIER -75.07 -31.27 61.21 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.847 -0.427 . . . . 1.87 109.847 177.95 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -54.71 -51.54 65.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.807 -0.633 . . . . 0.45 109.945 170.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 -60.43 -46.01 91.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.398 -0.819 . . . . 1.23 110.026 176.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 63.3 m -54.69 -45.97 74.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.595 -0.73 . . . . 1.09 111.742 -177.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -54.26 -45.68 72.48 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 120.769 0.318 . . . . 1.44 110.73 176.094 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -64.94 -47.3 78.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.834 -0.621 . . . . 0.29 111.049 -178.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.31 -41.29 96.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.944 0.402 . . . . 1.33 110.686 -178.644 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -52.06 -46.05 64.98 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.374 -0.83 . . . . 2.36 110.547 177.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . 0.478 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 0.0 OUTLIER -70.32 -37.74 74.78 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.92 -0.582 . . . . 1.09 110.855 -178.68 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -71.7 -32.77 68.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.625 -0.261 . . . . 1.17 111.353 -177.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 76.9 mt -73.32 -57.98 5.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.531 -0.304 . . . . 1.18 111.33 -177.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -70.32 -41.55 73.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.381 -0.372 . . . . 1.6 111.318 -174.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . 0.478 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 71.7 m-80 -86.28 168.14 14.18 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.926 0.393 . . . . 1.37 111.031 -174.273 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.04 147.27 83.4 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.984 -0.553 . . . . 3.92 110.397 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_endo -60.35 -21.24 66.52 Favored 'Trans proline' 0 C--N 1.343 0.241 0 C-N-CA 122.447 2.098 . . . . 1.32 111.959 177.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.15 34.82 4.79 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.059 -0.519 . . . . 1.71 110.638 176.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -83.84 167.48 17.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.882 -0.599 . . . . 1.34 110.673 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -67.28 -49.67 63.4 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.868 -0.605 . . . . 1.44 110.49 -177.285 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -64.3 -40.05 87.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.046 -0.525 . . . . 1.16 110.655 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.455 ' O ' HG12 ' A' ' 123' ' ' VAL . 6.6 t -65.45 -38.68 83.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.057 0.456 . . . . 1.1 110.681 -179.75 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.31 -28.29 68.0 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.029 -0.532 . . . . 1.22 110.276 177.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 3.1 mtt -82.52 -44.98 15.26 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.764 -0.653 . . . . 1.25 110.582 177.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.41 -33.24 58.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.679 -0.691 . . . . 1.1 111.697 -179.21 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -59.21 -45.87 89.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.373 -0.376 . . . . 2.08 110.986 178.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -73.86 -35.5 64.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.104 -0.498 . . . . 1.04 110.509 179.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.414 HD12 ' ND1' ' A' ' 53' ' ' HIS . 5.6 mp -61.37 -46.14 91.44 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.42 -0.809 . . . . 1.16 110.615 179.132 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -62.7 -23.87 67.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.321 -0.854 . . . . 1.47 111.831 -176.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.544 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -62.97 -49.63 73.97 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 109.914 -0.402 . . . . 2.7 109.914 -176.77 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.94 -30.09 45.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.953 -0.567 . . . . 1.79 110.481 179.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.562 ' O ' HG22 ' A' ' 137' ' ' VAL . 34.8 t80 -61.72 -62.88 1.49 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.984 -0.553 . . . . 0.52 110.99 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.8 pp -66.62 -29.91 70.05 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.821 0.343 . . . . 1.26 110.534 -175.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.544 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.3 OUTLIER -63.39 -48.79 76.41 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.623 -0.717 . . . . 2.07 111.203 -179.549 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 2.8 mttm -80.89 -14.03 58.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.403 -0.362 . . . . 2.11 111.285 -177.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.562 HG22 ' O ' ' A' ' 133' ' ' PHE . 30.9 t -82.53 -34.99 12.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.052 0.453 . . . . 1.09 109.882 178.025 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -66.44 -19.38 65.78 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.197 0.522 . . . . 1.21 110.432 178.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -100.05 10.61 41.01 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.991 -0.55 . . . . 1.94 111.172 -179.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -61.21 152.08 73.46 Favored Pre-proline 0 N--CA 1.466 0.341 0 CA-C-N 116.267 -0.424 . . . . 1.34 111.055 175.167 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -68.61 121.38 8.3 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.384 2.056 . . . . 0.67 112.074 179.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -71.97 1.95 6.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.32 -0.4 . . . . 3.68 112.065 -176.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -97.69 -41.3 8.17 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 116.387 -0.37 . . . . 2.7 111.678 -171.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 60.55 65.7 1.02 Allowed 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.66 0.6 . . . . 2.34 109.979 -175.553 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 16.6 t -98.21 127.78 50.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.699 -0.682 . . . . 1.66 110.294 -177.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.465 ' HA ' ' HA ' ' A' ' 36' ' ' THR . 8.8 tt0 -71.24 138.86 49.79 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.892 -0.41 . . . . 1.53 109.892 175.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 40.7 mt . . . . . 0 C--O 1.247 0.953 0 CA-C-O 118.395 -0.812 . . . . 1.57 110.516 -176.146 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.7 p . . . . . 0 N--CA 1.453 -0.296 0 CA-C-O 121.169 0.509 . . . . 1.5 110.158 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 73.1 m -166.95 142.57 4.26 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.551 -0.749 . . . . 1.85 109.347 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.456 ' HB3' ' CB ' ' A' ' 31' ' ' LYS . 34.8 t-20 -145.97 127.91 7.73 Favored Pre-proline 0 C--N 1.319 -0.754 0 N-CA-C 109.663 -0.495 . . . . 1.62 109.663 178.366 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -63.42 -36.12 57.06 Favored 'Trans proline' 0 N--CA 1.478 0.587 0 C-N-CA 123.224 2.616 . . . . 2.05 112.783 -177.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.5 m -80.35 -19.68 45.89 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 115.576 -0.738 . . . . 2.24 110.324 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.456 ' CB ' ' HB3' ' A' ' 28' ' ' ASN . 11.1 tttp -90.33 129.27 46.02 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.114 -0.948 . . . . 3.33 110.254 179.324 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.438 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 35.6 Cg_endo -69.17 135.72 32.63 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 121.96 1.773 . . . . 1.8 112.284 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -145.46 86.05 0.18 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.317 -0.856 . . . . 0.97 111.002 -178.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.49 ' HG3' ' CE2' ' A' ' 96' ' ' TRP . 1.7 mmm180 -97.97 163.38 12.8 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.879 0.371 . . . . 2.37 110.498 -176.161 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.3 mtmt -104.93 108.92 20.69 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.084 -0.507 . . . . 3.13 110.121 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.3 p -111.94 166.89 10.82 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.889 0.376 . . . . 1.29 110.864 176.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.524 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 60.3 t30 -59.75 -37.41 78.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.928 -0.578 . . . . 1.47 110.893 178.249 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -71.07 -37.47 72.48 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.854 0.359 . . . . 1.04 110.409 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.18 -53.27 55.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.117 -0.492 . . . . 1.39 110.557 178.507 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -69.48 -21.43 63.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.093 -0.503 . . . . 1.75 110.81 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.524 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 52.8 t80 -64.36 -63.41 1.15 Allowed 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.003 -0.544 . . . . 1.2 110.868 178.307 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -57.91 -31.45 66.79 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.534 -0.303 . . . . 1.76 110.867 -174.633 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.449 ' O ' HG12 ' A' ' 47' ' ' VAL . 13.9 tt0 -59.69 -55.24 36.83 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.909 -0.587 . . . . 1.47 111.209 178.097 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -86.56 -28.89 23.04 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 112.28 0.474 . . . . 0.53 112.28 -176.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 95.1 t -89.23 -57.51 4.19 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 N-CA-C 112.479 0.548 . . . . 1.11 112.479 -175.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 39.7 t -81.47 -65.63 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 111.739 0.274 . . . . 1.07 111.739 -169.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.449 HG12 ' O ' ' A' ' 43' ' ' GLN . 2.6 p -67.53 -34.26 67.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 C-N-CA 120.851 -0.34 . . . . 1.44 111.548 -174.253 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.4 mmtt -60.03 -39.5 86.08 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 122.243 -0.285 . . . . 2.85 111.574 177.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.3 m -75.97 -36.12 59.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.67 0.272 . . . . 1.23 110.713 178.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.88 -37.51 79.58 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.406 0.622 . . . . 1.11 109.541 174.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 16.7 t-105 -63.9 -27.36 69.1 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.041 -0.982 . . . . 0.44 112.096 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.1 mtpt -88.97 0.79 56.34 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.038 0.384 . . . . 2.75 112.038 -174.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.411 ' ND1' ' HB2' ' A' ' 55' ' ' PHE . 8.7 t-80 -76.76 134.51 39.13 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.893 -0.41 . . . . 0.47 109.893 177.028 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 40.1 mm-40 -72.42 -13.39 61.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.417 -0.356 . . . . 1.91 111.743 -175.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.411 ' HB2' ' ND1' ' A' ' 53' ' ' HIS . 3.1 m-85 -96.08 -1.79 47.97 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.152 0.501 . . . . 1.24 110.341 178.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -97.28 13.9 27.91 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.411 0.624 . . . . 1.09 110.311 -179.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.619 ' HA ' ' CE2' ' A' ' 60' ' ' TYR . 54.3 p-90 -65.91 -33.6 7.45 Favored Pre-proline 0 CA--C 1.545 0.775 0 N-CA-C 113.787 1.032 . . . . 0.65 113.787 -174.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.482 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 1.3 Cg_endo -85.13 12.0 3.2 Favored 'Trans proline' 0 C--N 1.359 1.115 0 C-N-CA 121.695 1.597 . . . . 0.61 111.325 176.682 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -110.57 -0.39 17.32 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.389 -0.823 . . . . 1.52 110.781 -177.241 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.619 ' CE2' ' HA ' ' A' ' 57' ' ' TRP . 16.3 m-30 -82.21 -23.24 35.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.878 0.37 . . . . 1.01 111.179 -178.318 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.98 127.53 27.82 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.214 -0.448 . . . . 2.11 110.717 -174.373 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.408 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 45.4 Cg_endo -69.79 158.22 57.65 Favored 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 122.835 2.357 . . . . 1.1 112.843 -177.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 41.7 t -77.07 94.45 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.618 0.723 . . . . 1.46 110.167 178.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.82 -10.24 40.54 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.103 -0.953 . . . . 1.85 110.507 178.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 80.37 -32.27 0.12 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.882 0.873 . . . . 1.43 112.646 176.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 24.0 mt -99.94 -57.24 4.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 O-C-N 122.122 -0.361 . . . . 2.38 111.724 -175.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.99 -33.46 75.62 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.98 0.419 . . . . 3.34 110.92 -176.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.8 tp -90.27 -5.85 55.84 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.121 -0.49 . . . . 2.3 110.843 177.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 57.44 57.15 4.55 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.843 -0.617 . . . . 1.89 111.242 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.402 ' O ' ' HB2' ' A' ' 73' ' ' TYR . 25.9 mt -129.07 64.51 71.07 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.564 -0.744 . . . . 2.18 110.812 176.486 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -77.23 -27.74 6.37 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.322 2.015 . . . . 1.42 111.891 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -84.52 2.98 38.65 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.653 -0.703 . . . . 1.97 110.114 -179.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.43 ' HA ' ' CE1' ' A' ' 115' ' ' TYR . 1.5 t80 -65.19 -45.46 84.71 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.418 -0.81 . . . . 1.53 110.929 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -78.45 5.97 9.54 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.595 -0.73 . . . . 1.22 111.59 -172.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.0 mmmt -89.77 -22.84 21.95 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 108.989 -0.745 . . . . 3.34 108.989 178.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 53.6 mt -118.3 -56.09 3.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 CA-C-N 115.257 -0.883 . . . . 1.5 110.332 179.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 37.5 mm -88.83 107.46 17.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.959 -0.564 . . . . 1.19 110.564 -177.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.95 -10.43 59.27 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.895 -0.593 . . . . 2.35 110.889 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -117.58 82.94 16.45 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.004 -0.544 . . . . 2.05 110.109 176.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -76.32 91.05 1.14 Allowed 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.755 2.304 . . . . 1.24 112.0 -176.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -129.94 171.22 12.99 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.457 0.646 . . . . 1.39 111.245 -175.016 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.432 ' O ' HG12 ' A' ' 86' ' ' ILE . 12.9 p-10 -153.98 -134.81 0.05 OUTLIER 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.519 -1.219 . . . . 1.42 108.248 -174.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.2 ttm -113.25 -19.92 11.6 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.123 -0.695 . . . . 1.14 109.123 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.413 ' O ' ' HB2' ' A' ' 88' ' ' LYS . . . -79.81 -30.88 41.84 Favored Glycine 0 N--CA 1.44 -1.093 0 N-CA-C 109.863 -1.295 . . . . 0.33 109.863 178.006 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 28.5 m -77.14 -29.83 54.82 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.441 -0.379 . . . . 1.6 111.047 174.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.442 HD12 ' HB2' ' A' ' 104' ' ' ASP . 0.2 OUTLIER -65.52 -51.7 60.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 109.305 -0.628 . . . . 1.63 109.305 177.076 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.537 ' O ' ' HG2' ' A' ' 91' ' ' GLU . 0.0 OUTLIER -63.91 -27.35 69.09 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.156 -0.474 . . . . 1.71 110.164 177.548 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.539 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 0.8 OUTLIER -63.09 -52.27 63.31 Favored 'General case' 0 C--O 1.227 -0.09 0 CA-C-N 116.129 -0.487 . . . . 2.93 110.616 177.454 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.2 mmm-85 -63.91 -33.88 76.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.748 0.309 . . . . 1.49 110.724 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.8 mt -66.58 -57.89 6.31 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.936 -0.575 . . . . 1.14 111.598 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 11.4 pt-20 -78.55 -14.99 59.07 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.197 0.443 . . . . 1.39 112.197 -173.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . 0.539 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 1.0 OUTLIER -90.41 -4.02 57.3 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 110.058 -0.349 . . . . 1.66 110.058 174.977 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.49 58.99 2.75 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.408 -0.815 . . . . 1.75 111.347 179.361 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -71.85 -45.12 62.46 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.999 0.428 . . . . 1.3 110.773 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -108.59 -171.71 1.91 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.9 -0.591 . . . . 1.72 110.896 -175.263 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . 0.49 ' CE2' ' HG3' ' A' ' 34' ' ' ARG . 2.0 t90 -86.9 -41.59 13.86 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.556 -0.747 . . . . 1.15 110.394 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 28.6 t -148.96 175.67 11.09 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.255 0.55 . . . . 1.05 111.62 -172.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.0 -10.93 59.94 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.618 -0.719 . . . . 1.31 110.653 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.66 -33.25 72.54 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.792 0.806 . . . . 1.12 109.493 173.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -82.19 -35.31 28.46 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 114.647 -1.16 . . . . 2.44 110.144 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . 0.504 ' HA ' ' OD1' ' A' ' 104' ' ' ASP . 48.5 t -64.76 -24.61 67.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.984 -0.553 . . . . 1.24 110.709 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.5 mtt -59.73 -25.9 65.2 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.079 -0.509 . . . . 1.66 110.282 176.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.61 -47.36 26.92 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.025 -0.534 . . . . 3.72 110.896 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . 0.504 ' OD1' ' HA ' ' A' ' 101' ' ' CYS . 0.2 OUTLIER -70.77 -37.21 73.36 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.806 -0.357 . . . . 1.87 110.472 -179.367 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -56.09 -48.22 76.53 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.153 0.502 . . . . 0.45 110.043 173.543 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -64.54 -47.29 79.33 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.619 -0.719 . . . . 1.23 110.508 177.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 90.1 m -52.27 -45.4 65.44 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.372 -0.376 . . . . 1.09 111.332 -178.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 6.2 ttp -54.64 -38.97 67.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.348 -0.387 . . . . 1.44 111.453 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -78.78 -51.82 9.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.739 0.304 . . . . 0.29 110.605 -175.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.45 -39.72 73.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.171 -0.468 . . . . 1.33 111.165 178.267 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -53.82 -49.3 68.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.073 -0.512 . . . . 2.36 110.964 178.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.46 -38.16 90.04 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 116.391 -0.368 . . . . 1.09 110.612 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -67.85 -33.19 74.28 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.288 -0.414 . . . . 1.17 111.135 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 70.0 mt -80.79 -50.65 16.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.36 -0.382 . . . . 1.18 111.971 -176.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . 0.43 ' CE1' ' HA ' ' A' ' 73' ' ' TYR . 64.3 t80 -68.3 -34.37 76.02 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.862 0.363 . . . . 1.6 111.154 -175.491 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 -98.7 -163.73 1.07 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.991 -0.549 . . . . 1.37 110.892 -175.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.67 156.51 44.72 Favored Pre-proline 0 C--N 1.325 -0.464 0 N-CA-C 109.999 -0.371 . . . . 3.92 109.999 179.545 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -59.41 -21.64 62.16 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.333 2.022 . . . . 1.32 111.99 176.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.94 8.64 42.17 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.55 -0.75 . . . . 1.71 111.56 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . 0.462 ' OD1' HG23 ' A' ' 122' ' ' ILE . 3.3 t70 -76.04 155.98 34.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.186 0.517 . . . . 1.34 111.401 -175.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.47 -42.73 74.45 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.144 -0.935 . . . . 1.44 109.889 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . 0.462 HG23 ' OD1' ' A' ' 120' ' ' ASP . 2.4 tp -66.17 -33.75 65.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 115.977 -0.556 . . . . 1.16 110.535 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 2.8 t -69.94 -41.4 79.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.128 0.49 . . . . 1.1 110.131 177.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.29 -33.52 71.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.92 -0.582 . . . . 1.22 109.968 177.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' MET . . . . . 0.493 ' O ' HD11 ' A' ' 129' ' ' LEU . 21.5 mtt -76.49 -46.6 26.0 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.524 -0.762 . . . . 1.25 110.746 178.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -52.83 -36.71 59.02 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.284 -0.416 . . . . 1.1 111.634 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -60.73 -39.11 87.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.132 -0.486 . . . . 2.08 111.272 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.91 -36.9 35.76 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.153 0.501 . . . . 1.04 110.438 178.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.493 HD11 ' O ' ' A' ' 125' ' ' MET . 5.2 mp -60.46 -40.2 90.33 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.46 -0.791 . . . . 1.16 110.697 179.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -60.52 -24.54 65.43 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.943 -0.571 . . . . 1.47 111.961 -178.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.482 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -65.15 -39.41 92.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.681 0.277 . . . . 2.7 110.41 -177.521 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 11.3 mt -67.47 -28.55 42.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 1.79 110.846 -178.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.546 ' O ' HG23 ' A' ' 137' ' ' VAL . 33.3 t80 -61.46 -63.05 1.41 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.955 -0.566 . . . . 0.52 110.487 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.3 pp -65.89 -25.3 67.1 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.334 0.588 . . . . 1.26 110.51 -178.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.482 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -63.95 -34.15 77.33 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.484 -0.78 . . . . 2.07 111.446 -179.339 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.13 -21.98 14.31 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.891 0.377 . . . . 2.11 111.036 -178.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.546 HG23 ' O ' ' A' ' 133' ' ' PHE . 40.9 t -73.13 -31.28 34.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.078 0.466 . . . . 1.09 110.518 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -72.25 -6.35 42.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.322 0.582 . . . . 1.21 110.36 178.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -111.55 2.79 17.58 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.541 -0.754 . . . . 1.94 110.117 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -65.54 149.85 96.73 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 115.941 -0.572 . . . . 1.34 111.623 -179.736 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -84.84 87.26 1.07 Allowed 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.435 2.09 . . . . 0.67 111.165 177.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 6.6 mm-40 -70.47 11.03 0.39 Allowed 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.407 0.521 . . . . 3.68 112.407 -174.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -83.76 -39.6 19.86 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 108.85 -0.796 . . . . 2.7 108.85 173.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 67.82 98.55 0.05 Allowed 'General case' 0 C--O 1.231 0.115 0 CA-C-N 114.263 -1.335 . . . . 2.34 111.017 -177.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 9.4 t -100.55 107.47 21.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.746 -0.661 . . . . 1.66 109.304 175.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -66.21 140.13 58.15 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.741 -0.466 . . . . 1.53 109.741 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 11.1 mt . . . . . 0 C--O 1.246 0.906 0 CA-C-O 118.661 -0.685 . . . . 1.57 110.205 -177.308 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.454 ' O ' ' HB2' ' A' ' 94' ' ' TYR . 4.4 p . . . . . 0 N--CA 1.453 -0.324 0 N-CA-C 109.157 -0.683 . . . . 1.5 109.157 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.7 m -173.66 116.4 0.25 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 114.976 -1.011 . . . . 1.85 108.855 -179.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.462 ' OD1' ' HD2' ' A' ' 29' ' ' PRO . 20.3 t30 -140.5 132.69 14.39 Favored Pre-proline 0 C--N 1.319 -0.734 0 C-N-CA 120.918 -0.313 . . . . 1.62 110.75 -173.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . 0.462 ' HD2' ' OD1' ' A' ' 28' ' ' ASN . 70.7 Cg_endo -69.42 -38.76 8.08 Favored 'Trans proline' 0 N--CA 1.474 0.368 0 C-N-CA 123.044 2.496 . . . . 2.05 112.002 177.332 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 7.2 m -71.65 -17.22 62.27 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.392 -0.822 . . . . 2.24 110.571 -179.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.8 tmtm? -101.55 110.29 61.39 Favored Pre-proline 0 C--N 1.318 -0.802 0 CA-C-N 115.348 -0.842 . . . . 3.33 109.453 175.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.623 ' HB2' ' CZ3' ' A' ' 96' ' ' TRP . 24.5 Cg_endo -63.54 133.95 42.2 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 121.549 1.5 . . . . 1.8 111.978 -179.01 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -160.18 80.67 0.15 Allowed Glycine 0 N--CA 1.44 -1.099 0 CA-C-N 115.023 -0.989 . . . . 0.97 110.917 -177.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.1 mtm180 -73.92 -117.09 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.95 0.405 . . . . 2.37 110.186 -179.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -175.06 129.04 0.29 Allowed 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.447 -0.575 . . . . 3.13 109.447 178.413 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.411 ' HA ' ' HA ' ' A' ' 146' ' ' GLU . 4.1 p -118.94 159.76 23.22 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 109.841 -0.429 . . . . 1.29 109.841 174.002 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -57.71 -36.47 72.06 Favored 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 110.091 -0.337 . . . . 1.47 110.091 178.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.423 ' OE1' ' HB3' ' A' ' 140' ' ' MET . 0.9 OUTLIER -57.05 -44.09 82.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.696 -0.683 . . . . 1.04 110.922 178.32 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.436 ' HB2' ' HA ' ' A' ' 97' ' ' SER . 0.4 OUTLIER -63.41 -55.63 22.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.059 -0.518 . . . . 1.39 110.822 -179.052 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -62.98 -33.98 76.55 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.849 -0.614 . . . . 1.75 110.516 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -57.74 -63.38 1.26 Allowed 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 115.973 -0.558 . . . . 1.2 110.388 176.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.553 ' HB2' ' SD ' ' A' ' 140' ' ' MET . 8.6 ttp -59.81 -30.66 69.07 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.41 -0.359 . . . . 1.76 110.54 -175.656 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.44 ' O ' HG12 ' A' ' 47' ' ' VAL . 3.0 tt0 -61.5 -55.92 25.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.665 -0.698 . . . . 1.47 111.101 178.247 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 62.6 m-80 -85.72 -27.24 25.41 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.092 0.404 . . . . 0.53 112.092 -176.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 94.9 t -89.36 -57.73 4.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 N-CA-C 112.305 0.483 . . . . 1.11 112.305 -177.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 48.0 t -82.15 -66.66 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 112.143 0.423 . . . . 1.07 112.143 -169.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.44 HG12 ' O ' ' A' ' 43' ' ' GLN . 0.9 OUTLIER -65.97 -37.18 79.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 C-N-CA 120.707 -0.397 . . . . 1.44 111.248 -174.248 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.517 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 0.2 OUTLIER -56.7 -39.95 74.76 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.544 0.212 . . . . 2.85 111.164 178.702 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 12.2 m -77.47 -35.78 53.44 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 121.131 -0.228 . . . . 1.23 111.158 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.02 -39.05 90.95 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.269 0.557 . . . . 1.11 109.581 175.012 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 33.1 t-105 -62.74 -29.35 70.62 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.549 -0.751 . . . . 0.44 111.235 177.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.517 ' HG3' ' O ' ' A' ' 48' ' ' LYS . 12.7 mtpt -82.5 -5.54 58.78 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 111.949 0.352 . . . . 2.75 111.949 -175.394 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.506 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 4.7 t-80 -74.71 128.19 34.95 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.01 0.433 . . . . 0.47 110.028 177.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -82.61 15.7 2.47 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.247 -0.433 . . . . 1.91 111.445 -176.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.506 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.4 OUTLIER -112.15 -7.42 14.05 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.175 -0.676 . . . . 1.24 109.175 171.296 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -96.24 11.42 34.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.63 -0.713 . . . . 1.09 110.498 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.492 ' CG ' ' HD3' ' A' ' 58' ' ' PRO . 42.9 p-90 -63.27 -33.33 10.32 Favored Pre-proline 0 CA--C 1.545 0.778 0 N-CA-C 113.849 1.055 . . . . 0.65 113.849 -175.64 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.492 ' HD3' ' CG ' ' A' ' 57' ' ' TRP . 10.3 Cg_exo -73.37 -13.76 25.35 Favored 'Trans proline' 0 C--N 1.356 0.956 0 C-N-CA 121.423 1.415 . . . . 0.61 111.88 176.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -94.91 -0.89 53.58 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.986 -0.552 . . . . 1.52 110.665 -178.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 12.5 m-30 -66.64 -34.53 78.07 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.017 -0.538 . . . . 1.01 110.987 -179.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -94.68 138.35 22.26 Favored Pre-proline 0 C--N 1.325 -0.479 0 CA-C-N 115.857 -0.611 . . . . 2.11 110.663 -175.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.591 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 41.2 Cg_endo -69.38 141.95 48.23 Favored 'Trans proline' 0 C--O 1.237 0.468 0 C-N-CA 122.523 2.149 . . . . 1.1 112.65 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 53.1 t -77.32 87.93 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.798 0.809 . . . . 1.46 109.319 177.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.596 ' O ' ' HB2' ' A' ' 65' ' ' ALA . 0.0 OUTLIER -102.98 1.92 34.29 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.286 -0.87 . . . . 1.85 110.41 -178.015 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.596 ' HB2' ' O ' ' A' ' 64' ' ' ASP . . . 85.72 -21.31 0.22 Allowed 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 114.804 -1.089 . . . . 1.43 112.186 177.091 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.408 HG22 HD11 ' A' ' 66' ' ' ILE . 35.0 mm -112.26 -49.37 5.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 120.859 0.361 . . . . 2.38 111.002 -178.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.43 -36.32 73.46 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.004 -0.544 . . . . 3.34 111.699 -178.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -108.58 4.8 24.43 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.328 -0.396 . . . . 2.3 110.456 178.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 55.33 52.27 11.69 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.349 -0.842 . . . . 1.89 111.597 -179.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 19.2 mt -127.05 64.9 62.37 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 116.058 -0.519 . . . . 2.18 111.61 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -75.76 -20.23 15.59 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 121.956 1.771 . . . . 1.42 110.865 176.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -75.78 -19.8 58.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.958 -1.019 . . . . 1.97 110.361 179.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.942 ' HH ' ' HB3' ' A' ' 111' ' ' ASN . 0.5 OUTLIER -64.77 -39.07 93.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.336 -0.847 . . . . 1.53 110.299 178.98 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -78.29 6.28 8.59 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.507 -0.769 . . . . 1.22 111.456 -174.44 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -97.36 -53.99 3.29 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.096 0.474 . . . . 3.34 109.727 -179.291 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.9 mp -90.53 -47.02 14.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.563 -0.744 . . . . 1.5 110.878 -178.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 26.8 mm -78.18 114.83 19.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.964 -0.562 . . . . 1.19 110.353 -177.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.9 mtmm -72.86 -27.01 61.67 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.677 -0.692 . . . . 2.35 111.441 -176.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -127.13 81.78 69.32 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 116.276 -0.42 . . . . 2.05 110.817 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -65.95 93.63 0.27 Allowed 'Trans proline' 0 C--O 1.236 0.392 0 C-N-CA 122.601 2.201 . . . . 1.24 111.94 178.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 1.6 mmt -126.26 157.55 38.02 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.893 -0.594 . . . . 1.39 110.335 -178.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.591 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 1.2 p-10 -139.65 -121.72 0.12 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.023 -0.989 . . . . 1.42 109.427 -172.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.6 ttp -130.72 -17.31 3.23 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.033 0.444 . . . . 1.14 110.434 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -88.71 -27.76 23.44 Favored Glycine 0 N--CA 1.442 -0.944 0 N-CA-C 110.235 -1.146 . . . . 0.33 110.235 -179.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -74.23 -36.0 63.9 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.271 -0.464 . . . . 1.6 110.655 176.138 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 75.5 mt -61.73 -53.05 53.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.796 -0.638 . . . . 1.63 110.093 175.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.512 ' O ' ' HG2' ' A' ' 91' ' ' GLU . 0.2 OUTLIER -63.08 -28.18 69.9 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.157 -0.474 . . . . 1.71 111.247 178.843 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -64.36 -47.18 80.3 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.894 0.378 . . . . 2.93 110.581 178.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.49 ' HB3' ' CE2' ' A' ' 95' ' ' TYR . 6.9 mtp180 -65.33 -29.71 70.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.008 -0.542 . . . . 1.49 110.447 178.222 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 12.4 mt -73.22 -54.92 7.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.759 -0.655 . . . . 1.14 111.674 -179.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 2.6 pt-20 -66.77 -31.56 72.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.432 -0.349 . . . . 1.39 111.215 -175.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -81.32 -4.78 56.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.33 -0.395 . . . . 1.66 110.507 178.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.5 t30 56.82 58.56 4.0 Favored 'General case' 0 CA--C 1.522 -0.097 0 CA-C-N 115.731 -0.668 . . . . 1.75 111.363 -179.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . 0.454 ' HB2' ' O ' ' A' ' 26' ' ' VAL . 62.1 t80 -87.54 -35.2 18.28 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.31 -0.404 . . . . 1.3 111.067 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . 0.49 ' CE2' ' HB3' ' A' ' 89' ' ' ARG . 54.1 m-85 -77.71 168.8 19.36 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-O 121.823 0.821 . . . . 1.72 111.624 -176.031 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . 0.623 ' CZ3' ' HB2' ' A' ' 32' ' ' PRO . 2.0 t90 -87.48 -44.25 11.45 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 114.116 -1.402 . . . . 1.15 109.432 168.166 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.436 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 3.3 t -153.22 170.89 19.45 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 114.949 -1.023 . . . . 1.05 110.265 -170.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.43 -23.43 66.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.746 0.308 . . . . 1.31 111.121 -177.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.3 -25.25 67.76 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.09 -0.505 . . . . 1.12 111.03 178.268 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.403 ' HB3' ' CD1' ' A' ' 95' ' ' TYR . 16.6 tt0 -83.86 -29.5 27.19 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.227 0.537 . . . . 2.44 109.653 179.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . 0.542 ' SG ' ' HE2' ' A' ' 42' ' ' MET . 5.2 t -82.45 -30.98 29.7 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.715 -0.675 . . . . 1.24 111.076 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.02 -30.96 69.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.258 -0.428 . . . . 1.66 110.775 -179.533 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -63.59 -43.07 98.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.13 -0.486 . . . . 3.72 110.261 175.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -68.31 -43.16 78.23 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.036 -0.529 . . . . 1.87 109.715 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.92 -52.18 63.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.478 -0.783 . . . . 0.45 110.508 176.138 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -59.78 -40.65 88.98 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.838 -0.619 . . . . 1.23 110.67 178.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' THR . . . . . 0.417 ' HA ' ' OG1' ' A' ' 110' ' ' THR . 97.3 m -63.34 -43.71 96.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.118 -0.492 . . . . 1.09 111.276 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.49 -44.3 68.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.987 0.422 . . . . 1.44 110.82 177.024 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -71.63 -41.08 69.29 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.124 -0.489 . . . . 0.29 111.24 -179.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' THR . . . . . 0.417 ' OG1' ' HA ' ' A' ' 107' ' ' THR . 0.1 OUTLIER -65.0 -42.15 94.73 Favored 'General case' 0 CA--C 1.52 -0.21 0 C-N-CA 120.88 -0.328 . . . . 1.33 110.623 -179.851 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . 0.942 ' HB3' ' HH ' ' A' ' 73' ' ' TYR . 59.6 m-20 -48.75 -52.55 23.1 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.656 -0.702 . . . . 2.36 111.114 178.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 1.8 t -56.26 -46.42 79.68 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.694 -0.684 . . . . 1.09 111.573 177.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -73.58 -20.81 60.52 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.83 0.307 . . . . 1.17 111.83 -174.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 89.0 mt -91.8 -55.93 5.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.653 0.263 . . . . 1.18 111.301 -176.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -76.19 -39.98 53.48 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.823 0.344 . . . . 1.6 110.905 -175.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -93.01 150.9 20.22 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.339 -0.391 . . . . 1.37 110.414 -176.232 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 2.9 ttpp -64.98 142.03 98.55 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.859 -0.609 . . . . 3.92 110.195 178.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -59.46 -13.1 19.31 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.832 2.355 . . . . 1.32 112.376 178.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -111.45 26.91 10.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.119 -0.491 . . . . 1.71 110.811 178.286 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -88.09 158.7 18.5 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.178 -0.465 . . . . 1.34 110.76 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.81 -43.66 98.41 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.153 -0.93 . . . . 1.44 110.611 -179.313 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . 0.433 HG22 ' N ' ' A' ' 123' ' ' VAL . 1.0 OUTLIER -69.16 -36.65 74.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-O 120.998 0.428 . . . . 1.16 110.872 -178.688 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.433 ' N ' HG22 ' A' ' 122' ' ' ILE . 3.1 t -67.66 -36.52 76.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.075 0.464 . . . . 1.1 110.302 -179.187 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.34 -33.78 71.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.812 -0.631 . . . . 1.22 110.112 178.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 16.9 mtt -79.61 -42.93 23.86 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.819 -0.628 . . . . 1.25 110.677 179.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.94 -36.79 65.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.042 -0.526 . . . . 1.1 111.755 -178.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -62.43 -40.91 98.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.471 . . . . 2.08 111.055 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.04 -37.71 61.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.078 0.466 . . . . 1.04 110.523 179.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.478 HD12 ' ND1' ' A' ' 53' ' ' HIS . 1.6 mp -58.85 -39.59 81.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.416 -0.811 . . . . 1.16 110.536 179.037 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -61.47 -25.12 67.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.517 -0.765 . . . . 1.47 112.075 -177.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.525 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -66.45 -39.45 88.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.777 0.322 . . . . 2.7 110.433 -176.924 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 8.9 mt -70.06 -30.9 45.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.069 -0.514 . . . . 1.79 110.416 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.607 ' O ' HG22 ' A' ' 137' ' ' VAL . 61.5 t80 -59.78 -62.87 1.55 Allowed 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.835 -0.621 . . . . 0.52 110.491 179.447 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.61 -30.26 71.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.937 0.398 . . . . 1.26 110.665 -177.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.525 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -57.16 -47.42 81.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.491 -0.777 . . . . 2.07 111.267 179.724 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.18 -18.55 26.91 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.91 -0.587 . . . . 2.11 111.139 -176.304 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.607 HG22 ' O ' ' A' ' 133' ' ' PHE . 40.5 t -72.34 -31.79 40.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 109.77 -0.455 . . . . 1.09 109.77 177.174 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -60.3 -27.38 67.26 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.48 -0.782 . . . . 1.21 110.588 175.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -91.02 -8.86 47.89 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.054 -0.975 . . . . 1.94 111.123 -173.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' MET . . . . . 0.553 ' SD ' ' HB2' ' A' ' 42' ' ' MET . 0.9 OUTLIER -64.81 144.59 98.93 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.11 -0.495 . . . . 1.34 111.171 -178.208 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . 0.474 ' C ' ' H ' ' A' ' 143' ' ' GLU . 57.9 Cg_endo -70.34 107.38 1.96 Allowed 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.453 2.102 . . . . 0.67 111.324 178.347 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.78 29.45 0.11 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.273 0.559 . . . . 3.68 111.759 -173.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . 0.474 ' H ' ' C ' ' A' ' 141' ' ' PRO . 22.3 mt-10 -105.33 -39.71 6.07 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.782 -0.644 . . . . 2.7 109.631 174.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 63.27 73.27 0.46 Allowed 'General case' 0 C--N 1.334 -0.089 0 CA-C-N 114.788 -1.096 . . . . 2.34 109.829 -174.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 1.5 t -89.62 122.01 40.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.698 -0.683 . . . . 1.66 109.734 -176.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.411 ' HA ' ' HA ' ' A' ' 36' ' ' THR . 7.9 tt0 -70.71 147.58 48.91 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.758 0.313 . . . . 1.53 110.698 -179.291 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 64.9 mt . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.584 -0.722 . . . . 1.57 110.239 -178.856 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.5 p . . . . . 0 N--CA 1.448 -0.552 0 CA-C-O 121.303 0.573 . . . . 1.5 109.48 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.2 m -177.11 138.78 0.25 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-N 114.957 -1.02 . . . . 1.85 109.827 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.462 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 35.3 t-20 -135.34 127.17 17.73 Favored Pre-proline 0 C--N 1.322 -0.625 0 N-CA-C 109.472 -0.566 . . . . 1.62 109.472 178.313 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -61.46 -38.3 64.55 Favored 'Trans proline' 0 N--CA 1.475 0.426 0 C-N-CA 123.239 2.626 . . . . 2.05 113.034 -178.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.1 m -80.34 -19.65 46.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.216 0.531 . . . . 2.24 110.49 -178.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.462 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 5.6 tttp -96.61 107.07 34.15 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.522 -0.763 . . . . 3.33 110.502 178.432 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.457 ' HB2' ' CZ3' ' A' ' 96' ' ' TRP . 3.2 Cg_exo -72.85 149.02 46.99 Favored 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 122.413 2.075 . . . . 1.8 112.391 -178.119 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -145.92 85.68 0.18 Allowed Glycine 0 N--CA 1.442 -0.965 0 N-CA-C 110.746 -0.941 . . . . 0.97 110.746 178.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -74.54 159.25 32.44 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.15 0.5 . . . . 2.37 110.976 -175.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.59 104.74 17.19 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.241 -0.436 . . . . 3.13 109.886 179.382 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.5 p -104.36 164.29 11.84 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.048 -0.524 . . . . 1.29 110.513 178.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -60.46 -41.37 93.99 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.268 -0.424 . . . . 1.47 110.551 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -61.92 -44.66 96.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.238 -0.437 . . . . 1.04 110.565 178.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.16 -52.96 63.11 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.824 -0.625 . . . . 1.39 111.092 -178.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 20.7 mm100 -69.26 -28.25 66.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.042 -0.526 . . . . 1.75 110.919 -179.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.463 ' CE1' ' HG2' ' A' ' 140' ' ' MET . 53.2 t80 -61.23 -63.84 1.15 Allowed 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.994 -0.548 . . . . 1.2 110.137 177.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.403 ' O ' ' HG3' ' A' ' 42' ' ' MET . 0.3 OUTLIER -61.52 -30.52 70.68 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.946 -0.301 . . . . 1.76 110.611 -173.091 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -58.71 -59.18 5.81 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.684 -0.689 . . . . 1.47 111.245 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 63.4 m-80 -87.81 -25.95 23.09 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 112.231 0.456 . . . . 0.53 112.231 -177.016 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 97.4 t -89.1 -57.97 3.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 112.386 0.513 . . . . 1.11 112.386 -175.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 59.6 t -81.97 -66.25 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 111.941 0.348 . . . . 1.07 111.941 -170.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.1 p -66.99 -32.7 59.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 C-N-CA 120.925 -0.31 . . . . 1.44 111.345 -174.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.2 -34.0 75.63 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.775 -0.37 . . . . 2.85 111.001 176.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 38.2 m -79.89 -36.59 36.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.725 0.297 . . . . 1.23 110.302 177.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -44.7 95.7 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.169 -0.469 . . . . 1.11 109.768 175.399 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 17.6 t-105 -62.76 -30.43 71.44 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.457 -0.792 . . . . 0.44 111.556 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.9 mtpp -90.7 7.62 38.6 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.018 0.377 . . . . 2.75 112.018 -174.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 41.3 t-80 -75.61 143.55 42.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.913 0.387 . . . . 0.47 110.133 177.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -69.12 -25.09 64.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.166 -0.47 . . . . 1.91 112.205 -175.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.501 ' HB3' ' HB2' ' A' ' 125' ' ' MET . 21.7 m-85 -105.23 8.42 33.96 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.065 0.459 . . . . 1.24 110.619 -178.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -93.15 8.13 41.4 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.135 0.493 . . . . 1.09 110.837 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.437 ' CG ' ' HD3' ' A' ' 58' ' ' PRO . 62.3 p-90 -62.44 -34.47 15.06 Favored Pre-proline 0 CA--C 1.548 0.872 0 N-CA-C 113.873 1.064 . . . . 0.65 113.873 -175.577 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.626 ' HG2' ' SD ' ' A' ' 125' ' ' MET . 5.6 Cg_exo -80.14 3.66 7.44 Favored 'Trans proline' 0 C--N 1.36 1.173 0 C-N-CA 121.636 1.557 . . . . 0.61 112.221 179.219 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.41 ' CE2' HD12 ' A' ' 122' ' ' ILE . 31.4 m-85 -113.9 47.05 1.23 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.702 0.763 . . . . 1.52 109.166 178.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -114.18 -13.61 12.38 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.146 -0.934 . . . . 1.01 109.903 -178.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.76 117.0 24.43 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 115.268 -0.878 . . . . 2.11 110.602 -169.377 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.32 143.23 93.55 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 122.337 2.024 . . . . 1.1 112.196 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.422 HG12 ' CD2' ' A' ' 73' ' ' TYR . 2.9 t -67.5 106.09 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-O 121.715 0.769 . . . . 1.46 110.047 178.226 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -107.51 0.93 23.06 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.859 -1.064 . . . . 1.85 109.379 178.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 77.31 -55.73 0.53 Allowed 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 114.274 -1.33 . . . . 1.43 111.595 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.0 mt -77.77 -49.41 21.99 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.817 0 N-CA-C 111.635 0.235 . . . . 2.38 111.635 -173.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.71 -19.73 64.38 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.805 0.298 . . . . 3.34 111.805 -175.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.4 tp -109.84 -0.86 18.17 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.888 -0.325 . . . . 2.3 111.288 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 61.88 42.78 9.98 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.711 -0.677 . . . . 1.89 112.129 178.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -126.51 68.37 67.74 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 115.969 -0.56 . . . . 2.18 110.683 176.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -72.1 -26.0 18.61 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.093 1.862 . . . . 1.42 111.869 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 -84.28 -4.14 58.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.741 -0.663 . . . . 1.97 110.484 -178.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.468 ' HA ' ' CE1' ' A' ' 115' ' ' TYR . 27.0 t80 -65.29 -30.89 71.79 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.699 -0.682 . . . . 1.53 110.307 178.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -80.89 2.93 24.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.548 -0.751 . . . . 1.22 111.613 -171.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.7 mtpt -96.75 -51.08 4.43 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.078 0.466 . . . . 3.34 109.859 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.7 mp -81.58 -45.0 20.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.865 -0.607 . . . . 1.5 110.539 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 45.0 mm -89.56 123.32 41.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.192 -0.458 . . . . 1.19 110.019 -178.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.45 ' O ' ' HD3' ' A' ' 80' ' ' PRO . 0.9 OUTLIER -86.44 -36.12 19.29 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.263 -0.426 . . . . 2.35 111.295 -175.235 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -112.33 90.4 14.15 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 109.708 -0.479 . . . . 2.05 109.708 176.598 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.45 ' HD3' ' O ' ' A' ' 78' ' ' LYS . 13.1 Cg_exo -69.11 87.11 0.47 Allowed 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.996 2.464 . . . . 1.24 111.937 -178.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.0 mmt -124.0 164.38 19.47 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.888 -0.596 . . . . 1.39 110.766 -176.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.485 ' CG ' ' H ' ' A' ' 83' ' ' MET . 19.9 t70 -143.18 -144.64 0.16 Allowed 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 106.755 -1.572 . . . . 1.42 106.755 -177.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' MET . . . . . 0.485 ' H ' ' CG ' ' A' ' 82' ' ' ASP . 0.5 OUTLIER -107.84 -18.06 13.91 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 107.924 -1.139 . . . . 1.14 107.924 177.758 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -74.98 -26.26 67.16 Favored Glycine 0 N--CA 1.439 -1.135 0 N-CA-C 109.398 -1.481 . . . . 0.33 109.398 177.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -83.9 -37.22 22.65 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 114.868 -0.666 . . . . 1.6 111.079 177.324 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.405 HD12 ' N ' ' A' ' 86' ' ' ILE . 0.2 OUTLIER -61.11 -49.96 82.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.003 -0.544 . . . . 1.63 109.719 178.095 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.457 ' HZ2' ' CD ' ' A' ' 91' ' ' GLU . 0.1 OUTLIER -66.58 -26.44 67.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.863 -0.608 . . . . 1.71 111.001 179.957 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.411 ' N ' ' HG3' ' A' ' 87' ' ' LYS . 1.2 tptt -67.47 -51.36 52.26 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-O 120.688 0.28 . . . . 2.93 110.703 -179.327 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.446 HH22 ' CG ' ' A' ' 104' ' ' ASP . 10.0 mtm-85 -67.66 -24.05 65.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.944 0.402 . . . . 1.49 110.81 -179.153 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.403 HD11 ' SG ' ' A' ' 101' ' ' CYS . 4.0 mt -73.33 -59.52 2.67 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.957 -0.565 . . . . 1.14 111.041 177.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.457 ' CD ' ' HZ2' ' A' ' 87' ' ' LYS . 19.9 pt-20 -66.63 -36.73 83.29 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.738 -0.665 . . . . 1.39 111.114 -175.019 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -79.26 -4.41 50.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.384 -0.371 . . . . 1.66 110.6 -179.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 58.25 72.04 0.55 Allowed 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.428 0.632 . . . . 1.75 110.731 176.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -93.97 -49.94 5.56 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.002 -0.544 . . . . 1.3 110.98 179.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . 0.436 ' CE1' ' HB2' ' A' ' 101' ' ' CYS . 0.2 OUTLIER -96.07 -179.67 4.76 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.846 0.355 . . . . 1.72 110.94 -177.933 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . 0.457 ' CZ3' ' HB2' ' A' ' 32' ' ' PRO . 2.1 t-105 -82.58 -46.52 13.23 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.74 -0.664 . . . . 1.15 111.878 -174.055 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.4 t -144.93 172.3 13.24 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 120.424 -0.511 . . . . 1.05 110.929 -173.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -68.16 -17.88 64.46 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.081 -0.508 . . . . 1.31 111.458 -176.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.06 -33.81 73.91 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 121.019 0.437 . . . . 1.12 109.976 175.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.4 -37.35 63.4 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.877 -0.601 . . . . 2.44 109.571 177.179 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . 0.436 ' HB2' ' CE1' ' A' ' 95' ' ' TYR . 41.3 t -68.01 -39.49 83.17 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.565 -0.743 . . . . 1.24 111.322 -178.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.23 -22.99 67.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.359 -0.382 . . . . 1.66 110.912 -177.029 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -67.2 -44.29 79.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.064 0.459 . . . . 3.72 110.466 175.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . 0.446 ' CG ' HH22 ' A' ' 89' ' ' ARG . 0.6 OUTLIER -78.76 -29.97 45.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.36 -0.382 . . . . 1.87 110.194 -179.348 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.84 -40.72 93.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.77 -0.65 . . . . 0.45 109.647 173.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -68.72 -34.52 75.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.771 -0.65 . . . . 1.23 110.126 174.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 86.3 m -63.02 -51.93 64.86 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.891 -0.595 . . . . 1.09 111.265 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 10.7 ptm -59.57 -32.75 70.65 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.783 0.325 . . . . 1.44 111.291 -178.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -73.13 -47.51 43.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.509 -0.314 . . . . 0.29 110.764 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.1 p -64.84 -38.97 92.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.756 0.312 . . . . 1.33 110.589 179.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.0 m-20 -47.83 -53.08 16.65 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.529 -0.759 . . . . 2.36 110.731 177.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 10.6 t -60.84 -43.81 97.78 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.312 -0.858 . . . . 1.09 111.02 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -66.14 -33.98 77.02 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.492 -0.322 . . . . 1.17 111.541 -177.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 70.6 mt -80.32 -55.46 8.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.575 -0.284 . . . . 1.18 111.622 -176.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . 0.468 ' CE1' ' HA ' ' A' ' 73' ' ' TYR . 57.6 t80 -68.3 -35.87 78.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.908 0.385 . . . . 1.6 111.43 -174.048 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 63.6 m-80 -94.23 -170.23 2.24 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.137 -0.483 . . . . 1.37 110.725 -175.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.31 154.5 40.54 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 116.32 -0.4 . . . . 3.92 110.363 -177.563 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -61.9 -25.54 78.21 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.415 2.076 . . . . 1.32 111.67 176.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.26 22.07 12.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.787 -0.642 . . . . 1.71 111.018 178.273 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -87.23 155.57 20.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 1.34 110.341 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -68.83 -42.36 77.31 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.728 -0.669 . . . . 1.44 110.244 -178.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . 0.7 ' HA ' ' SD ' ' A' ' 125' ' ' MET . 1.4 tp -65.21 -32.81 59.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.853 -0.612 . . . . 1.16 110.743 -177.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 2.7 t -74.09 -37.71 47.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.145 0.498 . . . . 1.1 110.105 178.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.14 -38.45 79.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.681 -0.691 . . . . 1.22 110.515 -178.495 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' MET . . . . . 0.7 ' SD ' ' HA ' ' A' ' 122' ' ' ILE . 0.0 OUTLIER -82.5 -39.28 22.67 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.325 -0.398 . . . . 1.25 111.311 177.991 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.23 -32.24 64.26 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.753 0.311 . . . . 1.1 111.566 -178.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -63.98 -44.39 92.84 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.17 -0.468 . . . . 2.08 110.692 177.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.63 -41.23 84.23 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.236 -0.438 . . . . 1.04 110.565 177.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.584 HD12 ' O ' ' A' ' 125' ' ' MET . 9.3 mp -56.73 -45.34 82.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.81 -0.632 . . . . 1.16 110.549 177.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -65.05 -23.32 67.15 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.649 -0.705 . . . . 1.47 111.551 -177.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.2 -49.16 53.07 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 110.17 -0.308 . . . . 2.7 110.17 -177.11 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 129' ' ' LEU . 1.0 OUTLIER -72.41 -24.92 22.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.41 -0.359 . . . . 1.79 110.324 178.07 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.487 ' O ' HG21 ' A' ' 137' ' ' VAL . 39.9 t80 -60.76 -62.07 2.12 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.97 -0.559 . . . . 0.52 110.406 174.597 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.82 -25.58 67.28 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.897 0.379 . . . . 1.26 110.629 -177.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.402 ' HB2' ' HA ' ' A' ' 132' ' ' ILE . 1.3 mm-40 -60.84 -44.06 97.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.68 -0.691 . . . . 2.07 111.042 -179.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 30.6 mttm -91.73 -13.0 32.36 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.955 0.407 . . . . 2.11 111.017 -177.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.487 HG21 ' O ' ' A' ' 133' ' ' PHE . 19.5 t -81.73 -29.12 10.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.207 0.527 . . . . 1.09 110.04 178.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -71.76 -7.76 50.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.436 0.636 . . . . 1.21 110.324 176.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -107.68 2.87 24.12 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.237 -0.892 . . . . 1.94 110.378 179.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' MET . . . . . 0.463 ' HG2' ' CE1' ' A' ' 41' ' ' TYR . 0.6 OUTLIER -61.77 149.51 84.85 Favored Pre-proline 0 C--O 1.232 0.182 0 CA-C-N 115.669 -0.696 . . . . 1.34 110.676 177.022 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -74.02 90.68 0.96 Allowed 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 121.902 1.734 . . . . 0.67 110.832 175.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -63.79 -4.15 2.94 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.996 -0.547 . . . . 3.68 111.736 -175.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -79.06 -34.77 43.42 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.771 -0.649 . . . . 2.7 110.066 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 67.68 93.26 0.08 Allowed 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 114.813 -1.085 . . . . 2.34 109.524 -177.024 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -113.04 118.73 58.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.818 -0.628 . . . . 1.66 110.142 -176.245 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -74.28 132.59 42.23 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.676 -0.49 . . . . 1.53 109.676 178.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 34.3 mt . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.744 -0.646 . . . . 1.57 110.133 -177.062 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 7.9 p . . . . . 0 N--CA 1.452 -0.368 0 CA-C-O 121.897 0.856 . . . . 1.5 108.696 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -146.43 138.42 24.88 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 114.32 -1.309 . . . . 1.85 108.416 177.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.508 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 16.4 t-20 -143.01 122.33 7.6 Favored Pre-proline 0 C--N 1.313 -0.98 0 C-N-CA 120.786 -0.366 . . . . 1.62 110.459 176.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -67.39 -46.29 2.97 Favored 'Trans proline' 0 N--CA 1.475 0.439 0 C-N-CA 123.43 2.753 . . . . 2.05 113.351 -177.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.8 m -71.81 -39.52 69.79 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.975 -0.557 . . . . 2.24 110.502 -175.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.508 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 0.2 OUTLIER -66.38 130.37 94.2 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.338 -0.846 . . . . 3.33 110.005 179.638 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -60.97 156.79 42.11 Favored 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.7 2.267 . . . . 1.8 112.554 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -160.67 63.11 0.29 Allowed Glycine 0 N--CA 1.446 -0.667 0 N-CA-C 110.658 -0.977 . . . . 0.97 110.658 -179.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.462 ' HG3' ' CZ2' ' A' ' 96' ' ' TRP . 5.8 mtm-85 -79.53 132.54 36.34 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.848 0.356 . . . . 2.37 110.142 -174.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.4 ttmt -80.33 119.75 23.47 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.104 -0.498 . . . . 3.13 110.438 -173.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.425 ' HA ' ' HA ' ' A' ' 146' ' ' GLU . 0.6 OUTLIER -112.76 160.34 18.06 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.815 -0.354 . . . . 1.29 111.154 178.421 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.641 ' ND2' ' HG3' ' A' ' 141' ' ' PRO . 11.9 t30 -55.51 -46.56 76.96 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 115.786 -0.643 . . . . 1.47 110.321 176.384 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -54.32 -46.31 72.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.648 -0.706 . . . . 1.04 110.925 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.0 -57.96 10.75 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.643 -0.708 . . . . 1.39 111.561 -177.409 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -70.86 -25.29 62.74 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.066 -0.515 . . . . 1.75 110.79 -176.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.581 ' CE1' ' HG2' ' A' ' 140' ' ' MET . 54.0 t80 -61.85 -62.39 1.83 Allowed 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 116.064 -0.516 . . . . 1.2 110.345 175.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.52 ' O ' HG13 ' A' ' 47' ' ' VAL . 0.1 OUTLIER -59.15 -35.22 73.14 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 120.792 0.33 . . . . 1.76 110.15 -175.329 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -56.75 -54.66 43.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.567 -0.742 . . . . 1.47 111.159 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.437 ' O ' ' HB2' ' A' ' 48' ' ' LYS . 69.5 m-80 -87.02 -28.62 22.51 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.362 0.504 . . . . 0.53 112.362 -177.217 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 74.8 t -89.19 -58.24 3.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 112.3 0.482 . . . . 1.11 112.3 -175.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 43.3 t -79.52 -62.67 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 116.482 -0.326 . . . . 1.07 111.359 -170.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.52 HG13 ' O ' ' A' ' 42' ' ' MET . 1.5 m -62.92 -33.22 59.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 111.669 0.248 . . . . 1.44 111.669 -175.146 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.437 ' HB2' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -67.48 -35.24 78.79 Favored 'General case' 0 CA--C 1.528 0.118 0 C-N-CA 120.936 -0.305 . . . . 2.85 111.488 179.275 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.4 m -74.24 -37.76 63.7 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.78 -0.368 . . . . 1.23 110.51 178.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.417 HD11 ' SD ' ' A' ' 83' ' ' MET . 0.1 OUTLIER -66.59 -37.61 85.27 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.255 0.55 . . . . 1.11 109.844 175.253 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 9.7 t-105 -65.41 -25.72 67.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.47 -0.786 . . . . 0.44 111.623 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -89.74 3.16 53.65 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 120.61 -0.436 . . . . 2.75 111.665 -177.107 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.519 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 15.7 t-80 -89.1 129.96 35.63 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.647 -0.501 . . . . 0.47 109.647 175.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.97 -3.27 41.1 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.188 0.44 . . . . 1.91 112.188 -172.198 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.519 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 2.1 m-30 -93.05 -10.38 36.36 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.157 0.503 . . . . 1.24 110.114 175.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -92.4 19.93 6.67 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.972 -0.558 . . . . 1.09 110.514 178.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.635 ' HA ' ' CE2' ' A' ' 60' ' ' TYR . 44.8 p-90 -67.89 -34.45 6.34 Favored Pre-proline 0 CA--C 1.543 0.675 0 N-CA-C 113.309 0.855 . . . . 0.65 113.309 -175.008 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.602 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 3.4 Cg_exo -82.31 10.15 3.68 Favored 'Trans proline' 0 C--N 1.358 1.055 0 C-N-CA 121.711 1.607 . . . . 0.61 111.203 174.129 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -112.57 -15.65 13.0 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.546 -0.752 . . . . 1.52 111.182 -177.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.635 ' CE2' ' HA ' ' A' ' 57' ' ' TRP . 12.5 m-85 -66.6 -28.58 68.61 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.389 0.614 . . . . 1.01 110.147 177.445 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -98.35 116.57 65.48 Favored Pre-proline 0 C--N 1.32 -0.693 0 CA-C-N 115.063 -0.971 . . . . 2.11 110.431 -172.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.637 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 18.0 Cg_endo -62.56 133.08 40.77 Favored 'Trans proline' 0 C--O 1.24 0.597 0 C-N-CA 122.564 2.176 . . . . 1.1 112.52 -178.589 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.1 t -62.33 111.14 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 CA-C-O 121.893 0.854 . . . . 1.46 109.846 178.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.474 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.2 OUTLIER -122.5 -3.53 8.84 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.684 -1.144 . . . . 1.85 109.717 -175.058 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 74.95 -40.43 0.44 Allowed 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 114.967 -1.015 . . . . 1.43 111.596 -178.004 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.8 mt -86.43 -60.92 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 120.677 0.275 . . . . 2.38 111.25 -176.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.408 ' HG2' ' HB3' ' A' ' 64' ' ' ASP . 6.1 pttt -71.5 -10.6 60.01 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.246 0.462 . . . . 3.34 112.246 -175.342 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -114.58 -1.57 13.34 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.921 0.391 . . . . 2.3 110.596 175.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 52.9 50.33 18.24 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.849 -0.614 . . . . 1.89 111.735 -178.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 12.7 mt -120.81 71.07 19.32 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.804 -0.634 . . . . 2.18 109.628 174.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.71 -31.47 20.7 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.805 2.337 . . . . 1.42 113.458 -170.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.442 ' OD1' ' HG3' ' A' ' 75' ' ' LYS . 0.4 OUTLIER -100.11 10.86 40.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.925 0.393 . . . . 1.97 111.316 -176.763 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 15.8 t80 -63.46 -37.41 87.19 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.073 -0.512 . . . . 1.53 110.266 178.071 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 8.6 m-70 -78.99 -1.11 33.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.678 -0.692 . . . . 1.22 111.415 -175.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.442 ' HG3' ' OD1' ' A' ' 72' ' ' ASP . 13.0 mmtm -96.24 -18.01 20.35 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.216 0.531 . . . . 3.34 110.159 -179.272 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.3 mp -114.82 -45.43 4.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.66 -0.7 . . . . 1.5 110.171 178.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 33.3 mm -93.72 116.38 34.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 120.953 0.406 . . . . 1.19 110.116 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.85 -28.41 60.66 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.904 -0.589 . . . . 2.35 111.282 -177.028 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -122.33 85.33 47.4 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 116.23 -0.441 . . . . 2.05 110.842 -177.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -68.34 89.95 0.39 Allowed 'Trans proline' 0 CA--C 1.528 0.209 0 C-N-CA 122.527 2.152 . . . . 1.24 112.198 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 10.2 mmt -131.73 157.38 43.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.067 -0.515 . . . . 1.39 110.331 -178.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.637 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 1.2 p-10 -151.67 -115.39 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.699 -0.682 . . . . 1.42 109.637 -172.227 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' MET . . . . . 0.417 ' SD ' HD11 ' A' ' 50' ' ' LEU . 11.6 ttp -129.45 -22.28 3.06 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 121.922 -0.486 . . . . 1.14 110.789 176.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -83.3 -25.88 46.0 Favored Glycine 0 N--CA 1.444 -0.816 0 N-CA-C 110.607 -0.997 . . . . 0.33 110.607 179.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.82 -44.86 30.83 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.375 -0.413 . . . . 1.6 110.504 175.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.488 HD13 ' O ' ' A' ' 82' ' ' ASP . 83.6 mt -58.5 -48.68 84.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.732 -0.667 . . . . 1.63 110.257 175.199 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.416 ' HB3' ' O ' ' A' ' 83' ' ' MET . 0.0 OUTLIER -59.6 -32.93 70.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.116 -0.493 . . . . 1.71 110.902 178.397 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 8.6 tppt? -67.4 -50.39 59.81 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 120.601 0.239 . . . . 2.93 110.696 -179.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.691 ' HB3' ' CE1' ' A' ' 95' ' ' TYR . 15.2 mtp180 -68.22 -28.25 67.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.911 0.386 . . . . 1.49 110.643 179.29 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 5.8 mt -68.14 -56.59 8.24 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.86 -0.609 . . . . 1.14 111.635 177.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -65.92 -26.36 67.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.982 0.42 . . . . 1.39 111.24 -176.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -87.96 -4.68 58.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.989 -0.551 . . . . 1.66 110.715 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 50.63 61.66 3.1 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.739 -0.664 . . . . 1.75 110.766 -176.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -85.07 -32.83 22.64 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 115.913 -0.585 . . . . 1.3 111.014 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . 0.691 ' CE1' ' HB3' ' A' ' 89' ' ' ARG . 0.1 OUTLIER -80.71 -145.15 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.797 0.808 . . . . 1.72 110.398 178.885 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . 0.462 ' CZ2' ' HG3' ' A' ' 34' ' ' ARG . 2.3 t-105 -126.83 -53.59 1.43 Allowed 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 114.479 -1.237 . . . . 1.15 108.091 174.397 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 12.6 t -133.93 -173.06 3.14 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 115.043 -0.98 . . . . 1.05 110.072 -177.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.81 -5.49 58.24 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.611 0.243 . . . . 1.31 111.345 -177.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.45 -41.92 98.65 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.902 0.382 . . . . 1.12 110.552 177.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -69.66 -28.68 66.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.332 0.587 . . . . 2.44 109.593 177.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 4.2 t -71.77 -30.75 65.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.305 -0.862 . . . . 1.24 110.543 177.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.6 ttm -64.89 -40.37 94.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.08 -0.509 . . . . 1.66 109.935 177.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.2 -37.37 83.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.73 -0.668 . . . . 3.72 110.123 176.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . 0.416 ' HB3' HG12 ' A' ' 86' ' ' ILE . 1.1 m-20 -58.6 -55.58 33.28 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.601 -0.727 . . . . 1.87 110.509 177.14 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -58.31 -44.58 88.65 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.782 -0.645 . . . . 0.45 110.913 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -56.87 -44.98 82.77 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.28 -0.418 . . . . 1.23 110.294 177.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 54.3 m -65.12 -47.53 76.81 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.125 -0.489 . . . . 1.09 111.037 178.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.72 -41.57 74.05 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.083 -0.508 . . . . 1.44 111.313 -179.706 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -73.41 -45.79 52.59 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.422 -0.354 . . . . 0.29 110.633 -177.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.0 p -63.81 -35.6 81.14 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.607 -0.27 . . . . 1.33 110.871 -179.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 49.2 m-20 -46.28 -52.08 13.3 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.638 -0.71 . . . . 2.36 111.348 176.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 7.4 t -61.02 -38.42 86.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.451 -0.795 . . . . 1.09 111.085 -178.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -75.97 -16.21 60.03 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.336 -0.393 . . . . 1.17 111.71 -175.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 57.1 mt -92.39 -51.66 11.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.95 0.405 . . . . 1.18 110.816 178.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -71.52 -35.6 70.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.841 -0.618 . . . . 1.6 111.654 -175.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -105.3 -179.82 4.05 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.912 0.387 . . . . 1.37 110.982 -175.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.4 154.83 39.27 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.195 -0.457 . . . . 3.92 110.921 -177.027 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -61.48 -17.8 55.81 Favored 'Trans proline' 0 N--CA 1.476 0.49 0 C-N-CA 122.733 2.289 . . . . 1.32 112.373 177.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.16 0.42 51.22 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.832 -0.622 . . . . 1.71 111.515 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -71.43 156.25 39.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.446 0.641 . . . . 1.34 111.734 -173.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -69.58 -41.59 75.61 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.91 -1.041 . . . . 1.44 109.884 -179.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 3.1 tp -67.46 -28.11 40.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.602 -0.727 . . . . 1.16 110.627 -179.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 1.3 t -70.48 -45.61 73.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 109.794 -0.447 . . . . 1.1 109.794 176.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.68 -33.23 71.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.668 -0.696 . . . . 1.22 109.736 177.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 30.5 mtt -71.15 -46.62 61.12 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.475 -0.784 . . . . 1.25 110.506 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.58 -40.42 75.2 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.253 -0.43 . . . . 1.1 111.481 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -44.96 96.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.468 -0.333 . . . . 2.08 111.217 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -70.68 -36.89 73.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.074 0.464 . . . . 1.04 110.564 178.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.29 -44.06 92.82 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.567 -0.742 . . . . 1.16 110.667 179.589 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -62.18 -25.91 68.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.744 -0.662 . . . . 1.47 111.349 -178.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.465 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 17.0 ttpt -64.25 -42.39 96.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.22 -0.445 . . . . 2.7 110.029 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . 0.421 ' HA ' ' HB2' ' A' ' 135' ' ' GLN . 0.1 OUTLIER -77.27 -23.69 14.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.09 -0.505 . . . . 1.79 110.501 -179.625 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.464 ' O ' HG23 ' A' ' 137' ' ' VAL . 30.3 t80 -62.09 -62.1 2.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.074 -0.512 . . . . 0.52 110.168 176.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.11 -26.46 68.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.126 0.489 . . . . 1.26 110.205 -178.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.465 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.01 -33.66 72.3 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.385 -0.825 . . . . 2.07 111.762 179.314 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.96 -25.14 15.09 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.135 0.493 . . . . 2.11 110.597 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.514 ' O ' ' HB2' ' A' ' 140' ' ' MET . 53.9 t -69.79 -32.35 51.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.948 -0.569 . . . . 1.09 110.619 179.176 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.59 -16.98 64.03 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.124 -0.489 . . . . 1.21 110.49 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -100.29 0.03 39.37 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.741 -0.663 . . . . 1.94 110.223 -179.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' MET . . . . . 0.581 ' HG2' ' CE1' ' A' ' 41' ' ' TYR . 0.1 OUTLIER -71.65 161.2 79.86 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.69 -0.686 . . . . 1.34 110.195 176.903 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . 0.641 ' HG3' ' ND2' ' A' ' 37' ' ' ASN . 65.3 Cg_endo -74.7 107.67 2.52 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 121.714 1.609 . . . . 0.67 109.796 173.306 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -72.29 2.39 6.12 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.801 0.334 . . . . 3.68 111.881 -171.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -100.22 -111.52 0.19 Allowed 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 108.652 -0.87 . . . . 2.7 108.652 171.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 178.3 131.35 0.07 Allowed 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.606 -0.887 . . . . 2.34 108.606 173.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 2.8 t -129.04 94.05 2.27 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.705 -0.48 . . . . 1.66 109.705 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.425 ' HA ' ' HA ' ' A' ' 36' ' ' THR . 4.8 tt0 -67.99 146.28 53.7 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 110.148 -0.316 . . . . 1.53 110.148 177.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 9.8 mt . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.427 -0.797 . . . . 1.57 110.133 -178.598 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.459 ' O ' ' HB2' ' A' ' 94' ' ' TYR . 5.1 p . . . . . 0 N--CA 1.445 -0.686 0 CA-C-O 121.49 0.662 . . . . 1.5 109.216 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -160.52 142.14 12.38 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.305 -0.861 . . . . 1.85 109.053 175.591 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.445 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 23.0 t-20 -134.92 127.12 18.16 Favored Pre-proline 0 C--N 1.316 -0.871 0 CA-C-O 120.639 0.257 . . . . 1.62 110.57 -179.661 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -72.97 -44.89 0.52 Allowed 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 122.837 2.358 . . . . 2.05 112.344 175.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.0 m -74.15 -38.22 63.81 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.743 -0.662 . . . . 2.24 110.719 -175.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.445 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 0.2 OUTLIER -85.78 130.31 51.22 Favored Pre-proline 0 C--N 1.322 -0.612 0 N-CA-C 109.055 -0.72 . . . . 3.33 109.055 177.183 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.434 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 18.6 Cg_endo -57.5 137.8 83.14 Favored 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.794 2.329 . . . . 1.8 112.907 -175.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -150.67 84.66 0.16 Allowed Glycine 0 N--CA 1.446 -0.656 0 CA-C-N 114.775 -1.102 . . . . 0.97 110.503 -178.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -100.78 -177.84 3.59 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.101 0.477 . . . . 2.37 111.338 -172.277 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.3 ttmt -123.76 100.0 6.56 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.712 -0.676 . . . . 3.13 110.09 177.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 18.0 p -101.13 173.94 6.23 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 116.41 -0.359 . . . . 1.29 110.042 175.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.518 HD22 ' HG2' ' A' ' 141' ' ' PRO . 0.0 OUTLIER -65.68 -38.4 89.18 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.252 -0.431 . . . . 1.47 110.598 178.779 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.508 ' NE2' ' HG2' ' A' ' 144' ' ' GLU . 1.5 tt0 -62.9 -42.77 99.89 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 120.619 0.247 . . . . 1.04 110.856 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.401 ' HB2' ' HA ' ' A' ' 97' ' ' SER . 0.8 OUTLIER -61.07 -54.09 49.03 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.165 -0.471 . . . . 1.39 110.601 179.917 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.3 mm-40 -63.36 -35.55 80.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.988 -0.551 . . . . 1.75 110.781 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -58.39 -64.05 1.06 Allowed 'General case' 0 C--O 1.217 -0.641 0 CA-C-N 116.181 -0.463 . . . . 1.2 110.359 177.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.556 ' SD ' ' HB3' ' A' ' 101' ' ' CYS . 3.3 ttm -60.15 -32.84 71.42 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.414 -0.217 . . . . 1.76 110.414 -174.479 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -59.31 -58.11 10.06 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.904 -0.589 . . . . 1.47 111.056 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.4 m-80 -86.19 -28.04 24.14 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.146 -0.479 . . . . 0.53 112.054 -175.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 95.7 t -88.63 -56.57 5.06 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.926 0 CA-C-N 116.093 -0.503 . . . . 1.11 111.641 -176.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 92.5 t -80.08 -65.74 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.395 -0.366 . . . . 1.07 111.892 -170.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -63.57 -34.45 67.69 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 C-N-CA 120.601 -0.439 . . . . 1.44 111.526 -174.425 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.89 -32.0 73.25 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.935 -0.306 . . . . 2.85 111.442 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 51.1 m -75.64 -37.5 59.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.842 0.353 . . . . 1.23 110.329 177.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.56 -40.81 97.94 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.162 -0.681 . . . . 1.11 109.162 174.031 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 12.4 t-105 -59.12 -37.56 77.51 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.115 -0.948 . . . . 0.44 111.494 178.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 14.3 mttm -88.86 9.27 25.37 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.178 0.436 . . . . 2.75 112.178 -175.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 16.3 t-80 -79.51 144.98 33.46 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.422 -0.584 . . . . 0.47 109.422 174.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -79.9 -12.75 59.72 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.616 0.246 . . . . 1.91 111.543 -174.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 3.7 m-30 -99.43 -8.16 25.12 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.992 0.425 . . . . 1.24 110.653 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -95.36 16.34 17.07 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.084 0.469 . . . . 1.09 110.808 -179.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.443 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 60.3 p-90 -62.38 -34.14 14.14 Favored Pre-proline 0 CA--C 1.548 0.867 0 N-CA-C 114.282 1.216 . . . . 0.65 114.282 -174.577 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.443 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 59.4 Cg_endo -90.58 9.88 3.05 Favored 'Trans proline' 0 C--N 1.36 1.148 0 CA-C-N 121.204 1.466 . . . . 0.61 112.866 -178.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -106.39 6.97 30.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.184 -0.462 . . . . 1.52 110.88 -177.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.8 m-30 -75.66 -24.87 56.4 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.212 -0.449 . . . . 1.01 111.966 -175.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.16 128.15 31.43 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 116.482 -0.326 . . . . 2.11 111.325 -171.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.499 ' HA ' ' OD2' ' A' ' 82' ' ' ASP . 27.0 Cg_endo -63.12 133.22 39.91 Favored 'Trans proline' 0 C--O 1.236 0.424 0 C-N-CA 122.667 2.244 . . . . 1.1 111.482 178.037 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.7 t -59.62 110.48 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 122.189 0.995 . . . . 1.46 111.676 -178.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -121.17 125.89 48.3 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 113.848 -1.524 . . . . 1.85 106.977 167.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.518 ' HB1' ' NE2' ' A' ' 74' ' ' HIS . . . -63.09 -12.49 27.26 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.62 0.6 . . . . 1.43 112.62 -170.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.9 mp -106.58 -42.44 6.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 120.84 0.352 . . . . 2.38 110.497 -177.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 36.1 tptt -67.09 -44.12 80.81 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.056 -0.52 . . . . 3.34 111.076 179.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -97.54 -3.77 39.12 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.374 -0.375 . . . . 2.3 110.693 -179.123 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 53.37 63.04 2.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.607 -0.724 . . . . 1.89 110.689 -176.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -119.81 70.09 13.58 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 115.749 -0.66 . . . . 2.18 110.235 -179.037 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.79 -24.78 8.34 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.388 2.059 . . . . 1.42 112.622 -175.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -96.76 -8.18 31.9 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.004 0.43 . . . . 1.97 110.708 -178.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.57 ' O ' ' HB ' ' A' ' 77' ' ' ILE . 17.6 t80 -61.91 -40.17 94.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.762 -0.654 . . . . 1.53 110.208 178.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . 0.518 ' NE2' ' HB1' ' A' ' 65' ' ' ALA . 9.5 m-70 -80.33 3.82 19.83 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.877 -0.601 . . . . 1.22 111.174 -178.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -108.16 -50.12 3.09 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.032 0.444 . . . . 3.34 110.114 179.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.0 mt -78.71 -36.95 20.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.74 -0.664 . . . . 1.5 110.692 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.57 ' HB ' ' O ' ' A' ' 73' ' ' TYR . 28.1 mm -99.79 135.6 34.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.903 -0.59 . . . . 1.19 109.819 -178.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.66 -40.64 14.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.813 0.339 . . . . 2.35 111.019 -176.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 10.1 m-20 -113.26 95.73 36.5 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.196 -0.456 . . . . 2.05 110.03 177.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -68.59 92.87 0.42 Allowed 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.924 2.416 . . . . 1.24 112.306 -178.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 13.3 mmt -135.79 167.28 21.46 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.121 -0.49 . . . . 1.39 110.633 -178.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.499 ' OD2' ' HA ' ' A' ' 62' ' ' PRO . 3.0 p-10 -151.49 -123.19 0.04 OUTLIER 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.044 -0.98 . . . . 1.42 108.788 -177.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -125.31 -17.77 5.55 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.082 0.467 . . . . 1.14 110.301 177.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.448 ' O ' ' HB2' ' A' ' 88' ' ' LYS . . . -88.65 -23.97 34.57 Favored Glycine 0 N--CA 1.44 -1.088 0 N-CA-C 110.304 -1.118 . . . . 0.33 110.304 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -76.89 -39.98 49.08 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.332 -0.434 . . . . 1.6 110.442 175.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.528 HG22 ' SG ' ' A' ' 101' ' ' CYS . 38.9 mt -59.8 -49.09 85.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.707 -0.679 . . . . 1.63 110.369 176.764 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.402 ' HG3' ' O ' ' A' ' 84' ' ' GLY . 0.2 OUTLIER -67.14 -28.94 68.55 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.367 -0.379 . . . . 1.71 110.682 179.138 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.448 ' HB2' ' O ' ' A' ' 84' ' ' GLY . 11.1 tttt -64.89 -41.73 95.38 Favored 'General case' 0 N--CA 1.457 -0.089 0 CA-C-O 121.049 0.452 . . . . 2.93 110.691 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 10.0 mtp180 -75.25 -32.35 61.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.012 -0.54 . . . . 1.49 110.68 178.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 8.1 mt -63.52 -53.17 56.09 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.863 -0.608 . . . . 1.14 111.167 178.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -66.79 -30.38 70.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.079 -0.51 . . . . 1.39 111.211 -176.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 12.4 m-80 -84.15 0.0 50.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.151 -0.477 . . . . 1.66 111.184 -177.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 60.52 50.97 5.42 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.705 0.628 . . . . 1.75 111.393 178.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . 0.459 ' HB2' ' O ' ' A' ' 26' ' ' VAL . 61.3 t80 -82.87 -33.59 26.99 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.082 -0.508 . . . . 1.3 111.193 179.279 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . 0.68 ' CD1' ' HB3' ' A' ' 100' ' ' GLU . 41.0 m-85 -90.78 169.45 10.94 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 121.541 0.686 . . . . 1.72 111.607 -176.148 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . 0.434 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 2.0 t90 -88.3 -44.7 10.62 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 114.526 -1.215 . . . . 1.15 109.2 169.314 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.401 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 35.3 t -152.12 177.18 10.77 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.139 -0.937 . . . . 1.05 110.224 -172.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -69.29 -18.05 63.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.928 0.394 . . . . 1.31 111.284 -177.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.57 -18.44 64.87 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.075 -0.511 . . . . 1.12 110.874 178.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.68 ' HB3' ' CD1' ' A' ' 95' ' ' TYR . 1.5 mt-10 -86.32 -39.95 15.96 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 109.435 -0.58 . . . . 2.44 109.435 177.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . 0.556 ' HB3' ' SD ' ' A' ' 42' ' ' MET . 0.1 OUTLIER -68.58 -30.84 69.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.432 -0.804 . . . . 1.24 110.758 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 9.6 ttm -56.78 -33.43 66.63 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.031 -0.532 . . . . 1.66 110.595 177.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -66.28 -41.35 89.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.847 -0.615 . . . . 3.72 110.539 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -76.51 -38.91 54.44 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.089 -0.505 . . . . 1.87 110.494 -178.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.7 -47.0 87.36 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.159 -0.473 . . . . 0.45 110.194 177.06 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -57.53 -47.1 82.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.852 -0.613 . . . . 1.23 109.823 175.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 89.1 m -59.95 -50.15 74.88 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.657 -0.701 . . . . 1.09 111.077 179.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.03 -41.69 68.33 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 122.594 0.357 . . . . 1.44 111.496 -178.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -70.31 -47.5 60.84 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.0 0.429 . . . . 0.29 110.043 -177.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 38.1 p -66.63 -30.52 70.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.883 -0.599 . . . . 1.33 111.144 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . 0.497 ' HB3' ' HH ' ' A' ' 73' ' ' TYR . 23.3 m-20 -54.9 -45.54 74.72 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-O 121.188 0.518 . . . . 2.36 110.127 178.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 18.6 t -61.76 -41.5 97.76 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.252 -0.885 . . . . 1.09 110.808 179.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -71.16 -22.96 61.98 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.168 -0.469 . . . . 1.17 111.531 -176.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 51.7 mt -93.15 -52.3 10.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.968 0.413 . . . . 1.18 111.609 -179.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -66.31 -35.31 80.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.685 -0.689 . . . . 1.6 111.474 -173.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -106.49 -174.41 2.53 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.119 -0.491 . . . . 1.37 110.73 -176.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . 0.439 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 0.0 OUTLIER -80.93 145.73 57.83 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 116.585 -0.28 . . . . 3.92 110.257 178.978 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -64.29 -9.08 18.55 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.671 2.248 . . . . 1.32 112.628 179.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.35 26.68 7.28 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.037 -0.528 . . . . 1.71 110.369 177.154 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . 0.439 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 0.4 OUTLIER -84.18 171.35 12.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.499 . . . . 1.34 111.197 -177.518 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -65.03 -53.05 51.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.745 -0.661 . . . . 1.44 110.607 -177.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 3.1 tp -63.97 -29.61 47.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.629 -0.714 . . . . 1.16 111.104 -178.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 2.0 t -70.35 -43.62 78.19 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-O 121.085 0.469 . . . . 1.1 110.02 177.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.32 -37.29 74.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.508 -0.769 . . . . 1.22 109.55 177.315 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' MET . . . . . 0.445 ' O ' HD12 ' A' ' 129' ' ' LEU . 33.1 mtt -70.54 -45.68 65.05 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.179 -0.919 . . . . 1.25 110.825 178.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.84 -34.91 63.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 1.1 111.973 -178.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.39 -47.06 85.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.69 -0.232 . . . . 2.08 111.054 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -70.81 -39.27 73.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.061 0.457 . . . . 1.04 110.606 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.445 HD12 ' O ' ' A' ' 125' ' ' MET . 4.7 mp -56.9 -41.37 77.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.431 -0.804 . . . . 1.16 110.491 177.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -59.82 -30.34 68.86 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.281 -0.872 . . . . 1.47 112.355 -178.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.532 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 9.3 mmtp -63.25 -49.1 75.45 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 120.629 0.252 . . . . 2.7 110.605 -171.26 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -72.49 -24.57 21.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.359 -0.382 . . . . 1.79 110.86 -179.53 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.514 ' O ' HG22 ' A' ' 137' ' ' VAL . 26.4 t80 -63.16 -62.58 1.6 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.247 -0.433 . . . . 0.52 110.564 178.165 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.59 -22.75 62.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.888 0.375 . . . . 1.26 110.689 -175.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.532 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -65.03 -51.16 63.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.849 -0.614 . . . . 2.07 110.447 179.798 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 40.8 mttt -80.8 -15.31 56.74 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.058 -0.519 . . . . 2.11 111.146 -175.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.514 HG22 ' O ' ' A' ' 133' ' ' PHE . 38.8 t -80.49 -35.22 15.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.227 -0.442 . . . . 1.09 110.083 177.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -69.51 -11.17 60.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.215 0.531 . . . . 1.21 110.793 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -97.48 -8.63 28.81 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.84 -0.618 . . . . 1.94 110.616 179.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -71.71 139.66 83.51 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 116.094 -0.503 . . . . 1.34 111.018 -177.465 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . 0.518 ' HG2' HD22 ' A' ' 37' ' ' ASN . 56.2 Cg_endo -72.0 98.43 0.9 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.653 2.235 . . . . 0.67 111.969 177.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . 0.421 ' HA ' ' NE2' ' A' ' 38' ' ' GLN . 0.3 OUTLIER -73.66 -8.45 56.04 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.014 0.435 . . . . 3.68 110.604 -179.996 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -66.81 -35.46 80.11 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.082 -0.71 . . . . 2.7 109.082 174.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.508 ' HG2' ' NE2' ' A' ' 38' ' ' GLN . 0.0 OUTLIER 74.72 143.17 0.07 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 114.037 -1.438 . . . . 2.34 112.651 174.31 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . 0.43 ' O ' ' HB3' ' A' ' 37' ' ' ASN . 2.9 t -140.62 104.16 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-N 114.321 -1.309 . . . . 1.66 108.86 176.025 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -72.29 141.32 48.88 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.877 -0.416 . . . . 1.53 109.877 178.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 34.8 mt . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.495 -0.764 . . . . 1.57 109.829 -178.543 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.452 -0.331 0 CA-C-O 121.257 0.551 . . . . 1.5 110.218 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.2 m -156.21 138.92 15.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.502 -0.772 . . . . 1.85 109.204 178.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.472 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 19.6 t-20 -144.5 138.01 14.27 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-O 120.696 0.284 . . . . 1.62 110.412 178.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -69.94 -48.25 0.72 Allowed 'Trans proline' 0 CA--C 1.531 0.366 0 C-N-CA 123.138 2.559 . . . . 2.05 113.287 177.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.515 ' O ' ' HD3' ' A' ' 32' ' ' PRO . 28.2 t -77.1 -33.07 57.01 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.952 0.406 . . . . 2.24 110.729 -175.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.472 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 0.6 OUTLIER -92.01 104.22 10.11 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.82 -0.627 . . . . 3.33 109.85 177.981 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.515 ' HD3' ' O ' ' A' ' 30' ' ' SER . 16.2 Cg_exo -68.64 154.13 72.05 Favored 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 122.69 2.26 . . . . 1.8 112.845 -177.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -131.27 121.85 3.29 Favored Glycine 0 N--CA 1.441 -0.973 0 N-CA-C 110.291 -1.124 . . . . 0.97 110.291 178.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.476 ' HG3' ' CE2' ' A' ' 96' ' ' TRP . 1.5 mmm180 -131.47 171.91 12.83 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.895 0.379 . . . . 2.37 110.576 -174.289 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.94 103.32 12.34 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.105 -0.498 . . . . 3.13 110.134 179.341 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.421 ' HA ' ' HA ' ' A' ' 146' ' ' GLU . 23.9 p -109.05 170.18 8.21 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.182 -0.463 . . . . 1.29 111.066 178.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.418 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 55.6 t30 -62.67 -49.78 73.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.964 -0.562 . . . . 1.47 110.8 -179.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.8 tt0 -61.6 -37.43 83.88 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 120.689 0.281 . . . . 1.04 110.781 -179.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.2 -59.2 5.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.932 -0.576 . . . . 1.39 110.884 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -67.37 -29.44 68.97 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 116.081 -0.509 . . . . 1.75 110.742 -178.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.418 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 44.7 t80 -60.63 -63.39 1.32 Allowed 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.796 -0.638 . . . . 1.2 110.872 177.06 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 23.6 ttp -61.04 -28.62 69.19 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.851 0.358 . . . . 1.76 110.358 -173.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 -61.41 -58.48 8.02 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.54 -0.755 . . . . 1.47 111.273 177.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -86.01 -26.59 25.33 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.364 -0.38 . . . . 0.53 111.777 -175.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 93.6 t -89.37 -57.84 3.94 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 N-CA-C 112.382 0.512 . . . . 1.11 112.382 -176.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 67.9 t -81.82 -66.59 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 112.016 0.376 . . . . 1.07 112.016 -170.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -66.43 -34.21 68.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 120.477 -0.489 . . . . 1.44 111.298 -174.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.447 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -59.53 -38.04 79.95 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 121.012 -0.275 . . . . 2.85 111.437 178.456 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.7 m -74.6 -35.83 62.97 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.865 -0.334 . . . . 1.23 110.711 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.26 -33.86 76.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.266 0.555 . . . . 1.11 109.574 176.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 18.2 t-105 -65.06 -31.18 72.27 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.472 -0.786 . . . . 0.44 110.877 177.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.447 ' HG3' ' O ' ' A' ' 48' ' ' LYS . 13.6 mtpp -83.65 14.87 3.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.888 0.375 . . . . 2.75 111.646 -176.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.503 ' ND1' HD11 ' A' ' 129' ' ' LEU . 4.6 t-80 -98.82 128.43 45.03 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.095 -0.705 . . . . 0.47 109.095 173.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.413 ' NE2' ' HA ' ' A' ' 54' ' ' GLN . 0.0 OUTLIER -85.57 9.74 15.15 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.698 -0.401 . . . . 1.91 111.797 -173.991 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -103.35 -6.95 21.43 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.26 -0.644 . . . . 1.24 109.26 170.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -94.64 14.99 19.29 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.43 -0.804 . . . . 1.09 110.11 177.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.569 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 48.9 p-90 -66.92 -34.54 7.57 Favored Pre-proline 0 CA--C 1.544 0.74 0 N-CA-C 113.467 0.914 . . . . 0.65 113.467 -175.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.569 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 7.6 Cg_exo -73.79 -2.67 12.55 Favored 'Trans proline' 0 C--N 1.364 1.357 0 CA-C-N 121.108 1.431 . . . . 0.61 111.512 177.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.421 ' HZ ' ' SG ' ' A' ' 112' ' ' CYS . 1.9 m-85 -105.64 0.16 26.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.824 -0.626 . . . . 1.52 110.462 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 6.2 m-30 -66.47 -40.47 89.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.331 0.586 . . . . 1.01 110.88 -178.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.64 129.48 28.76 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-N 115.467 -0.788 . . . . 2.11 110.179 -176.587 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.58 ' HA ' ' OD2' ' A' ' 82' ' ' ASP . 19.5 Cg_endo -59.95 147.12 94.03 Favored 'Trans proline' 0 C--O 1.238 0.512 0 C-N-CA 122.964 2.443 . . . . 1.1 113.475 -176.233 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.5 t -86.84 98.88 7.56 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 N-CA-C 108.408 -0.96 . . . . 1.46 108.408 177.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -109.78 12.12 24.14 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 114.812 -1.085 . . . . 1.85 110.896 -174.328 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 77.93 -17.55 0.56 Allowed 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 114.721 -1.127 . . . . 1.43 112.526 177.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.6 mt -109.29 -49.11 7.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 120.811 0.339 . . . . 2.38 110.762 -177.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.6 ttmm -56.96 -43.38 81.53 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.96 -0.563 . . . . 3.34 110.95 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -95.2 0.99 54.56 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.038 -0.528 . . . . 2.3 111.086 179.043 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 53.16 60.43 3.76 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 109.106 -0.701 . . . . 1.89 109.106 -174.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.6 66.07 73.52 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 115.497 -0.774 . . . . 2.18 111.662 -170.124 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -77.49 -27.79 6.03 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.186 1.924 . . . . 1.42 111.828 177.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -76.83 -23.99 52.74 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.591 -0.731 . . . . 1.97 110.448 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.46 -43.59 93.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.452 -0.795 . . . . 1.53 110.468 178.254 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -77.66 6.31 7.56 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.254 -0.885 . . . . 1.22 111.195 -175.323 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -108.93 -57.98 2.08 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 120.869 0.366 . . . . 3.34 110.046 -179.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 26.9 mt -73.45 -42.7 56.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.835 -0.62 . . . . 1.5 110.852 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.468 HG13 ' OD1' ' A' ' 111' ' ' ASN . 27.1 mm -87.54 126.39 41.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.188 0.518 . . . . 1.19 110.004 -178.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.05 -53.99 45.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.515 -0.766 . . . . 2.35 110.879 -176.67 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -120.48 95.3 49.02 Favored Pre-proline 0 C--N 1.324 -0.539 0 N-CA-C 109.75 -0.463 . . . . 2.05 109.75 178.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -67.87 100.25 0.6 Allowed 'Trans proline' 0 CA--C 1.528 0.206 0 C-N-CA 122.19 1.926 . . . . 1.24 111.775 178.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.81 159.64 34.22 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.449 0.642 . . . . 1.39 111.428 -176.234 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.58 ' OD2' ' HA ' ' A' ' 62' ' ' PRO . 2.3 p-10 -136.99 -116.21 0.16 Allowed 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.383 -1.281 . . . . 1.42 108.649 -177.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' MET . . . . . 0.408 ' HB2' ' HB3' ' A' ' 59' ' ' PHE . 3.5 ttp -132.71 -19.51 2.34 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.795 0.331 . . . . 1.14 110.645 176.045 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -84.1 -29.13 31.97 Favored Glycine 0 N--CA 1.442 -0.905 0 N-CA-C 110.556 -1.018 . . . . 0.33 110.556 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.19 -39.01 68.93 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.925 0.393 . . . . 1.6 110.492 176.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 62.1 mt -59.76 -50.41 80.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.559 -0.746 . . . . 1.63 110.304 177.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 91' ' ' GLU . 0.0 OUTLIER -70.6 -21.9 62.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.337 -0.392 . . . . 1.71 111.37 -178.6 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.518 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 12.5 tppt? -65.09 -42.6 93.93 Favored 'General case' 0 CA--C 1.526 0.043 0 CA-C-O 120.714 0.292 . . . . 2.93 110.765 179.683 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.459 HH21 ' HE2' ' A' ' 94' ' ' TYR . 63.4 mtp180 -68.26 -32.33 72.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.96 0.409 . . . . 1.49 110.456 176.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.71 ' HG ' ' HH ' ' A' ' 95' ' ' TYR . 4.7 mt -69.13 -59.72 2.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.543 -0.753 . . . . 1.14 111.662 -177.195 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.504 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 16.6 pt-20 -73.95 -15.98 61.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.044 -0.526 . . . . 1.39 111.819 -173.031 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . 0.518 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 0.9 OUTLIER -94.9 -3.39 48.79 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.997 -0.281 . . . . 1.66 110.363 176.962 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 52.3 57.43 6.46 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.653 -0.703 . . . . 1.75 111.186 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . 0.459 ' HE2' HH21 ' A' ' 89' ' ' ARG . 27.6 t80 -75.7 -48.91 19.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.322 -0.399 . . . . 1.3 110.888 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . 0.71 ' HH ' ' HG ' ' A' ' 90' ' ' LEU . 0.1 OUTLIER -97.92 177.65 5.37 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.211 0.529 . . . . 1.72 111.212 -175.212 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . 0.476 ' CE2' ' HG3' ' A' ' 34' ' ' ARG . 1.9 t-105 -77.92 -48.03 17.28 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.277 -0.874 . . . . 1.15 110.761 -179.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 17.3 t -142.42 168.47 19.66 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.862 0.363 . . . . 1.05 110.892 -173.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -78.23 -11.71 59.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.033 -0.53 . . . . 1.31 111.613 -175.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.98 -27.39 66.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.002 0.43 . . . . 1.12 110.581 178.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.98 -36.19 59.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.073 -0.512 . . . . 2.44 110.245 177.537 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.75 -19.81 62.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 1.24 110.897 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 11.3 mmt -55.95 -26.12 46.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.191 0.519 . . . . 1.66 110.144 173.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.16 -39.88 60.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.751 -0.659 . . . . 3.72 109.995 176.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.88 -53.98 51.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.817 -0.629 . . . . 1.87 110.345 178.548 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -57.26 -47.7 80.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.497 -0.774 . . . . 0.45 110.605 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -56.85 -44.01 81.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.787 -0.642 . . . . 1.23 110.256 177.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 90.5 m -64.3 -47.47 79.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.02 -0.537 . . . . 1.09 111.317 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.405 ' HG3' ' O ' ' A' ' 82' ' ' ASP . 0.3 OUTLIER -51.12 -44.4 61.34 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.734 0.302 . . . . 1.44 111.011 179.298 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -72.68 -47.55 46.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.02 -0.536 . . . . 0.29 110.953 -177.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.4 p -64.75 -37.5 87.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.46 -0.336 . . . . 1.33 110.91 -178.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . 0.468 ' OD1' HG13 ' A' ' 77' ' ' ILE . 0.4 OUTLIER -54.33 -45.43 72.67 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.803 -0.635 . . . . 2.36 110.32 178.1 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . 0.587 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 1.2 m -60.93 -40.58 93.78 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.948 -0.569 . . . . 1.09 110.813 176.328 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -74.6 -19.7 60.21 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.265 -0.425 . . . . 1.17 111.094 -176.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 68.0 mt -93.42 -61.41 2.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.49 -0.323 . . . . 1.18 111.557 -179.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -68.89 -49.62 56.68 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.062 0.458 . . . . 1.6 110.446 -175.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . 0.587 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 14.0 m120 -80.02 167.58 20.27 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.654 -0.703 . . . . 1.37 110.214 177.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . 0.485 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 6.4 mttp -98.0 160.73 27.7 Favored Pre-proline 0 C--N 1.318 -0.769 0 N-CA-C 109.739 -0.467 . . . . 3.92 109.739 177.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -61.51 -13.63 30.56 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.474 2.116 . . . . 1.32 111.762 175.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.82 -4.11 44.39 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.251 -0.886 . . . . 1.71 111.284 178.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . 0.485 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 1.9 m-20 -74.06 148.3 42.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.987 0.422 . . . . 1.34 110.471 -176.724 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.77 -43.56 98.6 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.612 -0.722 . . . . 1.44 111.105 -175.537 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . 0.445 HG21 ' N ' ' A' ' 123' ' ' VAL . 2.0 tp -66.4 -33.1 61.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.874 -0.603 . . . . 1.16 111.291 -178.359 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.445 ' N ' HG21 ' A' ' 122' ' ' ILE . 2.1 t -66.09 -42.06 90.69 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.109 0.48 . . . . 1.1 109.792 178.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.81 -32.14 70.37 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.549 -0.75 . . . . 1.22 110.05 178.242 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 11.2 mtt -79.24 -46.07 18.54 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.591 -0.731 . . . . 1.25 110.518 177.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -55.46 -41.69 73.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.361 -0.381 . . . . 1.1 111.711 -178.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.66 -31.79 73.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.801 0.334 . . . . 2.08 111.235 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -78.06 -38.88 43.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.094 0.473 . . . . 1.04 110.121 176.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.503 HD11 ' ND1' ' A' ' 53' ' ' HIS . 2.2 mp -59.47 -42.46 92.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.414 -0.812 . . . . 1.16 110.172 177.206 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -52.16 -29.36 21.79 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 114.953 -1.021 . . . . 1.47 112.867 -176.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.524 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.1 OUTLIER -60.64 -44.21 96.64 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 120.667 0.27 . . . . 2.7 110.757 -173.955 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -77.77 -23.61 14.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.159 -0.473 . . . . 1.79 111.105 -176.449 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.565 ' O ' HG23 ' A' ' 137' ' ' VAL . 34.1 t80 -65.92 -63.05 1.17 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.504 -0.316 . . . . 0.52 110.578 -179.597 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.97 -21.74 64.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.948 0.404 . . . . 1.26 110.657 -176.298 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.524 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -68.01 -45.47 73.94 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.697 -0.683 . . . . 2.07 110.185 178.089 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.25 -28.51 42.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.042 -0.526 . . . . 2.11 111.082 -179.216 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.565 HG23 ' O ' ' A' ' 133' ' ' PHE . 54.2 t -65.08 -34.47 70.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.135 0.493 . . . . 1.09 110.573 178.019 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.79 -12.61 61.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.308 0.575 . . . . 1.21 110.509 177.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -105.02 0.37 27.59 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.765 -0.652 . . . . 1.94 110.343 179.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' MET . . . . . 0.465 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 11.3 mtp -75.74 141.73 72.57 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.955 -0.566 . . . . 1.34 110.924 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -73.44 92.43 0.85 Allowed 'Trans proline' 0 N--CA 1.462 -0.355 0 C-N-CA 122.324 2.016 . . . . 0.67 110.964 177.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -74.24 -1.65 21.5 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.042 -0.526 . . . . 3.68 111.648 -173.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -82.1 -39.37 23.45 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.65 -0.5 . . . . 2.7 109.65 175.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 72.93 134.23 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 114.504 -1.226 . . . . 2.34 111.697 178.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 34.4 t -142.49 112.24 2.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.299 -0.864 . . . . 1.66 109.14 179.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.421 ' HA ' ' HA ' ' A' ' 36' ' ' THR . 31.1 tt0 -63.13 138.51 58.57 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.719 -0.392 . . . . 1.53 110.396 179.463 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 96.5 mt . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.528 -0.749 . . . . 1.57 110.618 -174.03 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.4 p . . . . . 0 N--CA 1.453 -0.303 0 CA-C-O 121.718 0.77 . . . . 1.5 109.235 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.4 m -162.97 135.38 5.4 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 114.979 -1.01 . . . . 1.85 109.375 175.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -126.94 125.86 24.3 Favored Pre-proline 0 C--N 1.321 -0.633 0 N-CA-C 109.742 -0.466 . . . . 1.62 109.742 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -66.06 -46.63 4.36 Favored 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 123.057 2.505 . . . . 2.05 113.017 -176.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.8 m -77.93 -22.02 50.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.987 0.422 . . . . 2.24 110.97 -176.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.6 ttmt -81.94 113.38 42.64 Favored Pre-proline 0 C--N 1.325 -0.484 0 N-CA-C 109.172 -0.677 . . . . 3.33 109.172 173.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.453 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 12.6 Cg_exo -65.34 147.17 87.28 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 121.778 1.652 . . . . 1.8 111.767 -179.234 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -127.81 130.27 6.66 Favored Glycine 0 N--CA 1.442 -0.913 0 CA-C-N 115.417 -0.811 . . . . 0.97 111.197 -176.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -140.3 -179.96 6.3 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 120.975 0.417 . . . . 2.37 110.167 -178.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.3 106.06 10.76 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.835 -0.62 . . . . 3.13 109.602 177.565 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.3 p -109.14 166.68 10.67 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 120.711 -0.396 . . . . 1.29 110.281 175.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.65 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 0.2 OUTLIER -66.83 -26.56 66.98 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.859 -0.609 . . . . 1.47 110.661 -178.211 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -75.38 -39.29 59.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.817 0.341 . . . . 1.04 110.3 177.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.52 -53.45 56.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.924 -0.58 . . . . 1.39 110.555 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.9 mm100 -70.85 -24.11 62.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.825 -0.625 . . . . 1.75 110.682 -178.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.65 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 35.7 t80 -61.14 -64.11 1.06 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 116.169 -0.468 . . . . 1.2 110.905 177.569 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 2.2 ttm -60.28 -31.71 70.5 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.813 -0.355 . . . . 1.76 110.506 -174.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -59.07 -57.27 13.81 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.734 -0.666 . . . . 1.47 110.997 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -86.28 -29.53 22.99 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.104 0.409 . . . . 0.53 112.104 -176.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 99.3 t -88.31 -57.82 3.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 112.161 0.43 . . . . 1.11 112.161 -175.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 60.2 t -82.14 -66.8 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 112.11 0.411 . . . . 1.07 112.11 -169.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 1.5 p -68.91 -32.9 56.49 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.326 0 C-N-CA 120.711 -0.395 . . . . 1.44 111.411 -174.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.11 -26.1 68.1 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 122.092 -0.38 . . . . 2.85 111.084 177.178 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 35.2 m -85.65 -38.1 18.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.77 0.319 . . . . 1.23 110.503 177.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.48 -39.94 89.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.039 0.447 . . . . 1.11 110.211 177.687 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 29.2 t-105 -60.37 -35.52 75.91 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.47 -0.787 . . . . 0.44 111.662 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.59 -4.1 52.83 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.064 0.394 . . . . 2.75 112.064 -174.036 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.573 ' ND1' ' HB2' ' A' ' 55' ' ' PHE . 10.0 t-80 -75.56 128.71 35.88 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.265 -0.643 . . . . 0.47 109.265 176.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -81.08 7.13 11.66 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.83 0.348 . . . . 1.91 111.46 -174.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.573 ' HB2' ' ND1' ' A' ' 53' ' ' HIS . 2.3 m-30 -103.36 -8.51 20.19 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.514 -0.55 . . . . 1.24 109.514 172.361 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -91.18 9.98 28.93 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.786 -0.643 . . . . 1.09 110.641 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.499 ' CG ' ' HD3' ' A' ' 58' ' ' PRO . 57.8 p-90 -61.9 -35.38 21.22 Favored Pre-proline 0 CA--C 1.547 0.842 0 N-CA-C 113.916 1.08 . . . . 0.65 113.916 -175.21 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.499 ' HD3' ' CG ' ' A' ' 57' ' ' TRP . 3.0 Cg_exo -76.98 -10.78 18.08 Favored 'Trans proline' 0 C--N 1.364 1.358 0 CA-C-N 121.016 1.399 . . . . 0.61 111.733 178.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -101.6 10.84 39.84 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.702 -0.681 . . . . 1.52 110.431 -177.028 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 2.9 m-30 -73.23 -31.67 64.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.794 -0.639 . . . . 1.01 111.001 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -114.59 144.7 32.35 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 115.77 -0.65 . . . . 2.11 110.564 -173.634 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.572 ' HA ' ' OD1' ' A' ' 82' ' ' ASP . 33.3 Cg_endo -66.35 151.46 83.24 Favored 'Trans proline' 0 C--O 1.237 0.474 0 C-N-CA 122.885 2.39 . . . . 1.1 112.905 -178.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 1.4 t -70.42 101.79 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 CA-C-O 122.258 1.028 . . . . 1.46 109.253 173.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -96.16 6.1 49.57 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.336 -1.302 . . . . 1.85 108.993 176.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 69.4 -71.68 0.12 Allowed 'General case' 0 C--O 1.226 -0.137 0 CA-C-N 114.525 -1.216 . . . . 1.43 110.555 -175.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 5.7 mt -65.0 -39.68 86.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 116.372 -0.376 . . . . 2.38 111.09 -176.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.41 -24.25 65.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.034 -0.53 . . . . 3.34 111.766 -179.593 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -117.06 5.74 12.83 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.636 0.255 . . . . 2.3 111.513 -178.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 65.24 35.37 7.76 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.826 -0.624 . . . . 1.89 111.576 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 2.6 mt -120.19 74.03 21.01 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 115.86 -0.609 . . . . 2.18 110.303 177.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.19 -29.85 25.88 Favored 'Trans proline' 0 C--O 1.233 0.25 0 C-N-CA 122.413 2.075 . . . . 1.42 113.216 -173.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -101.74 13.37 35.06 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.263 0.554 . . . . 1.97 111.057 -177.142 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -57.52 -41.25 80.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.68 -0.691 . . . . 1.53 110.442 177.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 18.7 m-70 -76.2 3.42 10.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.738 -0.665 . . . . 1.22 111.744 -176.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.0 mmpt? -97.28 -38.32 9.72 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.05 0.452 . . . . 3.34 109.972 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.9 mt -94.81 -47.7 13.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.962 -0.563 . . . . 1.5 110.037 177.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 41.9 mm -91.66 102.42 13.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.822 -0.626 . . . . 1.19 109.469 179.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.1 mtmt -72.35 -29.15 63.53 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.375 -0.83 . . . . 2.35 111.308 -174.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -116.22 80.17 9.36 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 115.719 -0.673 . . . . 2.05 110.315 178.109 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -69.16 97.69 0.6 Allowed 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.9 2.4 . . . . 1.24 111.865 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.6 mmt -133.36 155.02 50.21 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-O 121.363 0.601 . . . . 1.39 110.673 -177.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.572 ' OD1' ' HA ' ' A' ' 62' ' ' PRO . 5.0 p-10 -134.98 -129.85 0.16 Allowed 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 114.411 -1.268 . . . . 1.42 109.078 -172.029 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.25 -14.54 4.82 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.299 0.571 . . . . 1.14 110.266 178.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -90.62 -32.03 9.71 Favored Glycine 0 N--CA 1.441 -1.021 0 N-CA-C 109.921 -1.271 . . . . 0.33 109.921 -178.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.45 ' OG1' ' HB3' ' A' ' 62' ' ' PRO . 98.0 m -67.79 -37.32 81.88 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.004 -0.598 . . . . 1.6 110.5 173.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.454 HD13 ' O ' ' A' ' 82' ' ' ASP . 54.9 mt -63.22 -50.87 77.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.984 -0.553 . . . . 1.63 109.976 176.137 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.531 ' O ' ' HG2' ' A' ' 91' ' ' GLU . 0.0 OUTLIER -65.47 -29.9 70.62 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.691 -0.686 . . . . 1.71 110.9 -179.737 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 30.6 tttt -66.79 -37.82 85.31 Favored 'General case' 0 C--N 1.337 0.053 0 CA-C-O 120.986 0.422 . . . . 2.93 110.687 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 29.5 mtp180 -74.56 -29.97 61.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.072 -0.513 . . . . 1.49 110.594 178.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.555 ' HG ' ' OH ' ' A' ' 95' ' ' TYR . 2.8 mt -70.09 -57.54 4.85 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.791 -0.64 . . . . 1.14 111.084 179.031 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.531 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 9.0 pt-20 -72.25 -7.23 48.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.888 -0.596 . . . . 1.39 112.081 -173.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -106.58 -4.22 19.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.412 0.148 . . . . 1.66 111.168 178.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 57.69 63.8 1.72 Allowed 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.337 0.589 . . . . 1.75 110.854 -177.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -78.23 -26.4 47.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.603 -0.726 . . . . 1.3 111.404 -179.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . 0.555 ' OH ' ' HG ' ' A' ' 90' ' ' LEU . 0.1 OUTLIER -135.62 179.19 6.49 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.056 -0.52 . . . . 1.72 111.202 -172.21 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . 0.453 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 1.8 t-105 -66.55 -47.5 72.65 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.451 -0.795 . . . . 1.15 110.742 178.272 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 26.9 t -150.35 167.06 28.15 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.996 -0.547 . . . . 1.05 110.888 -174.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -76.1 -4.69 42.89 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.762 -0.653 . . . . 1.31 111.682 -175.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.36 -32.08 70.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.05 0.452 . . . . 1.12 110.476 178.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -66.42 -43.25 86.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.755 -0.657 . . . . 2.44 110.011 177.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . 0.443 ' HA ' ' OD1' ' A' ' 104' ' ' ASP . 0.0 OUTLIER -75.73 -20.28 58.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.925 -0.579 . . . . 1.24 111.381 -177.226 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -55.55 -29.17 58.5 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.199 0.523 . . . . 1.66 109.989 174.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -73.55 -41.18 63.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.679 -0.691 . . . . 3.72 110.281 175.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . 0.443 ' OD1' ' HA ' ' A' ' 101' ' ' CYS . 8.9 m-20 -68.04 -38.9 83.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.029 -0.532 . . . . 1.87 110.453 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.21 -46.88 87.28 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.871 -0.604 . . . . 0.45 110.466 177.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -62.55 -42.69 99.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.884 -0.598 . . . . 1.23 109.977 177.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 94.7 m -63.27 -40.21 96.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.487 -0.779 . . . . 1.09 111.687 -179.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.75 -42.68 62.51 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.057 0.456 . . . . 1.44 110.902 177.026 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -71.1 -40.33 71.57 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.93 -0.577 . . . . 0.29 110.988 -178.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -41.56 75.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.604 -0.271 . . . . 1.33 111.115 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -48.16 -53.26 17.42 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.619 -0.718 . . . . 2.36 111.062 178.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . 0.486 ' SG ' HG23 ' A' ' 123' ' ' VAL . 0.1 OUTLIER -63.62 -34.41 77.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.695 -0.684 . . . . 1.09 111.011 -179.636 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . 0.574 ' HH ' HE21 ' A' ' 127' ' ' GLN . 18.5 m-30 -77.22 -17.77 58.21 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.457 -0.338 . . . . 1.17 111.663 -177.374 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 67.5 mt -92.72 -53.63 8.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 120.668 0.27 . . . . 1.18 111.305 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -68.59 -37.75 80.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.322 -0.399 . . . . 1.6 110.53 -176.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -108.7 140.94 41.4 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.082 -0.508 . . . . 1.37 109.654 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.33 146.18 97.77 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 116.434 -0.348 . . . . 3.92 110.507 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -58.93 -12.12 14.25 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.215 2.61 . . . . 1.32 113.511 -177.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.93 -7.59 59.39 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.432 -0.349 . . . . 1.71 111.655 178.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -81.88 171.03 14.96 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.506 0.669 . . . . 1.34 112.043 -174.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -76.5 -41.58 46.44 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.497 -1.229 . . . . 1.44 110.791 -174.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . 0.632 ' HA ' ' SD ' ' A' ' 125' ' ' MET . 2.6 tp -62.15 -35.55 69.47 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.11 0 CA-C-O 120.974 0.416 . . . . 1.16 110.043 179.313 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.486 HG23 ' SG ' ' A' ' 112' ' ' CYS . 12.5 t -69.74 -49.32 58.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.118 -0.492 . . . . 1.1 110.04 177.201 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.9 -40.09 72.52 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.305 -0.862 . . . . 1.22 110.892 -177.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' MET . . . . . 0.632 ' SD ' ' HA ' ' A' ' 122' ' ' ILE . 0.1 OUTLIER -75.58 -38.7 58.93 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.163 -0.472 . . . . 1.25 111.21 179.742 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . 0.424 ' HB1' ' O ' ' A' ' 122' ' ' ILE . . . -60.15 -28.82 68.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.394 -0.366 . . . . 1.1 111.099 177.305 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . 0.574 HE21 ' HH ' ' A' ' 113' ' ' TYR . 0.0 OUTLIER -62.88 -38.52 91.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.26 -0.427 . . . . 2.08 110.815 177.717 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -73.59 -37.63 65.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.094 -0.503 . . . . 1.04 110.151 177.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.526 HD11 ' O ' ' A' ' 125' ' ' MET . 7.1 mp -58.25 -44.75 88.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.532 -0.758 . . . . 1.16 110.213 177.011 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -59.54 -30.56 68.7 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.081 -0.963 . . . . 1.47 111.842 -176.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.485 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -65.38 -46.58 79.54 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.576 -0.284 . . . . 2.7 110.467 -175.023 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.0 -21.73 18.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.537 -0.301 . . . . 1.79 110.746 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.538 ' O ' HG22 ' A' ' 137' ' ' VAL . 30.0 t80 -65.12 -62.23 1.67 Allowed 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.334 -0.394 . . . . 0.52 110.299 177.037 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.5 pp -66.59 -26.96 67.35 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.035 0.445 . . . . 1.26 110.341 -177.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.485 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -57.93 -48.22 80.55 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.446 -0.797 . . . . 2.07 111.046 178.708 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.81 -24.41 33.38 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.14 -0.482 . . . . 2.11 110.948 -177.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.538 HG22 ' O ' ' A' ' 133' ' ' PHE . 59.2 t -70.97 -32.04 47.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.086 0.47 . . . . 1.09 110.362 178.273 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -69.53 -10.49 58.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.064 0.459 . . . . 1.21 110.471 177.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -103.34 -3.55 25.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.946 -0.57 . . . . 1.94 110.926 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' MET . . . . . 0.458 ' HG3' ' HA ' ' A' ' 137' ' ' VAL . 0.7 OUTLIER -67.91 143.9 96.76 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.094 -0.503 . . . . 1.34 111.337 -177.883 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -70.77 110.79 2.85 Favored 'Trans proline' 0 N--CA 1.462 -0.356 0 C-N-CA 122.52 2.147 . . . . 0.67 111.675 177.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.05 5.79 7.51 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.913 -0.585 . . . . 3.68 111.917 -175.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . 0.403 ' O ' ' HB3' ' A' ' 144' ' ' GLU . 18.3 mt-10 -103.17 -41.18 6.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.436 -0.347 . . . . 2.7 111.244 -177.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.403 ' HB3' ' O ' ' A' ' 143' ' ' GLU . 2.7 tt0 70.95 101.57 0.06 Allowed 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.991 0.807 . . . . 2.34 110.866 -177.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 2.6 t -108.52 133.96 51.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.135 -0.691 . . . . 1.66 109.135 176.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -80.63 148.18 30.37 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.004 0.43 . . . . 1.53 111.13 -176.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 22.0 mt . . . . . 0 C--O 1.247 0.955 0 CA-C-O 118.896 -0.573 . . . . 1.57 110.142 178.134 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.448 -0.535 0 CA-C-O 121.348 0.594 . . . . 1.5 109.847 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -158.95 137.08 10.55 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.123 -0.944 . . . . 1.85 110.001 176.26 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.437 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 23.8 t-20 -136.8 122.92 13.47 Favored Pre-proline 0 C--N 1.32 -0.69 0 N-CA-C 109.357 -0.608 . . . . 1.62 109.357 173.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -60.4 -46.31 18.5 Favored 'Trans proline' 0 N--CA 1.474 0.338 0 C-N-CA 123.249 2.633 . . . . 2.05 113.008 -175.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.3 m -78.97 -30.04 44.25 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 116.037 -0.529 . . . . 2.24 110.957 -175.201 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.437 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 24.4 tttp -67.41 134.03 93.04 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.564 -0.744 . . . . 3.33 111.419 -177.378 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_exo -49.18 141.11 24.2 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 123.182 2.588 . . . . 1.8 112.993 173.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -158.91 117.07 0.75 Allowed Glycine 0 N--CA 1.443 -0.84 0 N-CA-C 110.218 -1.153 . . . . 0.97 110.218 177.282 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.409 ' HE ' ' CD ' ' A' ' 146' ' ' GLU . 7.2 mmm180 -131.55 158.82 39.94 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.013 0.435 . . . . 2.37 110.935 -175.377 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.5 mtpp -103.6 84.52 2.3 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.981 -0.554 . . . . 3.13 109.598 176.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.6 p -87.17 168.56 13.13 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.244 -0.434 . . . . 1.29 110.515 -179.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -59.12 -50.98 71.97 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-N 116.489 -0.323 . . . . 1.47 110.749 -178.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.504 ' HB2' ' OE2' ' A' ' 144' ' ' GLU . 1.7 mt-30 -59.21 -39.83 83.92 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.711 0.291 . . . . 1.04 111.222 -179.006 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -61.66 -55.17 33.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.109 -0.496 . . . . 1.39 110.72 -179.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 18.2 mm100 -68.53 -30.47 69.29 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.872 -0.603 . . . . 1.75 110.862 -179.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -61.6 -63.36 1.3 Allowed 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.825 -0.625 . . . . 1.2 110.488 176.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.478 ' SD ' ' HB3' ' A' ' 101' ' ' CYS . 0.1 OUTLIER -58.44 -33.62 69.9 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 110.175 -0.306 . . . . 1.76 110.175 -175.418 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -56.98 -56.62 19.34 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.569 -0.741 . . . . 1.47 111.121 178.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 61.3 m-80 -86.66 -28.16 23.34 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.285 -0.416 . . . . 0.53 112.039 -176.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 94.5 t -89.61 -56.89 4.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 N-CA-C 112.243 0.46 . . . . 1.11 112.243 -176.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 59.9 t -79.41 -65.82 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 121.012 -0.275 . . . . 1.07 111.521 -172.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.467 HG13 ' O ' ' A' ' 42' ' ' MET . 1.9 m -63.49 -33.58 62.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 N-CA-C 111.75 0.278 . . . . 1.44 111.75 -174.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.05 -39.35 86.92 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 121.102 -0.239 . . . . 2.85 111.53 -178.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 5.9 m -75.1 -33.26 61.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.728 0.299 . . . . 1.23 110.642 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.03 -41.06 87.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.324 0.583 . . . . 1.11 109.595 174.128 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 6.9 t-105 -63.03 -35.79 81.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.607 -0.724 . . . . 0.44 111.253 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.3 mmpt? -87.62 22.75 2.15 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.25 0.463 . . . . 2.75 112.25 -175.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.533 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 12.9 t-80 -96.24 139.99 31.59 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.42 -0.354 . . . . 0.47 110.07 175.232 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 40.6 mm-40 -81.44 7.03 12.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.777 0.323 . . . . 1.91 111.852 -176.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.533 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.7 OUTLIER -115.2 -7.29 12.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.022 0.439 . . . . 1.24 110.165 175.673 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -99.0 11.05 40.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.059 0.457 . . . . 1.09 110.939 -177.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.584 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 32.4 p-90 -63.24 -33.84 11.75 Favored Pre-proline 0 CA--C 1.547 0.855 0 N-CA-C 113.88 1.067 . . . . 0.65 113.88 -175.114 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.584 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 5.9 Cg_exo -78.97 -0.61 10.9 Favored 'Trans proline' 0 C--N 1.359 1.124 0 CA-C-N 121.2 1.464 . . . . 0.61 112.289 176.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -97.99 -2.01 41.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.121 -0.491 . . . . 1.52 110.614 -175.566 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.552 ' CZ ' ' HA ' ' A' ' 57' ' ' TRP . 13.1 m-30 -74.55 -11.7 60.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.02 -0.536 . . . . 1.01 110.603 179.24 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -106.96 119.71 50.42 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 115.902 -0.59 . . . . 2.11 111.23 -170.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.588 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 21.5 Cg_exo -63.44 145.45 92.36 Favored 'Trans proline' 0 C--O 1.237 0.438 0 C-N-CA 122.933 2.422 . . . . 1.1 113.103 -178.621 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 22.3 t -91.01 90.1 3.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 122.119 0.961 . . . . 1.46 108.847 177.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.442 ' O ' ' HB1' ' A' ' 65' ' ' ALA . 0.6 OUTLIER -108.14 5.12 25.61 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.783 -1.099 . . . . 1.85 110.677 -176.774 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.454 ' HB2' ' NE2' ' A' ' 74' ' ' HIS . . . 79.28 -29.73 0.14 Allowed 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.003 -0.999 . . . . 1.43 112.58 177.385 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -98.76 -49.54 11.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 120.855 0.359 . . . . 2.38 111.901 -174.423 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.01 -22.45 49.28 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.136 -0.484 . . . . 3.34 111.632 -173.109 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.2 tp -112.87 3.59 16.44 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.864 0.364 . . . . 2.3 110.767 177.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . 0.549 ' O ' HD12 ' A' ' 70' ' ' LEU . 15.4 t-20 53.68 69.41 0.71 Allowed 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.461 -0.791 . . . . 1.89 110.88 -178.378 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.549 HD12 ' O ' ' A' ' 69' ' ' ASN . 0.0 OUTLIER -133.31 64.18 68.46 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.584 -0.735 . . . . 2.18 110.596 178.218 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -78.54 -38.8 0.47 Allowed 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.417 2.078 . . . . 1.42 112.548 -178.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -77.97 -15.95 58.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.512 0.672 . . . . 1.97 109.896 -178.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.492 ' HA ' ' CE1' ' A' ' 115' ' ' TYR . 13.2 t80 -53.43 -41.6 66.23 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.845 -1.07 . . . . 1.53 111.007 177.102 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . 0.454 ' NE2' ' HB2' ' A' ' 65' ' ' ALA . 1.8 m-70 -80.35 3.84 19.85 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.585 -0.734 . . . . 1.22 111.724 -173.053 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.9 mttp -88.14 -21.98 24.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.396 0.617 . . . . 3.34 109.589 178.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.8 mp -117.63 -46.42 3.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.143 -0.935 . . . . 1.5 110.339 -179.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.5 mm -86.84 111.56 21.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.009 -0.541 . . . . 1.19 110.476 -179.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.91 -29.5 58.43 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.072 -0.513 . . . . 2.35 110.87 -179.5 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 57.1 m-20 -119.84 81.95 27.06 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 116.031 -0.531 . . . . 2.05 109.962 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -76.06 98.85 1.23 Allowed 'Trans proline' 0 N--CA 1.464 -0.235 0 C-N-CA 123.265 2.644 . . . . 1.24 112.091 -177.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -132.81 174.97 9.75 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.51 0.671 . . . . 1.39 111.087 -176.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.588 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 3.1 p-10 -152.38 -126.99 0.04 OUTLIER 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.555 -1.202 . . . . 1.42 109.135 -173.255 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -126.24 -14.28 5.98 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.185 0.517 . . . . 1.14 110.188 -179.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.457 ' O ' ' HG3' ' A' ' 88' ' ' LYS . . . -92.7 -33.19 7.59 Favored Glycine 0 N--CA 1.438 -1.191 0 N-CA-C 110.157 -1.177 . . . . 0.33 110.157 -179.066 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -65.56 -41.0 93.43 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.107 0.48 . . . . 1.6 110.435 176.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.428 HG12 ' HB3' ' A' ' 104' ' ' ASP . 79.0 mt -61.79 -47.95 90.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.365 -0.834 . . . . 1.63 109.935 175.074 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -32.28 73.39 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.692 -0.686 . . . . 1.71 111.136 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.457 ' HG3' ' O ' ' A' ' 84' ' ' GLY . 33.4 mttm -59.9 -52.9 63.43 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 120.951 0.405 . . . . 2.93 110.515 178.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -70.47 -30.42 67.23 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.633 -0.712 . . . . 1.49 111.233 -177.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.2 mt -66.14 -56.69 10.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.022 0.439 . . . . 1.14 111.119 178.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -68.42 -28.78 67.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.853 -0.612 . . . . 1.39 111.167 -177.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -80.69 -10.92 59.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.524 -0.307 . . . . 1.66 110.873 179.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 60.34 61.87 1.69 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.674 -0.694 . . . . 1.75 110.189 -178.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -79.75 -52.73 7.56 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.79 -0.641 . . . . 1.3 111.434 -178.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -97.03 -178.71 4.29 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.071 0.462 . . . . 1.72 110.955 -175.32 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 -72.59 -54.08 10.12 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.589 -0.732 . . . . 1.15 111.216 -179.255 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 26.4 t -145.32 -178.82 6.26 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.054 0.454 . . . . 1.05 111.495 -172.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -76.81 -7.07 54.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.997 -0.547 . . . . 1.31 111.132 -177.028 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -34.86 73.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.323 0.583 . . . . 1.12 109.82 175.183 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.09 -30.79 62.52 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.418 -0.81 . . . . 2.44 110.14 177.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . 0.478 ' HB3' ' SD ' ' A' ' 42' ' ' MET . 0.1 OUTLIER -74.36 -28.56 61.18 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.485 -0.779 . . . . 1.24 111.242 -179.258 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.77 -36.07 73.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.148 0.499 . . . . 1.66 110.326 177.616 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -70.05 -40.24 75.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.572 -0.74 . . . . 3.72 110.417 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . 0.428 ' HB3' HG12 ' A' ' 86' ' ' ILE . 0.3 OUTLIER -70.06 -49.65 49.01 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.015 -0.539 . . . . 1.87 111.05 -176.55 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.66 -45.26 77.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.073 -0.512 . . . . 0.45 110.948 -179.496 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -60.56 -45.33 94.29 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.142 -0.481 . . . . 1.23 110.294 177.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 66.4 m -64.4 -37.15 86.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.79 -0.641 . . . . 1.09 111.462 -178.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -34.73 71.08 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.214 -0.448 . . . . 1.44 110.69 177.176 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -79.21 -36.93 39.36 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.37 -0.377 . . . . 0.29 110.515 -178.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.0 -37.23 86.96 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.764 0.316 . . . . 1.33 110.611 175.566 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -43.63 -55.06 4.56 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.271 -0.877 . . . . 2.36 110.925 177.58 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . 0.516 ' SG ' HG23 ' A' ' 123' ' ' VAL . 2.1 t -58.76 -47.73 83.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.196 -0.911 . . . . 1.09 111.906 -179.509 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 47.7 m-85 -74.85 -15.92 60.7 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.719 0.637 . . . . 1.17 112.719 -170.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 85.5 mt -91.77 -54.33 7.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.759 0.314 . . . . 1.18 111.271 -179.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . 0.492 ' CE1' ' HA ' ' A' ' 73' ' ' TYR . 41.7 t80 -78.24 -40.35 37.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.78 0.324 . . . . 1.6 111.194 -175.31 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 72.6 m-20 -86.12 -168.57 2.28 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.376 -0.375 . . . . 1.37 110.481 -177.252 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.26 154.07 43.78 Favored Pre-proline 0 C--N 1.32 -0.693 0 N-CA-C 110.526 -0.176 . . . . 3.92 110.526 -177.466 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -58.61 -25.97 77.08 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.409 2.072 . . . . 1.32 112.276 177.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.79 16.37 25.28 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.124 -0.489 . . . . 1.71 111.325 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -76.52 159.72 30.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.47 . . . . 1.34 110.976 -177.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -69.56 -47.88 62.17 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.362 -0.836 . . . . 1.44 110.02 -178.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . 0.442 HG23 ' SG ' ' A' ' 112' ' ' CYS . 2.2 tp -68.28 -30.4 47.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.384 -0.825 . . . . 1.16 110.666 -177.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.516 HG23 ' SG ' ' A' ' 112' ' ' CYS . 1.4 t -71.75 -41.36 70.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.225 -0.443 . . . . 1.1 110.163 177.532 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.07 -32.24 71.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.955 -0.566 . . . . 1.22 110.045 179.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 25.8 mtt -75.39 -39.16 59.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.539 -0.755 . . . . 1.25 110.546 177.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.35 -28.0 66.44 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.201 -0.454 . . . . 1.1 111.837 -178.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.68 -44.79 89.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.849 0.357 . . . . 2.08 111.213 179.286 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -76.72 -36.87 56.88 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.127 0.489 . . . . 1.04 110.433 179.166 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.39 -43.51 92.92 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.357 -0.838 . . . . 1.16 111.047 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -65.93 -24.42 66.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.903 -0.589 . . . . 1.47 111.687 -175.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.518 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 19.1 ttmt -64.89 -41.62 95.46 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.768 -0.456 . . . . 2.7 109.768 -178.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . 0.447 ' H ' HG13 ' A' ' 132' ' ' ILE . 3.3 mt -69.39 -34.78 64.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.918 -0.583 . . . . 1.79 110.316 178.01 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.513 ' O ' HG21 ' A' ' 137' ' ' VAL . 29.9 t80 -58.35 -61.75 2.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.652 -0.703 . . . . 0.52 110.662 179.273 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 2.0 pp -63.94 -30.02 71.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.923 0.392 . . . . 1.26 110.406 -177.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.518 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.56 -50.73 72.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.549 -0.75 . . . . 2.07 111.13 178.894 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.53 -23.29 50.18 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.77 -0.65 . . . . 2.11 111.055 -176.611 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.513 HG21 ' O ' ' A' ' 133' ' ' PHE . 46.4 t -78.15 -33.74 18.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.011 -0.54 . . . . 1.09 110.56 -179.476 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.03 -13.35 61.83 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.116 0.484 . . . . 1.21 110.616 179.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -106.71 4.2 27.51 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.681 -0.691 . . . . 1.94 110.869 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' MET . . . . . 0.415 ' HG3' ' HA ' ' A' ' 137' ' ' VAL . 0.7 OUTLIER -66.36 143.03 98.09 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.296 -0.411 . . . . 1.34 110.505 176.908 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -63.82 114.13 2.45 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.27 1.98 . . . . 0.67 111.272 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 13.6 mm-40 -79.37 26.29 0.29 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.184 -0.462 . . . . 3.68 111.622 -173.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.06 -40.16 3.0 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 115.936 -0.574 . . . . 2.7 110.763 -178.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.504 ' OE2' ' HB2' ' A' ' 38' ' ' GLN . 0.0 OUTLIER 63.28 93.8 0.05 Allowed 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.063 -0.972 . . . . 2.34 110.313 -174.696 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 1.5 t -112.89 116.83 53.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 115.522 -0.763 . . . . 1.66 109.961 -178.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.409 ' CD ' ' HE ' ' A' ' 34' ' ' ARG . 7.5 tt0 -64.8 133.14 51.37 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.693 0.283 . . . . 1.53 110.392 178.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 14.9 mt . . . . . 0 C--O 1.246 0.897 0 CA-C-O 118.697 -0.668 . . . . 1.57 110.372 -177.808 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.2 p . . . . . 0 N--CA 1.451 -0.418 0 CA-C-O 122.058 0.932 . . . . 1.5 108.57 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.2 m -149.17 141.35 23.99 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 114.159 -1.382 . . . . 1.85 108.192 176.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -145.11 136.67 12.77 Favored Pre-proline 0 C--N 1.315 -0.929 0 C-N-CA 121.112 -0.235 . . . . 1.62 110.579 -177.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -65.76 -48.13 3.27 Favored 'Trans proline' 0 N--CA 1.473 0.278 0 C-N-CA 123.061 2.507 . . . . 2.05 112.955 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.458 ' O ' ' HD3' ' A' ' 32' ' ' PRO . 5.4 m -75.74 -19.31 59.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.082 -0.508 . . . . 2.24 110.872 -176.175 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.452 ' HE3' ' CZ ' ' A' ' 94' ' ' TYR . 0.0 OUTLIER -102.33 100.63 16.14 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.55 -0.75 . . . . 3.33 110.598 178.409 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.465 ' HB2' ' CZ3' ' A' ' 96' ' ' TRP . 15.2 Cg_exo -66.63 152.57 80.41 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.096 1.864 . . . . 1.8 111.564 178.675 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -136.02 88.78 0.23 Allowed Glycine 0 N--CA 1.444 -0.778 0 N-CA-C 111.662 -0.575 . . . . 0.97 111.662 -177.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.464 ' HG3' ' CZ2' ' A' ' 96' ' ' TRP . 7.3 mtm180 -91.87 148.81 21.94 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.723 -0.473 . . . . 2.37 109.723 178.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.0 120.62 32.14 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.395 -0.366 . . . . 3.13 110.103 -178.157 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -111.36 160.58 16.92 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.827 -0.349 . . . . 1.29 110.722 177.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.464 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 8.1 t30 -60.69 -37.84 82.99 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-N 115.879 -0.6 . . . . 1.47 110.113 178.292 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.402 ' O ' ' HB3' ' A' ' 41' ' ' TYR . 23.4 tt0 -64.18 -42.37 96.71 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.303 -0.408 . . . . 1.04 110.433 178.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.32 -52.01 63.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.216 -0.447 . . . . 1.39 110.549 179.027 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.413 ' O ' ' HG3' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -67.5 -22.98 65.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.288 0.566 . . . . 1.75 110.789 -179.541 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.464 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 62.3 t80 -64.45 -59.73 3.99 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 115.523 -0.762 . . . . 1.2 110.769 176.624 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.99 -34.39 71.79 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.573 -0.285 . . . . 1.76 111.749 -172.587 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.566 ' HA ' ' CG1' ' A' ' 47' ' ' VAL . 0.0 OUTLIER -65.68 -45.21 83.72 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.426 -0.509 . . . . 1.47 110.851 -177.521 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 -85.68 -34.24 21.34 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.085 -0.507 . . . . 0.53 111.795 -177.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 85.6 t -88.73 -57.81 3.96 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 112.332 0.493 . . . . 1.11 112.332 -175.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 42.4 t -79.63 -66.63 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 111.855 0.317 . . . . 1.07 111.855 -170.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.566 ' CG1' ' HA ' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -68.94 -35.97 71.75 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.314 0 C-N-CA 120.677 -0.409 . . . . 1.44 111.624 -173.728 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.46 -38.64 87.95 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.678 -0.409 . . . . 2.85 111.376 179.066 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.2 m -73.64 -36.37 65.39 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 121.083 -0.247 . . . . 1.23 110.824 178.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.24 -39.63 89.65 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 109.588 -0.523 . . . . 1.11 109.588 174.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 11.6 t-105 -58.04 -36.38 72.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.641 -0.709 . . . . 0.44 110.98 177.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -84.78 10.59 11.04 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.198 0.444 . . . . 2.75 112.198 -175.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.442 ' CD2' HD11 ' A' ' 132' ' ' ILE . 19.1 t-80 -83.12 139.06 33.42 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.842 0.353 . . . . 0.47 110.465 177.15 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.9 mm-40 -72.26 1.79 7.11 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.005 -0.543 . . . . 1.91 112.308 -175.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -118.83 -7.84 10.4 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.771 0.32 . . . . 1.24 110.918 178.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -92.6 6.43 47.34 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.955 0.407 . . . . 1.09 111.217 -176.089 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.552 ' HA ' ' CZ ' ' A' ' 60' ' ' TYR . 40.4 p-90 -62.97 -35.14 16.38 Favored Pre-proline 0 CA--C 1.548 0.867 0 N-CA-C 114.099 1.148 . . . . 0.65 114.099 -174.397 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.517 ' HD3' ' CG ' ' A' ' 57' ' ' TRP . 15.3 Cg_exo -71.19 -17.9 30.93 Favored 'Trans proline' 0 C--N 1.357 0.987 0 CA-C-N 121.095 1.427 . . . . 0.61 112.435 177.478 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -85.36 -4.53 59.19 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.196 -0.456 . . . . 1.52 111.257 -175.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.552 ' CZ ' ' HA ' ' A' ' 57' ' ' TRP . 17.6 m-30 -60.54 -38.08 83.29 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.304 0.573 . . . . 1.01 110.883 -178.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -97.45 132.8 24.63 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-N 115.41 -0.814 . . . . 2.11 110.615 -177.049 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.73 145.09 25.42 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.334 2.023 . . . . 1.1 112.083 178.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 4.4 t -69.59 110.11 2.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-O 121.727 0.775 . . . . 1.46 110.794 177.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.496 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.5 OUTLIER -110.23 -0.74 17.67 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.897 -1.047 . . . . 1.85 109.559 179.474 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.496 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 74.69 -64.19 0.39 Allowed 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 114.627 -1.169 . . . . 1.43 111.055 -175.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 12.9 mt -68.56 -48.84 70.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.788 0.328 . . . . 2.38 111.115 -176.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 38.2 tttp -50.46 -51.92 42.67 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.73 -0.668 . . . . 3.34 112.331 -177.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.1 7.24 33.76 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.496 -0.32 . . . . 2.3 111.573 -171.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . 0.481 ' O ' HD13 ' A' ' 70' ' ' LEU . 17.7 t-20 59.11 67.28 0.93 Allowed 'General case' 0 N--CA 1.467 0.418 0 O-C-N 123.731 0.644 . . . . 1.89 111.207 -178.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.481 HD13 ' O ' ' A' ' 69' ' ' ASN . 0.1 OUTLIER -128.06 66.94 73.44 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.349 -0.841 . . . . 2.18 110.798 -179.699 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.96 -34.93 21.97 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 121.909 1.739 . . . . 1.42 111.972 -179.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -72.0 -30.8 65.6 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.98 -0.554 . . . . 1.97 110.678 -178.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.757 ' HH ' ' HB3' ' A' ' 111' ' ' ASN . 2.8 t80 -59.67 -45.9 90.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.65 -0.705 . . . . 1.53 110.577 -178.478 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -75.73 -7.8 55.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.128 -0.487 . . . . 1.22 110.977 -177.144 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt -95.72 -44.6 7.37 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 116.082 -0.508 . . . . 3.34 110.004 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.6 mt -82.78 -50.31 15.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.859 -0.609 . . . . 1.5 111.026 -178.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 43.7 mm -83.1 138.08 19.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.438 -0.346 . . . . 1.19 110.339 -177.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.62 -47.43 12.09 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.205 -0.452 . . . . 2.35 110.936 -179.721 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -115.22 96.43 45.44 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 116.476 -0.329 . . . . 2.05 110.822 -179.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -73.38 99.01 1.07 Allowed 'Trans proline' 0 CA--C 1.529 0.271 0 C-N-CA 122.381 2.054 . . . . 1.24 112.516 178.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.24 145.76 47.94 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 116.056 -0.52 . . . . 1.39 110.085 -178.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.465 ' O ' HD12 ' A' ' 86' ' ' ILE . 5.4 m-20 -145.35 -153.93 0.51 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 114.862 -1.063 . . . . 1.42 108.297 -172.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.53 -18.72 21.94 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.065 -0.717 . . . . 1.14 109.065 -172.55 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -80.37 -25.07 57.86 Favored Glycine 0 N--CA 1.44 -1.084 0 N-CA-C 109.539 -1.424 . . . . 0.33 109.539 175.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -84.47 -41.28 16.75 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 114.705 -0.747 . . . . 1.6 111.486 178.385 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.501 ' CD1' ' HB3' ' A' ' 104' ' ' ASP . 0.2 OUTLIER -56.41 -47.42 81.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 121.163 0.506 . . . . 1.63 109.727 178.398 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.6 ptmt -66.15 -27.54 68.1 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.765 -0.652 . . . . 1.71 111.506 -179.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.9 tttt -67.92 -43.02 80.15 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.935 0.398 . . . . 2.93 110.795 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.53 ' HD3' ' OD2' ' A' ' 104' ' ' ASP . 1.6 mtt180 -69.84 -32.0 70.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.309 -0.405 . . . . 1.49 110.558 178.578 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.419 ' HG ' ' SG ' ' A' ' 101' ' ' CYS . 7.7 mt -67.71 -54.41 19.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.656 -0.702 . . . . 1.14 111.22 178.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 25.0 pt-20 -64.92 -26.74 68.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.119 -0.491 . . . . 1.39 111.313 -175.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -95.29 10.67 35.31 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.081 -0.509 . . . . 1.66 111.276 -178.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.3 p30 37.25 54.9 1.33 Allowed 'General case' 0 N--CA 1.475 0.825 0 O-C-N 124.169 0.918 . . . . 1.75 111.711 -177.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . 0.452 ' CZ ' ' HE3' ' A' ' 31' ' ' LYS . 29.8 t80 -66.06 -73.5 0.13 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.057 -0.974 . . . . 1.3 112.06 -175.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -94.87 39.44 1.1 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.518 -0.765 . . . . 1.72 112.582 -172.651 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . 0.465 ' CZ3' ' HB2' ' A' ' 32' ' ' PRO . 1.2 t-105 71.25 -66.07 0.31 Allowed 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.24 0.83 . . . . 1.15 113.24 169.012 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -125.15 161.26 27.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.114 0.483 . . . . 1.05 111.912 -168.143 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.4 -12.71 60.91 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.973 -0.558 . . . . 1.31 111.071 -179.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 20.0 m -64.05 -26.32 68.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.293 0.568 . . . . 1.12 109.791 175.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -82.47 -26.68 32.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.522 -0.763 . . . . 2.44 110.35 176.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . 0.419 ' SG ' ' HG ' ' A' ' 90' ' ' LEU . 0.5 OUTLIER -74.64 -23.08 58.63 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.539 -0.755 . . . . 1.24 110.62 179.475 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 6.5 ttm -60.94 -31.65 71.19 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.053 -0.521 . . . . 1.66 110.134 176.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.4 -38.16 68.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.696 -0.683 . . . . 3.72 110.252 178.18 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . 0.53 ' OD2' ' HD3' ' A' ' 89' ' ' ARG . 1.5 m-20 -67.3 -50.41 60.37 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.994 -0.548 . . . . 1.87 110.502 -178.405 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.75 -43.92 77.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.692 -0.685 . . . . 0.45 110.272 177.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -60.41 -49.87 75.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.615 -0.72 . . . . 1.23 110.361 178.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 71.3 m -55.37 -51.14 67.76 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 123.584 0.552 . . . . 1.09 111.259 179.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 2.3 ttp -53.42 -40.88 65.5 Favored 'General case' 0 C--O 1.233 0.216 0 O-C-N 123.326 0.391 . . . . 1.44 111.151 178.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -67.8 -43.58 79.33 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.485 -0.325 . . . . 0.29 110.971 -178.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.37 -43.71 98.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.738 0.304 . . . . 1.33 110.888 177.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . 0.757 ' HB3' ' HH ' ' A' ' 73' ' ' TYR . 7.1 m-20 -47.24 -48.86 24.28 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.455 -0.793 . . . . 2.36 111.335 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . 0.421 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 14.0 t -57.24 -42.46 81.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.724 -0.671 . . . . 1.09 111.518 179.124 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . 0.782 ' HH ' HE21 ' A' ' 127' ' ' GLN . 56.6 m-85 -80.44 -21.06 42.52 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.857 0.36 . . . . 1.17 111.833 -173.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 55.5 mt -87.01 -50.86 13.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.935 0.398 . . . . 1.18 110.75 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -73.43 -42.83 61.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.054 -0.521 . . . . 1.6 110.739 -177.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . 0.421 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 67.0 m-80 -100.01 161.5 13.57 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.233 -0.439 . . . . 1.37 110.728 -174.541 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.1 mmtt -82.83 147.95 56.22 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.95 -0.568 . . . . 3.92 109.844 178.007 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_endo -62.26 -12.98 29.63 Favored 'Trans proline' 0 N--CA 1.473 0.271 0 C-N-CA 122.786 2.324 . . . . 1.32 112.386 178.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.41 9.35 39.77 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.82 -0.627 . . . . 1.71 111.338 179.686 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -85.92 164.0 17.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.081 0.467 . . . . 1.34 111.062 -177.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.76 -45.41 94.01 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.234 -0.894 . . . . 1.44 110.943 -177.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -69.33 -34.85 64.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.176 -0.92 . . . . 1.16 111.487 -174.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.476 ' O ' HG12 ' A' ' 123' ' ' VAL . 2.3 t -71.32 -35.04 56.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.881 0.372 . . . . 1.1 110.088 179.507 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.87 -32.06 65.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.5 0.667 . . . . 1.22 109.646 177.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' MET . . . . . 0.465 ' SD ' ' HG2' ' A' ' 58' ' ' PRO . 8.7 mtt -80.13 -43.95 20.78 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 114.992 -1.004 . . . . 1.25 110.787 179.739 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.86 -35.16 63.72 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.246 -0.434 . . . . 1.1 111.885 -177.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . 0.782 HE21 ' HH ' ' A' ' 113' ' ' TYR . 0.1 OUTLIER -63.63 -41.98 98.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.403 -0.362 . . . . 2.08 111.386 -179.542 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -78.06 -36.56 48.2 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.174 0.512 . . . . 1.04 110.466 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.403 HD13 ' ND1' ' A' ' 53' ' ' HIS . 4.0 mp -60.8 -42.06 96.86 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.445 -0.798 . . . . 1.16 111.042 -179.333 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -61.13 -28.63 69.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.883 -0.599 . . . . 1.47 111.967 -175.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.501 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 7.0 mttm -64.53 -34.35 78.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.839 0.352 . . . . 2.7 110.441 -177.119 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . 0.442 HD11 ' CD2' ' A' ' 53' ' ' HIS . 13.9 mt -75.54 -31.0 22.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.036 -0.529 . . . . 1.79 110.67 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.572 ' O ' HG23 ' A' ' 137' ' ' VAL . 29.4 t80 -58.66 -62.33 1.95 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.009 -0.541 . . . . 0.52 110.691 -179.426 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.28 -28.24 69.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.104 0.478 . . . . 1.26 110.488 -179.364 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.501 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.36 -39.8 88.48 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.469 -0.787 . . . . 2.07 111.481 179.231 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.76 -26.56 19.43 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.895 0.378 . . . . 2.11 110.745 -178.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.572 HG23 ' O ' ' A' ' 133' ' ' PHE . 55.8 t -67.8 -32.03 54.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.1 -0.5 . . . . 1.09 110.23 177.403 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -64.96 -18.69 65.48 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.029 -0.532 . . . . 1.21 110.849 179.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.3 mm100 -103.58 -0.28 29.91 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.599 -0.728 . . . . 1.94 110.958 -178.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' MET . . . . . 0.462 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 0.4 OUTLIER -66.43 142.32 97.65 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.155 -0.475 . . . . 1.34 111.371 -179.432 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -74.77 101.7 1.49 Allowed 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.472 2.114 . . . . 0.67 111.895 179.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 76.5 mm-40 -70.05 -2.24 12.21 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 112.192 0.441 . . . . 3.68 112.192 -175.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -81.83 -38.42 25.52 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.881 0.372 . . . . 2.7 110.384 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 67.09 86.33 0.13 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.842 -1.072 . . . . 2.34 110.347 -178.685 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 1.2 t -96.25 120.19 45.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.564 -0.744 . . . . 1.66 109.618 178.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.15 146.02 45.95 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.752 0.311 . . . . 1.53 110.625 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 69.1 mt . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.555 -0.736 . . . . 1.57 110.371 -177.432 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.3 p . . . . . 0 N--CA 1.455 -0.202 0 CA-C-O 121.449 0.642 . . . . 1.5 110.059 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -148.92 132.68 16.95 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.645 -0.707 . . . . 1.85 110.027 177.21 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -140.77 131.01 13.39 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 116.366 -0.379 . . . . 1.62 110.319 178.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -67.35 -47.33 2.26 Favored 'Trans proline' 0 CA--C 1.53 0.316 0 C-N-CA 123.093 2.529 . . . . 2.05 113.093 -179.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 3.1 m -80.54 -22.48 40.79 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.083 -0.508 . . . . 2.24 111.331 -174.062 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.433 ' HA ' ' HD3' ' A' ' 32' ' ' PRO . 17.5 tttm -77.85 127.27 82.48 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 115.932 -0.577 . . . . 3.33 110.941 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 31' ' ' LYS . 3.8 Cg_exo -72.36 151.42 53.98 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.386 2.058 . . . . 1.8 111.952 177.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -151.84 113.36 0.58 Allowed Glycine 0 N--CA 1.443 -0.856 0 N-CA-C 110.681 -0.967 . . . . 0.97 110.681 179.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.6 mtm180 -124.7 159.74 30.16 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 110.099 -0.334 . . . . 2.37 110.099 -175.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.47 ' H ' ' HG3' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -99.2 84.2 2.99 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.118 0.485 . . . . 3.13 110.99 179.284 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.492 ' HA ' ' HA ' ' A' ' 146' ' ' GLU . 5.4 p -94.46 176.6 6.23 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 120.927 0.394 . . . . 1.29 111.401 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -63.31 -54.92 29.55 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.613 -0.721 . . . . 1.47 110.679 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -56.74 -39.85 74.7 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.771 0.319 . . . . 1.04 111.105 -178.035 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.53 -58.99 6.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.057 -0.52 . . . . 1.39 111.282 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.4 mt-30 -69.54 -26.02 64.3 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.962 -0.563 . . . . 1.75 110.721 -177.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 47.8 t80 -60.85 -62.95 1.48 Allowed 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.739 -0.664 . . . . 1.2 110.669 177.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -61.06 -30.41 70.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.726 0.298 . . . . 1.76 110.529 -173.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -59.14 -56.24 24.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.866 -0.606 . . . . 1.47 110.836 178.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 -86.4 -30.42 22.14 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.99 0.424 . . . . 0.53 111.927 -176.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 91.7 t -88.48 -57.6 4.12 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 N-CA-C 112.423 0.527 . . . . 1.11 112.423 -174.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 50.1 t -80.46 -66.51 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 C-N-CA 120.716 -0.394 . . . . 1.07 111.712 -170.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 1.5 p -70.67 -34.11 55.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 C-N-CA 120.581 -0.448 . . . . 1.44 111.437 -173.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.02 -34.79 79.27 Favored 'General case' 0 C--N 1.329 -0.29 0 O-C-N 122.195 -0.316 . . . . 2.85 111.578 179.345 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.0 m -77.5 -39.1 47.46 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.909 -0.316 . . . . 1.23 110.54 177.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.53 -38.05 83.19 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.246 0.546 . . . . 1.11 109.875 175.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 17.6 t-105 -60.76 -28.73 68.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.461 -0.79 . . . . 0.44 111.499 178.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.7 mtmt -92.72 18.79 8.28 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.014 0.375 . . . . 2.75 112.014 -174.177 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.415 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 23.3 t-80 -89.48 139.12 30.85 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.963 -0.384 . . . . 0.47 109.963 175.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -70.76 -8.88 55.52 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.323 -0.399 . . . . 1.91 112.023 -175.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.415 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 1.8 m-30 -107.53 -1.49 21.27 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.96 0.409 . . . . 1.24 110.47 177.762 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -92.25 2.29 56.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.271 0.558 . . . . 1.09 110.972 -177.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.462 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 54.0 p-90 -63.87 -33.22 9.23 Favored Pre-proline 0 CA--C 1.547 0.855 0 N-CA-C 114.489 1.292 . . . . 0.65 114.489 -173.683 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.462 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 6.6 Cg_exo -74.59 -5.1 16.42 Favored 'Trans proline' 0 C--N 1.36 1.179 0 CA-C-N 121.296 1.499 . . . . 0.61 112.49 178.411 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -100.9 3.13 41.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.875 0.369 . . . . 1.52 110.269 -177.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.415 ' CZ ' ' HA ' ' A' ' 57' ' ' TRP . 16.0 m-30 -71.83 -26.15 62.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.048 -0.524 . . . . 1.01 111.159 -178.484 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.52 123.91 34.52 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.098 -0.501 . . . . 2.11 110.896 -174.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.563 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 39.1 Cg_exo -60.41 159.62 26.66 Favored 'Trans proline' 0 C--O 1.237 0.45 0 C-N-CA 122.968 2.445 . . . . 1.1 113.166 179.395 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.7 t -100.77 105.14 17.23 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 CA-C-O 121.705 0.764 . . . . 1.46 109.103 -178.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -114.12 2.9 15.05 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.919 -1.037 . . . . 1.85 110.885 -176.211 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 73.02 -9.03 1.18 Allowed 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 115.195 -0.911 . . . . 1.43 112.812 175.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 21.5 mm -113.96 -55.39 4.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.019 0.438 . . . . 2.38 110.666 -175.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.68 -40.3 88.51 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.756 -0.656 . . . . 3.34 110.611 -177.548 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.61 -5.08 57.49 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.91 -0.586 . . . . 2.3 110.564 178.221 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 58.9 t30 53.21 68.11 0.89 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.774 -0.648 . . . . 1.89 110.507 -174.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -130.04 65.59 75.75 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 115.603 -0.726 . . . . 2.18 110.667 -177.067 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -70.5 -30.36 18.95 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.166 1.91 . . . . 1.42 112.414 -177.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.23 -9.14 59.6 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.043 -0.526 . . . . 1.97 110.951 -177.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -63.55 -42.27 98.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.144 -0.48 . . . . 1.53 110.468 179.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -71.39 -7.82 49.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.0 -0.545 . . . . 1.22 111.637 -176.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 52.9 mmtt -92.5 -28.88 16.52 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.107 0.48 . . . . 3.34 110.095 -177.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.6 mt -101.72 -42.37 9.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.416 0.627 . . . . 1.5 110.184 178.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 47.8 mm -105.17 117.49 50.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 115.76 -0.655 . . . . 1.19 110.014 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.66 -15.68 34.31 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.289 -0.414 . . . . 2.35 110.697 -176.699 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -120.36 84.45 35.14 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.921 -0.582 . . . . 2.05 109.896 177.333 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.43 ' O ' ' HE3' ' A' ' 81' ' ' MET . 48.4 Cg_endo -70.7 91.24 0.61 Allowed 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.604 2.203 . . . . 1.24 112.318 -176.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.43 ' HE3' ' O ' ' A' ' 80' ' ' PRO . 1.6 mmt -129.39 162.51 27.87 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.03 -0.532 . . . . 1.39 110.436 -178.009 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.563 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 8.4 p-10 -146.92 -126.01 0.06 Allowed 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 114.79 -1.096 . . . . 1.42 109.082 -173.568 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' MET . . . . . 0.495 ' SD ' ' HE3' ' A' ' 108' ' ' MET . 0.2 OUTLIER -120.0 -22.01 6.87 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.139 0.495 . . . . 1.14 110.15 -178.918 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -84.64 -24.89 44.37 Favored Glycine 0 N--CA 1.442 -0.931 0 N-CA-C 110.759 -0.937 . . . . 0.33 110.759 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.68 -38.56 64.86 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 121.104 0.478 . . . . 1.6 110.252 177.371 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.515 HG23 ' SG ' ' A' ' 101' ' ' CYS . 75.9 mt -60.17 -49.27 84.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.404 -0.816 . . . . 1.63 110.046 175.255 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.89 -27.45 66.67 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.562 -0.745 . . . . 1.71 111.303 -178.623 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.411 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 1.0 OUTLIER -62.48 -44.63 95.93 Favored 'General case' 0 N--CA 1.456 -0.128 0 CA-C-O 120.521 0.2 . . . . 2.93 111.301 -178.837 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 24.0 mtp180 -75.97 -29.03 58.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.638 0.256 . . . . 1.49 110.698 -179.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.57 ' HG ' ' OH ' ' A' ' 95' ' ' TYR . 3.9 mt -63.67 -55.52 22.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.945 -0.57 . . . . 1.14 110.91 178.429 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -72.05 -22.53 61.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.229 -0.441 . . . . 1.39 111.249 -176.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . 0.411 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 4.9 m-80 -83.72 -9.04 59.11 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.491 -0.322 . . . . 1.66 110.558 178.183 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 56.71 53.8 7.96 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.604 0.716 . . . . 1.75 110.142 -178.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -81.35 -16.27 52.83 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.329 -0.85 . . . . 1.3 111.411 -175.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . 0.57 ' OH ' ' HG ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -129.18 174.22 9.77 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.042 0.449 . . . . 1.72 110.936 -179.455 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 -73.64 -50.47 20.87 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.178 -0.919 . . . . 1.15 110.671 -178.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 29.1 t -143.55 176.74 8.97 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.033 -0.531 . . . . 1.05 110.228 -175.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.82 -7.35 54.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.475 -0.33 . . . . 1.31 111.741 -173.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.74 -32.23 71.52 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.937 0.398 . . . . 1.12 110.795 -179.515 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -73.26 -32.03 64.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.844 -0.617 . . . . 2.44 110.522 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . 0.616 ' HA ' ' OD2' ' A' ' 104' ' ' ASP . 0.5 OUTLIER -75.44 -20.65 58.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.737 -0.665 . . . . 1.24 111.539 -175.94 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.38 -27.39 62.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.006 0.432 . . . . 1.66 110.182 176.555 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -71.9 -40.52 68.8 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.851 -0.613 . . . . 3.72 110.511 177.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . 0.616 ' OD2' ' HA ' ' A' ' 101' ' ' CYS . 5.3 m-20 -66.47 -48.21 70.62 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.977 -0.556 . . . . 1.87 110.404 -179.565 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -56.82 -42.88 80.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.873 -0.603 . . . . 0.45 110.558 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -58.69 -50.47 73.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.169 -0.468 . . . . 1.23 110.054 175.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 30.9 m -57.88 -49.09 77.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.128 -0.487 . . . . 1.09 111.315 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.495 ' HE3' ' SD ' ' A' ' 83' ' ' MET . 0.0 OUTLIER -52.31 -38.05 57.43 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.878 0.471 . . . . 1.44 111.927 179.844 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -77.87 -49.12 14.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.972 0.415 . . . . 0.29 110.167 -175.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.81 -36.39 80.98 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.937 -0.574 . . . . 1.33 111.61 178.044 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -49.31 -52.83 25.28 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.013 0.435 . . . . 2.36 111.201 178.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . 0.419 ' SG ' ' HA ' ' A' ' 123' ' ' VAL . 1.0 OUTLIER -63.95 -41.71 97.52 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.536 -0.756 . . . . 1.09 110.998 -178.753 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -63.28 -37.92 89.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.399 -0.364 . . . . 1.17 111.411 -177.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 55.8 mt -80.04 -48.96 19.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.451 -0.341 . . . . 1.18 111.887 -176.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 92.2 t80 -69.8 -26.63 64.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.75 0.31 . . . . 1.6 111.55 -174.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -111.46 175.8 5.28 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.15 0.5 . . . . 1.37 111.375 -173.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -97.06 152.04 38.08 Favored Pre-proline 0 C--N 1.322 -0.625 0 CA-C-N 115.543 -0.753 . . . . 3.92 110.298 -177.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -60.18 -21.69 67.17 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.798 2.332 . . . . 1.32 112.697 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.52 18.39 16.76 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.131 -0.486 . . . . 1.71 111.347 -179.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -96.7 155.71 16.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.236 -0.438 . . . . 1.34 110.361 178.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -71.7 -41.05 69.07 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.792 -0.64 . . . . 1.44 110.703 -175.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.2 tp -62.65 -34.02 62.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.99 -0.55 . . . . 1.16 110.853 -178.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.419 ' HA ' ' SG ' ' A' ' 112' ' ' CYS . 0.9 OUTLIER -68.99 -41.71 81.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.113 0.483 . . . . 1.1 109.861 177.102 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.37 -34.83 79.07 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.646 -0.707 . . . . 1.22 109.819 -179.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' MET . . . . . 0.628 ' O ' HD13 ' A' ' 129' ' ' LEU . 14.5 mtt -69.0 -47.09 66.37 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.257 -0.883 . . . . 1.25 110.677 179.568 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.59 -39.43 67.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.239 -0.437 . . . . 1.1 111.394 -179.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.76 -36.74 83.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.14 -0.482 . . . . 2.08 111.386 -178.42 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -74.95 -37.15 62.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.198 0.523 . . . . 1.04 110.319 178.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.628 HD13 ' O ' ' A' ' 125' ' ' MET . 7.6 mp -61.05 -39.85 91.4 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.264 -0.88 . . . . 1.16 110.323 178.085 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -55.0 -32.75 62.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.574 -0.739 . . . . 1.47 112.071 -176.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.617 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -62.59 -38.8 91.55 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 120.692 0.282 . . . . 2.7 110.676 -175.389 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . 0.509 HD11 HG21 ' A' ' 132' ' ' ILE . 25.0 mt -72.2 -34.19 48.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.17 -0.468 . . . . 1.79 110.5 179.493 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.539 ' O ' HG21 ' A' ' 137' ' ' VAL . 30.7 t80 -60.52 -62.72 1.66 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.947 -0.57 . . . . 0.52 110.845 -178.684 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.8 -28.41 69.55 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 120.917 0.389 . . . . 1.26 110.612 -177.022 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.617 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -58.9 -57.53 12.64 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.611 -0.722 . . . . 2.07 110.777 176.626 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.15 -26.48 63.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.786 -0.643 . . . . 2.11 111.081 -176.552 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.539 HG21 ' O ' ' A' ' 133' ' ' PHE . 75.8 t -68.93 -31.87 52.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.936 0.398 . . . . 1.09 110.245 177.003 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -70.52 -12.5 61.61 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.111 0.482 . . . . 1.21 110.718 177.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -104.26 -1.36 27.17 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.877 -0.601 . . . . 1.94 110.333 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' MET . . . . . 0.471 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 0.5 OUTLIER -68.29 144.94 97.15 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 115.907 -0.588 . . . . 1.34 111.193 -178.193 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . 0.438 ' C ' ' H ' ' A' ' 143' ' ' GLU . 58.5 Cg_endo -73.95 91.14 0.93 Allowed 'Trans proline' 0 N--CA 1.459 -0.508 0 C-N-CA 122.4 2.067 . . . . 0.67 111.436 177.002 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -78.98 26.4 0.25 Allowed 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.633 0.73 . . . . 3.68 111.875 -176.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . 0.438 ' H ' ' C ' ' A' ' 141' ' ' PRO . 4.5 mp0 -114.13 -43.13 3.26 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-N 115.14 -0.937 . . . . 2.7 108.49 174.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.42 ' C ' HG23 ' A' ' 145' ' ' VAL . 3.8 tp10 72.35 137.99 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 114.667 -1.151 . . . . 2.34 112.37 171.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . 0.42 HG23 ' C ' ' A' ' 144' ' ' GLU . 0.1 OUTLIER -155.58 150.63 10.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 114.845 -1.07 . . . . 1.66 108.5 177.683 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.492 ' HA ' ' HA ' ' A' ' 36' ' ' THR . 0.9 OUTLIER -81.74 148.31 29.0 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 119.793 -0.763 . . . . 1.53 109.602 174.387 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . 0.439 ' N ' ' HG3' ' A' ' 146' ' ' GLU . 14.1 mt . . . . . 0 C--O 1.247 0.923 0 CA-C-O 118.581 -0.723 . . . . 1.57 110.906 -178.188 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.428 ' CG2' ' HG3' ' A' ' 88' ' ' LYS . 8.1 p . . . . . 0 N--CA 1.455 -0.222 0 CA-C-O 121.719 0.771 . . . . 1.5 109.596 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.481 ' HB3' ' ND2' ' A' ' 92' ' ' ASN . 66.9 p -163.7 141.8 7.57 Favored 'General case' 0 N--CA 1.439 -0.993 0 CA-C-N 114.893 -1.049 . . . . 1.85 109.21 179.179 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.454 ' HB3' ' CB ' ' A' ' 31' ' ' LYS . 39.1 t-20 -148.05 124.77 5.49 Favored Pre-proline 0 C--N 1.316 -0.86 0 CA-C-N 116.261 -0.427 . . . . 1.62 110.099 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.19 -40.13 9.19 Favored 'Trans proline' 0 N--CA 1.472 0.244 0 C-N-CA 123.093 2.529 . . . . 2.05 112.685 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.6 m -77.46 -22.68 51.0 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 116.054 -0.521 . . . . 2.24 110.363 -177.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.454 ' CB ' ' HB3' ' A' ' 28' ' ' ASN . 5.3 tttp -83.52 131.4 52.68 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.512 -0.767 . . . . 3.33 110.232 177.115 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.427 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 40.9 Cg_endo -68.3 140.5 48.87 Favored 'Trans proline' 0 N--CA 1.463 -0.3 0 C-N-CA 122.758 2.306 . . . . 1.8 112.702 177.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -142.45 121.58 1.8 Allowed Glycine 0 N--CA 1.446 -0.635 0 N-CA-C 110.491 -1.043 . . . . 0.97 110.491 177.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.418 ' HE ' ' CD ' ' A' ' 146' ' ' GLU . 0.3 OUTLIER -129.38 173.03 10.91 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 117.052 0.426 . . . . 2.37 110.877 -174.452 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -110.33 100.97 9.74 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.778 -0.646 . . . . 3.13 110.778 177.472 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.7 p -108.66 164.25 12.54 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.781 -0.368 . . . . 1.29 110.58 175.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.444 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 0.1 OUTLIER -65.72 -35.87 81.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.931 -0.577 . . . . 1.47 110.647 -179.666 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -67.43 -36.27 80.88 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 120.748 0.308 . . . . 1.04 110.505 178.162 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.1 -53.7 49.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.991 -0.55 . . . . 1.39 110.648 178.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -68.51 -30.36 69.16 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.985 -0.552 . . . . 1.75 110.617 -179.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.444 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 43.3 t80 -57.9 -63.2 1.33 Allowed 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 115.846 -0.616 . . . . 1.2 110.781 176.417 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.23 -31.87 70.59 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.749 0.309 . . . . 1.76 110.915 -172.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.416 ' HA ' ' CG1' ' A' ' 47' ' ' VAL . 11.1 tt0 -67.41 -48.2 68.01 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.88 -0.6 . . . . 1.47 110.978 -178.449 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 66.9 m-80 -85.81 -32.41 21.79 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 112.369 0.507 . . . . 0.53 112.369 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 72.6 t -88.23 -57.4 4.28 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 N-CA-C 112.214 0.45 . . . . 1.11 112.214 -174.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 78.6 t -82.6 -66.22 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 C-N-CA 120.695 -0.402 . . . . 1.07 111.864 -170.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.416 ' CG1' ' HA ' ' A' ' 43' ' ' GLN . 1.4 p -64.54 -36.79 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 C-N-CA 120.431 -0.508 . . . . 1.44 111.669 -174.026 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.38 -36.97 79.3 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.848 0.356 . . . . 2.85 111.037 177.416 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 56.3 m -77.88 -34.31 51.66 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.59 -0.277 . . . . 1.23 110.948 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.47 -42.63 92.05 Favored 'General case' 0 C--N 1.332 -0.196 0 N-CA-C 109.654 -0.499 . . . . 1.11 109.654 175.275 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 21.2 t-105 -61.9 -38.54 88.74 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.743 -0.662 . . . . 0.44 111.006 178.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -84.42 15.37 3.71 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.018 0.377 . . . . 2.75 112.018 -175.31 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -87.3 134.47 33.55 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.557 -0.535 . . . . 0.47 109.557 175.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -74.9 -4.54 38.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.896 0.379 . . . . 1.91 111.782 -175.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.457 ' CD2' ' HG2' ' A' ' 125' ' ' MET . 3.0 m-30 -105.38 1.64 28.03 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.118 0.485 . . . . 1.24 110.202 177.065 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -101.24 12.78 36.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.173 -0.467 . . . . 1.09 111.05 -178.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.49 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 55.6 p-90 -65.62 -34.62 9.61 Favored Pre-proline 0 CA--C 1.546 0.822 0 N-CA-C 113.507 0.929 . . . . 0.65 113.507 -175.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.49 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 4.7 Cg_exo -75.01 -1.84 11.76 Favored 'Trans proline' 0 C--N 1.364 1.357 0 CA-C-N 120.924 1.366 . . . . 0.61 112.136 178.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -106.9 10.59 30.53 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.019 -0.537 . . . . 1.52 110.405 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 11.7 m-30 -79.57 -13.25 59.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.894 -0.593 . . . . 1.01 111.317 -178.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -113.55 136.55 21.97 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 116.267 -0.424 . . . . 2.11 110.712 -174.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.564 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 37.1 Cg_endo -67.1 140.81 55.31 Favored 'Trans proline' 0 C--O 1.239 0.532 0 C-N-CA 122.765 2.31 . . . . 1.1 112.592 -179.474 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 47.4 t -83.97 86.03 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 CA-C-O 122.373 1.082 . . . . 1.46 109.408 178.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.521 ' OD1' ' HB2' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -103.18 17.1 24.87 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 114.259 -1.337 . . . . 1.85 108.612 177.26 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.422 ' HB3' ' NE2' ' A' ' 74' ' ' HIS . . . 78.21 -66.08 0.22 Allowed 'General case' 0 C--O 1.215 -0.719 0 CA-C-N 113.379 -1.737 . . . . 1.43 111.254 -176.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 55.7 mt -75.53 -37.5 37.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 112.173 0.435 . . . . 2.38 112.173 -171.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.521 ' HB2' ' OD1' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -57.67 -50.03 74.53 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.044 0.387 . . . . 3.34 112.044 -177.311 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 9.9 tp -95.37 -2.63 48.71 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.289 0.566 . . . . 2.3 110.151 178.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . 0.402 ' O ' HD12 ' A' ' 70' ' ' LEU . 1.2 t-20 63.57 56.98 1.51 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 114.95 -1.023 . . . . 1.89 112.168 178.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.402 HD12 ' O ' ' A' ' 69' ' ' ASN . 1.1 mm? -122.23 78.79 43.96 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.17 -0.923 . . . . 2.18 108.89 172.281 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.18 -32.85 26.23 Favored 'Trans proline' 0 C--O 1.233 0.269 0 C-N-CA 122.336 2.024 . . . . 1.42 113.198 -172.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.12 7.21 46.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.438 -0.346 . . . . 1.97 111.202 -174.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.47 ' OH ' ' HB3' ' A' ' 111' ' ' ASN . 1.0 OUTLIER -59.16 -42.81 91.65 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.321 -0.4 . . . . 1.53 110.25 179.437 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . 0.422 ' NE2' ' HB3' ' A' ' 65' ' ' ALA . 4.9 m-70 -77.29 0.9 20.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.857 -0.61 . . . . 1.22 111.315 -175.401 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.9 mttp -97.99 -39.05 9.14 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.212 0.529 . . . . 3.34 110.327 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.6 mt -99.09 -39.73 8.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.941 -0.572 . . . . 1.5 110.766 -178.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 50.0 mm -97.3 124.89 50.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.893 -0.594 . . . . 1.19 110.171 -178.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.38 -17.24 30.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.342 -0.39 . . . . 2.35 111.262 -176.494 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -128.32 87.28 55.67 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-O 120.841 0.353 . . . . 2.05 110.343 177.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -71.36 90.51 0.68 Allowed 'Trans proline' 0 CA--C 1.528 0.203 0 C-N-CA 122.976 2.451 . . . . 1.24 111.938 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 4.0 mmt -122.33 150.49 42.31 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 121.471 0.653 . . . . 1.39 110.527 -178.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.564 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 1.0 OUTLIER -128.45 -119.69 0.24 Allowed 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.589 -1.187 . . . . 1.42 109.03 -177.255 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -134.03 -17.68 2.12 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.941 0.4 . . . . 1.14 110.628 174.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -86.99 -30.77 19.47 Favored Glycine 0 CA--C 1.502 -0.749 0 N-CA-C 109.72 -1.352 . . . . 0.33 109.72 -178.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.3 m -74.17 -26.87 60.54 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.662 -0.769 . . . . 1.6 110.159 172.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.6 mm -66.19 -57.41 10.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.856 -0.611 . . . . 1.63 109.766 175.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.16 -24.46 66.31 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.554 -0.748 . . . . 1.71 110.886 179.049 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.428 ' HG3' ' CG2' ' A' ' 26' ' ' VAL . 4.3 tppt? -63.17 -48.09 79.87 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 120.703 0.287 . . . . 2.93 110.565 178.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 11.7 mtp180 -67.77 -29.54 68.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.973 0.416 . . . . 1.49 110.818 -179.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 9.4 mt -72.07 -51.38 21.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.855 -0.611 . . . . 1.14 111.182 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -73.72 -19.86 60.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.819 0.342 . . . . 1.39 111.252 -176.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . 0.481 ' ND2' ' HB3' ' A' ' 27' ' ' SER . 17.6 t30 -95.06 0.83 54.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.369 -0.378 . . . . 1.66 111.371 -179.087 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 56.25 65.7 1.37 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.394 0.616 . . . . 1.75 110.874 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -80.41 -47.51 14.28 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 116.122 -0.49 . . . . 1.3 111.382 178.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . 0.415 ' HB3' ' OE1' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -106.32 -173.95 2.42 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.664 0.745 . . . . 1.72 111.835 -174.311 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . 0.427 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 2.1 t90 -83.11 -45.29 14.14 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.298 -1.319 . . . . 1.15 110.159 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 46.1 t -149.49 173.67 13.34 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.47 -0.786 . . . . 1.05 110.002 -173.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -70.84 -8.55 53.43 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.398 -0.365 . . . . 1.31 111.264 -176.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -37.36 76.58 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.762 -0.654 . . . . 1.12 111.005 179.433 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.442 ' O ' ' HB3' ' A' ' 103' ' ' GLN . 3.1 tt0 -81.6 -30.7 32.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.05 -0.523 . . . . 2.44 110.718 -178.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 13.7 t -65.19 -22.74 66.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.205 0.526 . . . . 1.24 110.834 -178.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.26 -24.1 66.15 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.121 -0.49 . . . . 1.66 110.224 176.589 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.586 ' HG2' ' N ' ' A' ' 104' ' ' ASP . 0.0 OUTLIER -72.06 -51.38 21.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 3.72 110.445 179.158 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . 0.586 ' N ' ' HG2' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -70.63 -36.45 73.44 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.269 -0.423 . . . . 1.87 110.475 -177.491 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.58 -51.47 69.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.946 -0.57 . . . . 0.45 110.485 174.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -58.97 -41.27 87.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.891 -0.595 . . . . 1.23 110.766 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 71.1 m -56.41 -48.5 76.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.88 -0.6 . . . . 1.09 110.943 179.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.46 -42.9 61.92 Favored 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.439 0.462 . . . . 1.44 111.5 178.324 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -72.34 -45.04 61.62 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.43 -0.35 . . . . 0.29 111.159 -176.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.71 -36.16 82.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.132 0.492 . . . . 1.33 110.55 178.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . 0.47 ' HB3' ' OH ' ' A' ' 73' ' ' TYR . 25.1 m-20 -53.08 -51.91 60.31 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.314 -0.857 . . . . 2.36 111.05 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . 0.517 ' SG ' HG21 ' A' ' 123' ' ' VAL . 43.8 t -60.26 -40.65 91.07 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.829 -0.623 . . . . 1.09 111.379 179.426 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -71.18 -26.84 63.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.475 -0.329 . . . . 1.17 111.528 -176.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 56.0 mt -92.65 -53.67 8.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.875 0.369 . . . . 1.18 111.708 -177.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -71.03 -35.49 72.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.294 -0.412 . . . . 1.6 111.355 -174.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 50.3 m-20 -101.42 166.0 10.97 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.925 0.393 . . . . 1.37 110.705 -174.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 1.7 mmpt? -78.68 140.86 59.44 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 115.947 -0.569 . . . . 3.92 110.188 178.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -65.49 -8.63 19.64 Favored 'Trans proline' 0 CA--C 1.531 0.361 0 C-N-CA 122.357 2.038 . . . . 1.32 112.541 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -103.01 4.18 37.03 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.375 -0.375 . . . . 1.71 111.251 177.516 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -76.5 154.45 34.63 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.628 -0.508 . . . . 1.34 109.628 178.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -67.97 -33.29 74.36 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.972 -0.558 . . . . 1.44 110.205 -178.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.9 tp -63.27 -36.52 76.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 116.339 -0.391 . . . . 1.16 110.519 177.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.517 HG21 ' SG ' ' A' ' 112' ' ' CYS . 2.6 t -73.18 -43.31 57.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 N-CA-C 109.778 -0.453 . . . . 1.1 109.778 178.139 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.509 ' HA ' ' OE1' ' A' ' 127' ' ' GLN . 0.2 OUTLIER -61.63 -29.77 70.27 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.001 -0.545 . . . . 1.22 110.008 -179.466 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' MET . . . . . 0.457 ' HG2' ' CD2' ' A' ' 55' ' ' PHE . 46.7 mtt -80.63 -35.43 33.99 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.565 -0.743 . . . . 1.25 110.565 176.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.33 -36.81 76.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.021 -0.536 . . . . 1.1 111.592 -179.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . 0.509 ' OE1' ' HA ' ' A' ' 124' ' ' LEU . 18.9 mt-30 -61.22 -45.96 92.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.687 0.28 . . . . 2.08 110.638 179.319 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.85 -41.34 83.06 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.102 -0.499 . . . . 1.04 110.598 178.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.407 HD11 ' C ' ' A' ' 55' ' ' PHE . 2.5 mp -58.78 -46.19 88.09 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.687 -0.688 . . . . 1.16 110.211 177.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -66.48 -30.05 70.29 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.672 -0.695 . . . . 1.47 111.061 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.416 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.1 OUTLIER -64.28 -43.33 95.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.221 -0.445 . . . . 2.7 110.285 -177.068 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 5.5 pt -79.93 -26.89 12.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.305 -0.407 . . . . 1.79 110.45 177.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.49 ' O ' HG21 ' A' ' 137' ' ' VAL . 37.7 t80 -59.57 -61.59 2.51 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.595 -0.275 . . . . 0.52 110.598 175.415 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 2.8 pp -65.03 -22.16 66.95 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.112 0.482 . . . . 1.26 110.442 -178.096 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.512 ' O ' ' HG3' ' A' ' 139' ' ' GLN . 0.8 OUTLIER -66.07 -54.09 30.17 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.596 -0.729 . . . . 2.07 109.979 177.572 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 4.7 mmtm -65.03 -33.71 76.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.61 -0.723 . . . . 2.11 110.692 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.49 HG21 ' O ' ' A' ' 133' ' ' PHE . 78.7 t -67.16 -31.66 54.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.037 -0.529 . . . . 1.09 110.566 178.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.29 -19.52 64.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.058 0.456 . . . . 1.21 110.565 178.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . 0.512 ' HG3' ' O ' ' A' ' 135' ' ' GLN . 6.9 mt-30 -100.52 0.08 38.84 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.675 -0.693 . . . . 1.94 110.703 -178.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' MET . . . . . 0.478 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 0.2 OUTLIER -66.14 147.62 98.77 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.965 -0.561 . . . . 1.34 111.115 -179.411 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . 0.443 ' C ' ' H ' ' A' ' 143' ' ' GLU . 59.9 Cg_endo -71.35 107.01 2.05 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 C-N-CA 122.557 2.171 . . . . 0.67 112.01 -176.192 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.04 14.93 0.46 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.172 0.511 . . . . 3.68 111.372 -178.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . 0.443 ' H ' ' C ' ' A' ' 141' ' ' PRO . 0.5 OUTLIER -95.2 -40.22 9.69 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 115.74 -0.664 . . . . 2.7 109.774 178.082 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 52.8 tt0 55.24 70.06 0.67 Allowed 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.025 -0.989 . . . . 2.34 110.776 -179.045 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 1.7 t -94.6 132.34 38.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.111 -0.495 . . . . 1.66 110.241 -177.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.418 ' CD ' ' HE ' ' A' ' 34' ' ' ARG . 26.8 tt0 -78.21 146.0 35.22 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.739 0.304 . . . . 1.53 110.191 178.236 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 82.5 mt . . . . . 0 C--O 1.247 0.934 0 CA-C-O 118.626 -0.702 . . . . 1.57 110.118 -179.315 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 9.8 p . . . . . 0 N--CA 1.451 -0.421 0 CA-C-O 121.32 0.581 . . . . 1.5 109.879 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 33.7 m -161.55 138.26 8.4 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.369 -0.832 . . . . 1.85 109.263 -178.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -134.43 121.07 15.06 Favored Pre-proline 0 C--N 1.322 -0.615 0 N-CA-C 110.113 -0.328 . . . . 1.62 110.113 178.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -74.86 -37.28 2.2 Favored 'Trans proline' 0 N--CA 1.473 0.305 0 C-N-CA 123.414 2.743 . . . . 2.05 112.843 -178.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 16.3 m -69.46 -25.14 63.95 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 121.795 0.807 . . . . 2.24 109.64 179.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.4 ttmm -82.85 134.16 47.46 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 114.685 -1.143 . . . . 3.33 109.496 174.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.478 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 11.4 Cg_endo -56.06 133.76 60.01 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.02 1.813 . . . . 1.8 111.115 175.484 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -124.57 69.35 0.48 Allowed Glycine 0 N--CA 1.444 -0.818 0 CA-C-N 115.644 -0.707 . . . . 0.97 111.887 -171.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -101.35 -179.13 3.94 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.307 -0.627 . . . . 2.37 109.307 178.37 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.511 ' O ' ' HG2' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -143.32 137.53 28.86 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.89 -0.411 . . . . 3.13 109.89 178.271 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.461 ' HA ' ' HA ' ' A' ' 146' ' ' GLU . 2.1 p -120.64 174.59 6.48 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.311 -0.404 . . . . 1.29 110.251 179.296 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 56.7 t-20 -50.34 -44.65 54.54 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.705 0.628 . . . . 1.47 110.158 175.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.425 ' HG2' ' SD ' ' A' ' 140' ' ' MET . 3.3 mt-30 -60.63 -43.1 97.9 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.227 -0.442 . . . . 1.04 110.836 179.204 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -55.02 -56.88 14.85 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.528 -0.76 . . . . 1.39 110.856 -178.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -70.88 -31.03 67.56 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.84 -0.618 . . . . 1.75 111.105 -178.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.455 ' OH ' ' HB2' ' A' ' 139' ' ' GLN . 58.9 t80 -58.34 -63.72 1.17 Allowed 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.814 -0.63 . . . . 1.2 111.42 -179.505 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.1 -30.69 69.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.618 0.247 . . . . 1.76 111.039 -172.427 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.417 ' O ' HG11 ' A' ' 47' ' ' VAL . 8.5 tt0 -62.29 -53.17 58.99 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.038 -0.528 . . . . 1.47 111.317 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.451 ' O ' ' HB2' ' A' ' 48' ' ' LYS . 50.3 m-80 -87.94 -29.49 20.77 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.932 0.396 . . . . 0.53 112.048 -177.579 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 92.7 t -89.26 -58.66 3.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 N-CA-C 112.559 0.578 . . . . 1.11 112.559 -175.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 61.3 t -77.54 -65.12 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 C-N-CA 120.977 -0.289 . . . . 1.07 111.579 -169.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.417 HG11 ' O ' ' A' ' 43' ' ' GLN . 1.6 p -66.51 -34.19 68.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 C-N-CA 120.512 -0.475 . . . . 1.44 111.546 -174.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.451 ' HB2' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -62.86 -35.46 80.05 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 120.559 -0.457 . . . . 2.85 111.457 177.826 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 22.8 m -77.35 -39.28 48.11 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.858 -0.337 . . . . 1.23 110.79 177.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -37.97 83.49 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.221 0.534 . . . . 1.11 109.699 176.24 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 16.6 t-105 -63.78 -30.18 71.31 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.231 -0.895 . . . . 0.44 111.626 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.9 mttm -83.16 -5.94 59.3 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.197 0.443 . . . . 2.75 112.197 -173.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.467 ' ND1' HD12 ' A' ' 129' ' ' LEU . 3.7 t-80 -74.73 131.72 41.06 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.546 -0.539 . . . . 0.47 109.546 176.19 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -76.79 -11.87 59.9 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.591 -0.277 . . . . 1.91 111.397 -175.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 1.5 m-30 -92.87 -2.54 55.78 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.11 0.481 . . . . 1.24 110.14 176.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -96.78 14.26 25.76 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.111 -0.495 . . . . 1.09 110.596 179.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.523 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 47.6 p-90 -66.37 -33.2 6.29 Favored Pre-proline 0 CA--C 1.546 0.811 0 N-CA-C 114.016 1.117 . . . . 0.65 114.016 -174.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.523 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 11.7 Cg_exo -71.94 -2.05 10.92 Favored 'Trans proline' 0 C--N 1.361 1.228 0 C-N-CA 121.443 1.429 . . . . 0.61 112.328 178.825 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.424 ' CE2' HD12 ' A' ' 122' ' ' ILE . 3.5 m-85 -111.19 15.73 21.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.272 -0.422 . . . . 1.52 110.632 -178.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.46 ' CE2' ' HA ' ' A' ' 57' ' ' TRP . 18.3 m-30 -83.21 -12.07 57.22 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.051 -0.522 . . . . 1.01 110.699 179.261 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.71 135.28 27.11 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.205 -0.452 . . . . 2.11 110.306 -177.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.426 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 54.5 Cg_endo -71.47 147.3 51.9 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 122.718 2.279 . . . . 1.1 112.599 -177.648 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.6 t -70.38 105.92 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.525 0 CA-C-O 121.931 0.872 . . . . 1.46 110.326 176.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.415 ' HB3' ' HB3' ' A' ' 67' ' ' LYS . 12.0 t70 -116.07 131.1 57.04 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 107.601 -1.259 . . . . 1.85 107.601 166.348 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.14 -16.11 61.18 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.317 -0.401 . . . . 1.43 111.462 -173.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.9 mt -97.42 -44.08 12.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.031 0.443 . . . . 2.38 110.663 177.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.415 ' HB3' ' HB3' ' A' ' 64' ' ' ASP . 14.8 tptm -66.0 -48.41 71.29 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.729 -0.669 . . . . 3.34 111.587 -177.019 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -101.8 1.74 37.53 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.502 -0.317 . . . . 2.3 110.701 -177.137 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 47.7 t30 58.23 55.06 5.32 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.868 -0.605 . . . . 1.89 111.332 178.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.0 mt -123.37 70.67 44.7 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 115.892 -0.595 . . . . 2.18 111.269 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.98 -19.78 22.77 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.158 1.905 . . . . 1.42 111.441 178.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -77.46 -16.44 58.76 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.322 -0.854 . . . . 1.97 110.557 -179.756 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -61.27 -38.17 85.77 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.371 -0.831 . . . . 1.53 111.732 -176.412 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 8.1 m-70 -83.43 -0.79 51.58 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.083 -0.508 . . . . 1.22 111.303 -169.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.5 mtpt -93.02 -21.51 19.7 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.141 0.496 . . . . 3.34 109.815 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mt -114.53 -49.28 5.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.51 -0.768 . . . . 1.5 111.001 -178.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 33.9 mm -99.87 123.12 52.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.058 0.456 . . . . 1.19 110.44 -178.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.37 -9.25 51.05 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.985 -0.552 . . . . 2.35 110.891 -177.463 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -134.6 80.31 51.04 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.9 -0.591 . . . . 2.05 110.743 -179.414 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -70.7 94.7 0.61 Allowed 'Trans proline' 0 CA--C 1.529 0.26 0 C-N-CA 122.478 2.119 . . . . 1.24 112.219 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -128.13 159.78 34.07 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.167 0.508 . . . . 1.39 110.981 -176.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.426 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 16.2 p-10 -135.93 -126.45 0.15 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.929 -1.032 . . . . 1.42 109.742 -175.021 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' MET . . . . . 0.423 ' H ' ' CG ' ' A' ' 82' ' ' ASP . 2.4 ttm -122.76 -18.1 6.64 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.43 -0.581 . . . . 1.14 109.43 177.116 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.422 ' HA2' ' HG2' ' A' ' 87' ' ' LYS . . . -82.13 -35.74 20.15 Favored Glycine 0 N--CA 1.44 -1.036 0 N-CA-C 109.808 -1.317 . . . . 0.33 109.808 179.484 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.8 m -72.36 -31.64 65.78 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.236 -0.482 . . . . 1.6 110.621 174.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.404 HD12 ' HB2' ' A' ' 104' ' ' ASP . 0.2 OUTLIER -64.67 -53.29 44.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 109.145 -0.687 . . . . 1.63 109.145 177.454 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.422 ' HG2' ' HA2' ' A' ' 84' ' ' GLY . 0.2 OUTLIER -65.39 -26.18 67.88 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.896 -0.593 . . . . 1.71 110.737 179.384 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.01 -47.21 81.19 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-O 120.81 0.338 . . . . 2.93 110.54 179.124 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 9.5 mtp180 -67.81 -31.59 71.55 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.23 -0.441 . . . . 1.49 110.619 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.3 mt -68.43 -52.27 34.57 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.061 -0.518 . . . . 1.14 111.254 178.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -75.66 -18.82 59.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.36 -0.382 . . . . 1.39 111.822 -175.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -95.27 0.05 53.44 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.749 0.309 . . . . 1.66 110.411 178.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 56.58 66.48 1.18 Allowed 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.614 -0.721 . . . . 1.75 110.921 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 11.3 t80 -70.76 -57.76 4.32 Favored 'General case' 0 CA--C 1.512 -0.483 0 CA-C-O 121.765 0.793 . . . . 1.3 110.725 175.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -103.7 -177.88 3.5 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 114.268 -1.333 . . . . 1.72 112.074 -173.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . 0.478 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 2.3 t-105 -79.89 -44.61 20.12 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.444 -1.253 . . . . 1.15 110.647 -177.217 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 14.5 t -146.68 175.37 10.65 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.994 -0.548 . . . . 1.05 110.971 -173.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.15 -14.54 60.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.253 -0.43 . . . . 1.31 111.083 -176.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.12 -31.22 68.74 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.479 0.657 . . . . 1.12 109.869 174.469 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.64 -39.31 45.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.365 -0.834 . . . . 2.44 110.228 177.012 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 31.7 t -62.85 -22.62 66.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.595 -0.729 . . . . 1.24 110.586 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 5.4 mtt -58.97 -21.1 57.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.89 -0.595 . . . . 1.66 110.646 175.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -76.27 -55.94 5.1 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 116.38 -0.373 . . . . 3.72 110.328 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . 0.404 ' HB2' HD12 ' A' ' 86' ' ' ILE . 0.1 OUTLIER -67.07 -40.62 87.07 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.361 -0.381 . . . . 1.87 111.224 -176.21 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.24 -45.32 91.45 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.129 0.49 . . . . 0.45 110.548 176.623 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -64.72 -43.96 91.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.847 -0.615 . . . . 1.23 110.336 178.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' THR . . . . . 0.45 ' O ' ' HB3' ' A' ' 111' ' ' ASN . 57.3 m -53.98 -46.58 71.73 Favored 'General case' 0 C--N 1.332 -0.157 0 O-C-N 123.76 0.663 . . . . 1.09 111.31 -178.403 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -52.83 -40.29 63.21 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.12 -0.491 . . . . 1.44 111.07 178.195 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -74.85 -50.53 16.72 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.303 -0.408 . . . . 0.29 111.512 -177.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.28 -43.47 97.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.926 0.393 . . . . 1.33 111.058 -177.041 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . 0.45 ' HB3' ' O ' ' A' ' 107' ' ' THR . 0.1 OUTLIER -51.76 -44.31 63.31 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.386 -0.825 . . . . 2.36 111.252 179.229 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.83 -36.01 82.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.402 -0.363 . . . . 1.09 110.842 -178.535 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -71.85 -24.32 61.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.252 -0.431 . . . . 1.17 111.395 -178.006 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 25.2 mt -89.84 -49.11 14.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.361 -0.381 . . . . 1.18 111.226 -177.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 88.0 t80 -69.22 -32.11 71.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.442 . . . . 1.6 111.461 -175.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 54.1 m-80 -108.15 169.62 8.51 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.126 0.489 . . . . 1.37 111.531 -173.016 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 11.2 mmtt -82.53 149.45 61.02 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.672 -0.694 . . . . 3.92 109.969 177.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -66.23 -9.6 24.26 Favored 'Trans proline' 0 CA--C 1.53 0.319 0 C-N-CA 122.576 2.184 . . . . 1.32 112.848 -177.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -111.53 27.67 9.46 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.822 0.344 . . . . 1.71 111.269 179.605 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -99.85 164.58 11.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 1.34 110.705 178.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -64.26 -49.16 72.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.834 -0.621 . . . . 1.44 110.417 -178.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . 0.424 HD12 ' CE2' ' A' ' 59' ' ' PHE . 3.4 tp -61.45 -35.95 70.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.12 -0.491 . . . . 1.16 111.054 -175.517 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 2.4 t -70.4 -47.1 67.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 121.001 0.429 . . . . 1.1 110.157 177.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.2 mt -60.91 -35.25 76.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.726 -0.67 . . . . 1.22 110.238 -179.052 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 29.6 mtt -73.2 -43.36 61.46 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.757 -0.656 . . . . 1.25 110.619 179.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.97 -35.22 68.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.239 -0.437 . . . . 1.1 111.491 -179.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -62.89 -42.65 99.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.275 -0.42 . . . . 2.08 111.007 179.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -77.06 -39.73 48.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 1.04 110.518 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.467 HD12 ' ND1' ' A' ' 53' ' ' HIS . 2.3 mp -57.49 -39.74 77.09 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.483 -0.78 . . . . 1.16 110.757 178.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.6 -26.63 68.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.706 -0.679 . . . . 1.47 111.527 -177.68 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.5 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 27.6 mttt -64.9 -35.97 82.87 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.887 -0.412 . . . . 2.7 109.887 -179.64 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . 0.445 HD12 ' CD2' ' A' ' 53' ' ' HIS . 2.5 mt -74.77 -30.51 24.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.735 -0.666 . . . . 1.79 110.393 178.629 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.562 ' O ' HG22 ' A' ' 137' ' ' VAL . 49.5 t80 -59.29 -61.84 2.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.88 -0.6 . . . . 0.52 110.153 177.434 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.02 -30.07 71.32 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.102 0.477 . . . . 1.26 110.534 -178.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.5 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -59.49 -31.6 69.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.469 -0.787 . . . . 2.07 112.173 -180.0 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.72 -22.32 15.43 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.072 0.463 . . . . 2.11 110.444 -179.504 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.639 ' O ' ' HB2' ' A' ' 140' ' ' MET . 56.1 t -77.92 -31.9 17.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.63 -0.714 . . . . 1.09 110.436 -179.329 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.24 -18.27 64.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.167 0.508 . . . . 1.21 110.419 178.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . 0.455 ' HB2' ' OH ' ' A' ' 41' ' ' TYR . 1.9 mt-30 -98.18 2.8 48.82 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.633 -0.712 . . . . 1.94 110.324 179.487 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' MET . . . . . 0.639 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 1.6 mtt -67.39 147.68 98.81 Favored Pre-proline 0 C--O 1.233 0.219 0 CA-C-N 115.874 -0.603 . . . . 1.34 110.667 177.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.31 105.7 2.09 Favored 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.222 1.948 . . . . 0.67 111.508 175.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.04 8.37 2.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.083 0.468 . . . . 3.68 111.487 -174.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -91.06 -38.82 12.55 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.846 -0.616 . . . . 2.7 109.864 178.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 61.8 91.31 0.06 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 114.647 -1.161 . . . . 2.34 110.641 -177.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 10.3 t -111.08 126.27 68.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 115.897 -0.592 . . . . 1.66 109.532 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.461 ' HA ' ' HA ' ' A' ' 36' ' ' THR . 4.1 tt0 -71.64 149.23 45.77 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.993 0.425 . . . . 1.53 111.135 -177.443 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 16.0 mt . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.881 -0.58 . . . . 1.57 110.555 -178.245 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.3 p . . . . . 0 N--CA 1.452 -0.341 0 CA-C-O 121.583 0.706 . . . . 1.5 109.522 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 70.8 m -160.83 145.85 14.22 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 114.963 -1.017 . . . . 1.85 109.73 178.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.459 ' HB3' ' CB ' ' A' ' 31' ' ' LYS . 24.8 t-20 -146.57 126.85 6.93 Favored Pre-proline 0 C--N 1.316 -0.852 0 N-CA-C 108.765 -0.828 . . . . 1.62 108.765 175.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -61.81 -46.13 14.72 Favored 'Trans proline' 0 N--CA 1.474 0.374 0 C-N-CA 123.241 2.628 . . . . 2.05 113.305 -175.024 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 6.1 m -77.55 -22.74 50.56 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.212 0.529 . . . . 2.24 110.927 -177.045 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.459 ' CB ' ' HB3' ' A' ' 28' ' ' ASN . 9.3 tttm -77.22 124.77 87.12 Favored Pre-proline 0 C--N 1.321 -0.665 0 CA-C-N 115.393 -0.821 . . . . 3.33 111.231 -177.624 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -76.09 151.57 34.87 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.538 2.159 . . . . 1.8 111.975 175.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -136.85 136.06 8.09 Favored Glycine 0 N--CA 1.443 -0.86 0 N-CA-C 110.366 -1.094 . . . . 0.97 110.366 177.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.98 166.19 22.96 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.187 0.517 . . . . 2.37 111.361 -176.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -115.23 70.13 0.74 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.32 -0.854 . . . . 3.13 109.483 -179.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.6 p -89.0 170.02 11.02 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.84 -0.344 . . . . 1.29 110.726 -177.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.48 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 67.2 t30 -59.55 -47.34 85.95 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 115.939 -0.573 . . . . 1.47 110.406 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -56.0 -46.58 78.68 Favored 'General case' 0 C--O 1.233 0.231 0 O-C-N 123.296 0.373 . . . . 1.04 110.821 179.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.91 -59.61 5.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.103 -0.498 . . . . 1.39 111.355 -178.248 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -65.55 -28.26 69.03 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.088 -0.505 . . . . 1.75 110.613 -177.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.556 ' CE1' ' HG2' ' A' ' 140' ' ' MET . 36.3 t80 -60.89 -63.34 1.33 Allowed 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.172 -0.467 . . . . 1.2 110.974 176.736 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -63.82 -28.45 69.87 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.736 -0.385 . . . . 1.76 110.648 -172.436 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -66.08 -50.58 63.62 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.86 -0.609 . . . . 1.47 110.743 178.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.9 m-80 -86.53 -31.1 21.45 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 111.99 0.367 . . . . 0.53 111.99 -177.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 99.4 t -89.34 -58.47 3.47 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.924 0 N-CA-C 112.446 0.536 . . . . 1.11 112.446 -176.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 71.3 t -77.23 -66.14 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.337 -0.392 . . . . 1.07 111.685 -169.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.444 ' O ' HG21 ' A' ' 47' ' ' VAL . 1.8 p -65.83 -36.05 76.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 C-N-CA 120.531 -0.468 . . . . 1.44 111.588 -175.185 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 7.8 mttt -63.05 -39.61 95.25 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.343 -0.543 . . . . 2.85 111.496 178.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 90.2 m -69.75 -39.33 76.8 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.729 0.299 . . . . 1.23 110.801 177.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.28 -40.29 95.65 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 109.724 -0.473 . . . . 1.11 109.724 176.391 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . 0.43 ' CE3' ' HE3' ' A' ' 83' ' ' MET . 15.5 t-105 -62.87 -35.91 81.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.541 -0.754 . . . . 0.44 111.025 177.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -81.68 9.59 7.51 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.412 -0.358 . . . . 2.75 111.873 -177.21 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.405 ' ND1' HD12 ' A' ' 129' ' ' LEU . 10.8 t-80 -90.05 126.46 35.78 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.299 -0.63 . . . . 0.47 109.299 173.276 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -81.97 15.46 2.28 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 112.114 0.412 . . . . 1.91 112.114 -173.279 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -111.43 -5.3 14.62 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.205 -0.665 . . . . 1.24 109.205 171.524 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -95.57 16.93 15.83 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.579 -0.737 . . . . 1.09 110.613 179.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.526 ' CG ' ' HD3' ' A' ' 58' ' ' PRO . 57.9 p-90 -67.28 -35.16 8.07 Favored Pre-proline 0 CA--C 1.54 0.593 0 N-CA-C 113.527 0.936 . . . . 0.65 113.527 -175.366 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.526 ' HD3' ' CG ' ' A' ' 57' ' ' TRP . 2.9 Cg_exo -76.17 2.82 6.77 Favored 'Trans proline' 0 C--N 1.361 1.223 0 C-N-CA 121.445 1.43 . . . . 0.61 111.425 175.314 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -107.2 -4.85 18.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.396 -0.82 . . . . 1.52 110.687 -178.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.0 m-30 -71.15 -29.1 64.8 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.315 -0.402 . . . . 1.01 111.748 -176.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.75 123.39 45.88 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-N 116.269 -0.423 . . . . 2.11 111.203 -172.512 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.551 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 25.0 Cg_exo -61.56 144.65 97.88 Favored 'Trans proline' 0 C--O 1.238 0.481 0 C-N-CA 122.686 2.258 . . . . 1.1 112.314 178.164 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 4.0 t -80.69 111.49 17.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-O 121.661 0.743 . . . . 1.46 110.633 -179.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.503 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.0 OUTLIER -111.51 -0.09 16.31 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.043 -0.98 . . . . 1.85 109.478 177.488 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.503 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 78.38 -55.66 0.48 Allowed 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 114.762 -1.108 . . . . 1.43 111.5 -177.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.7 mp -80.41 -44.32 21.99 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 O-C-N 122.177 -0.327 . . . . 2.38 111.749 -173.142 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.423 ' HG2' ' HB3' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -64.03 -31.04 72.09 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.594 0.22 . . . . 3.34 111.594 -177.424 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 5.0 tp -109.81 3.61 20.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.643 0.258 . . . . 2.3 111.601 -176.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . 0.415 ' O ' HD12 ' A' ' 70' ' ' LEU . 13.6 t-20 58.85 59.52 2.81 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.361 0.6 . . . . 1.89 111.236 179.287 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.415 HD12 ' O ' ' A' ' 69' ' ' ASN . 0.0 OUTLIER -124.7 72.96 62.12 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 115.222 -0.899 . . . . 2.18 109.625 178.051 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -74.49 -58.83 0.05 OUTLIER 'Trans proline' 0 CA--C 1.531 0.34 0 C-N-CA 121.952 1.768 . . . . 1.42 112.928 -174.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -79.83 6.77 10.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.387 0.613 . . . . 1.97 111.019 -176.445 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -61.04 -38.42 86.08 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.233 -0.894 . . . . 1.53 110.613 177.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . 0.473 ' NE2' ' HB1' ' A' ' 65' ' ' ALA . 5.1 m-70 -80.25 -0.4 36.24 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.461 -0.79 . . . . 1.22 111.404 -175.764 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.2 mmtp -94.47 -44.24 7.98 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.658 -0.497 . . . . 3.34 109.658 -179.032 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 14.0 mt -82.99 -47.18 18.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.807 -0.633 . . . . 1.5 110.807 179.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.6 mm -93.53 133.64 33.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.167 -0.47 . . . . 1.19 110.056 -178.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.55 -36.28 24.12 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.136 -0.484 . . . . 2.35 110.54 -177.161 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -119.56 88.88 39.82 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 115.771 -0.65 . . . . 2.05 110.279 -179.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -74.46 80.57 2.24 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 122.857 2.371 . . . . 1.24 112.297 -178.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.63 176.52 5.14 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.358 0.599 . . . . 1.39 111.158 -178.442 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.551 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 4.4 p-10 -154.32 -129.08 0.03 OUTLIER 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 114.763 -1.108 . . . . 1.42 108.96 -172.254 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' MET . . . . . 0.43 ' HE3' ' CE3' ' A' ' 51' ' ' TRP . 6.7 ttp -124.69 -16.8 6.12 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.245 0.545 . . . . 1.14 110.242 -177.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -90.05 -29.47 15.09 Favored Glycine 0 N--CA 1.44 -1.044 0 N-CA-C 110.455 -1.058 . . . . 0.33 110.455 -178.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -70.06 -42.65 72.55 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 121.258 0.552 . . . . 1.6 110.373 177.185 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.447 HD12 ' O ' ' A' ' 82' ' ' ASP . 48.8 mt -61.95 -44.1 98.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.249 -0.887 . . . . 1.63 109.944 175.819 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.73 -34.56 76.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.838 -0.619 . . . . 1.71 111.44 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.0 mtpt -62.1 -49.09 77.31 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.393 0.616 . . . . 2.93 110.518 179.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 32.5 mtp180 -66.69 -29.38 69.36 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.382 -0.827 . . . . 1.49 111.314 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 6.3 mt -70.18 -51.67 29.35 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.297 -0.41 . . . . 1.14 110.883 177.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -73.68 -17.45 61.14 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.142 -0.481 . . . . 1.39 111.695 -175.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 14.4 t30 -100.94 1.32 39.69 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 121.028 -0.269 . . . . 1.66 110.825 178.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 54.77 58.92 4.41 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.937 -0.574 . . . . 1.75 111.184 178.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -76.51 -28.56 56.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.167 -0.47 . . . . 1.3 111.283 -178.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . 0.408 ' HA ' ' HZ2' ' A' ' 31' ' ' LYS . 0.1 OUTLIER -117.36 179.76 3.95 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.119 0.485 . . . . 1.72 111.217 -177.537 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 2.1 t-105 -81.34 -44.47 17.57 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.282 -0.872 . . . . 1.15 110.771 -177.071 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 36.5 t -148.12 -179.6 7.04 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.034 -0.53 . . . . 1.05 111.166 -172.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.45 -18.05 60.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.067 -0.515 . . . . 1.31 111.196 -176.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.38 -29.43 67.7 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.319 0.581 . . . . 1.12 110.195 177.322 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -82.34 -24.64 34.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.508 -0.769 . . . . 2.44 110.265 -179.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 9.6 t -83.42 -30.57 27.2 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.528 -0.76 . . . . 1.24 110.876 -178.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 8.8 ttm -59.01 -33.8 71.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.802 -0.635 . . . . 1.66 111.532 -177.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.48 -45.51 87.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.165 -0.471 . . . . 3.72 110.611 -179.54 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.26 -38.05 71.9 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.328 -0.396 . . . . 1.87 110.316 -179.422 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.97 -43.97 86.81 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.856 -0.611 . . . . 0.45 110.802 178.466 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 31.0 t30 -66.53 -46.29 76.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.973 -0.558 . . . . 1.23 110.08 176.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 94.2 m -57.14 -41.38 79.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.787 -0.642 . . . . 1.09 111.859 -179.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -54.25 -35.09 62.13 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 120.792 0.33 . . . . 1.44 111.141 177.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -78.97 -49.58 12.53 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.233 -0.439 . . . . 0.29 110.753 -177.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.77 -42.85 89.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.352 -0.385 . . . . 1.33 110.876 179.759 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -51.6 -47.1 63.73 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.589 -0.732 . . . . 2.36 111.002 178.017 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 4.4 t -62.32 -44.82 95.6 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 120.765 0.316 . . . . 1.09 110.938 177.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . 0.454 ' HH ' ' HA ' ' A' ' 127' ' ' GLN . 16.8 m-85 -65.41 -34.2 77.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.295 -0.411 . . . . 1.17 111.613 -177.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 54.4 mt -80.48 -52.77 13.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.468 -0.333 . . . . 1.18 111.701 -176.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 93.0 t80 -64.77 -35.49 81.25 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.865 0.364 . . . . 1.6 111.156 -175.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 -99.8 -175.98 3.13 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.084 -0.507 . . . . 1.37 110.552 -175.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . 0.571 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 0.2 OUTLIER -93.33 150.73 39.5 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 109.469 -0.567 . . . . 3.92 109.469 176.161 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -62.9 -15.35 46.81 Favored 'Trans proline' 0 N--CA 1.471 0.174 0 C-N-CA 122.29 1.993 . . . . 1.32 112.141 177.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.88 16.63 24.89 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.6 -0.727 . . . . 1.71 110.927 177.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . 0.571 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 0.2 OUTLIER -80.04 159.01 26.34 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 120.884 0.373 . . . . 1.34 110.569 -178.752 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -68.01 -46.72 70.47 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.726 -0.67 . . . . 1.44 110.666 -177.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -62.69 -37.83 80.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.123 -0.489 . . . . 1.16 110.634 179.232 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 2.3 t -66.12 -42.19 90.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.009 0.433 . . . . 1.1 110.252 178.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -33.38 72.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.843 -0.617 . . . . 1.22 109.878 179.909 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' MET . . . . . 0.447 ' O ' HD11 ' A' ' 129' ' ' LEU . 11.9 mtt -75.06 -47.47 28.73 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.403 -0.817 . . . . 1.25 110.515 177.001 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -55.9 -37.91 69.51 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.11 -0.495 . . . . 1.1 111.358 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . 0.454 ' HA ' ' HH ' ' A' ' 113' ' ' TYR . 0.9 OUTLIER -59.03 -41.4 87.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.979 -0.555 . . . . 2.08 111.043 178.268 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -76.17 -38.89 56.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.027 0.442 . . . . 1.04 110.602 178.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.447 HD11 ' O ' ' A' ' 125' ' ' MET . 2.3 mp -57.31 -41.76 80.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.566 -0.743 . . . . 1.16 110.399 177.787 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -61.27 -26.28 67.66 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.281 -0.872 . . . . 1.47 112.106 -176.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.534 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 49.4 mttm -62.64 -45.78 91.27 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 120.751 0.31 . . . . 2.7 110.38 -175.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -77.48 -21.89 14.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.185 -0.462 . . . . 1.79 110.903 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.576 ' O ' HG23 ' A' ' 137' ' ' VAL . 22.0 t80 -63.43 -61.98 1.98 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.652 -0.249 . . . . 0.52 110.516 177.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.0 -27.2 67.95 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.115 0.484 . . . . 1.26 110.219 -178.386 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.534 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -58.87 -56.74 18.34 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.173 -0.922 . . . . 2.07 110.865 174.384 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.67 -30.29 70.51 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.92 -0.582 . . . . 2.11 110.867 -177.761 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.576 HG23 ' O ' ' A' ' 133' ' ' PHE . 83.2 t -66.53 -34.8 72.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.146 -0.479 . . . . 1.09 110.229 176.311 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -70.84 -15.32 62.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.163 -0.472 . . . . 1.21 111.019 179.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . 0.46 ' HG3' ' O ' ' A' ' 135' ' ' GLN . 11.1 mt-30 -98.25 -6.38 31.24 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.398 -0.364 . . . . 1.94 110.596 177.816 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' MET . . . . . 0.556 ' HG2' ' CE1' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -66.12 159.21 72.7 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.086 -0.507 . . . . 1.34 110.453 -179.927 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -74.65 116.95 4.77 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 121.479 1.452 . . . . 0.67 110.366 174.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 -71.34 -2.78 17.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.514 0.673 . . . . 3.68 110.391 -178.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.6 -130.92 0.21 Allowed 'General case' 0 N--CA 1.432 -1.371 0 CA-C-N 114.768 -1.105 . . . . 2.7 108.861 179.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 178.8 132.5 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.08 -0.711 . . . . 2.34 109.08 169.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 2.4 t -131.66 114.45 25.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.305 -0.407 . . . . 1.66 110.118 -179.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -76.09 134.21 40.09 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 110.221 -0.288 . . . . 1.53 110.221 179.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 4.3 mt . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.647 -0.692 . . . . 1.57 110.346 -179.195 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.1 p . . . . . 0 N--CA 1.452 -0.355 0 CA-C-O 121.632 0.729 . . . . 1.5 109.329 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.2 m -169.87 143.37 2.58 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.706 -1.134 . . . . 1.85 108.514 178.441 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -151.91 140.21 13.33 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-O 120.555 0.216 . . . . 1.62 110.527 -178.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -70.76 -45.15 1.12 Allowed 'Trans proline' 0 N--CA 1.475 0.439 0 C-N-CA 123.193 2.595 . . . . 2.05 113.323 177.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.7 m -74.8 -28.34 60.68 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 121.206 0.527 . . . . 2.24 110.389 -176.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -86.31 114.84 59.61 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 115.488 -0.778 . . . . 3.33 109.015 174.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.48 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 5.9 Cg_exo -66.66 148.11 82.64 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 121.651 1.567 . . . . 1.8 111.812 -176.84 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -144.81 119.51 1.26 Allowed Glycine 0 N--CA 1.44 -1.045 0 N-CA-C 110.638 -0.985 . . . . 0.97 110.638 -179.194 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.3 mmm-85 -134.52 171.51 14.21 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.861 -0.422 . . . . 2.37 109.861 -176.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -111.1 98.56 7.62 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.649 -0.5 . . . . 3.13 109.649 -179.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.429 ' HG1' ' CD ' ' A' ' 144' ' ' GLU . 2.8 p -106.15 167.25 9.94 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.748 0.309 . . . . 1.29 111.366 -178.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.569 ' HB3' ' O ' ' A' ' 145' ' ' VAL . 0.1 OUTLIER -66.78 -35.52 80.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.096 -0.502 . . . . 1.47 110.781 -179.582 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -70.32 -38.87 75.02 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.894 0.378 . . . . 1.04 110.34 176.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.537 ' O ' ' HG2' ' A' ' 43' ' ' GLN . 0.5 OUTLIER -62.88 -52.63 62.37 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.003 -0.544 . . . . 1.39 110.339 178.253 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.95 -20.88 65.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.008 -0.542 . . . . 1.75 111.134 -179.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.547 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 43.4 t80 -68.31 -63.47 1.05 Allowed 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.741 -0.663 . . . . 1.2 111.33 179.851 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.543 ' O ' HG21 ' A' ' 47' ' ' VAL . 1.5 ttm -60.37 -33.85 73.04 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 111.978 0.362 . . . . 1.76 111.978 -170.101 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.537 ' HG2' ' O ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -63.01 -48.91 76.75 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.154 0.502 . . . . 1.47 110.585 -175.423 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.533 ' O ' ' HB2' ' A' ' 48' ' ' LYS . 69.7 m-80 -85.79 -31.29 22.41 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.835 -0.621 . . . . 0.53 111.537 -178.312 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 88.3 t -89.01 -59.72 2.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 112.878 0.695 . . . . 1.11 112.878 -175.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.492 ' HB ' ' HG2' ' A' ' 42' ' ' MET . 21.9 t -79.14 -51.82 16.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 C-N-CA 120.992 -0.283 . . . . 1.07 110.669 -171.183 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.543 HG21 ' O ' ' A' ' 42' ' ' MET . 14.7 t -58.34 -47.61 87.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.912 -0.586 . . . . 1.44 111.083 -178.03 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.533 ' HB2' ' O ' ' A' ' 44' ' ' ASN . 3.6 mttt -63.34 -29.9 71.13 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.214 0.449 . . . . 2.85 112.214 -177.474 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.5 m -73.99 -42.05 60.99 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.77 -0.372 . . . . 1.23 110.129 177.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -42.18 98.71 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.609 0.719 . . . . 1.11 109.43 174.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 8.1 t-105 -58.48 -35.02 71.56 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.664 -1.153 . . . . 0.44 111.99 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 10.9 mtpp -91.36 12.99 18.68 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.301 0.482 . . . . 2.75 112.301 -173.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.4 ' ND1' ' HB2' ' A' ' 55' ' ' PHE . 15.3 t-80 -85.94 138.81 31.73 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.104 -0.332 . . . . 0.47 110.104 176.772 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.3 mm-40 -75.45 0.99 15.17 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.049 0.388 . . . . 1.91 112.049 -174.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.4 ' HB2' ' ND1' ' A' ' 53' ' ' HIS . 0.5 OUTLIER -111.56 -1.87 15.66 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.951 0.405 . . . . 1.24 110.638 178.238 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -100.95 16.31 25.7 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.014 0.435 . . . . 1.09 110.764 -178.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.532 ' CG ' ' HD3' ' A' ' 58' ' ' PRO . 63.7 p-90 -64.91 -36.34 16.12 Favored Pre-proline 0 CA--C 1.545 0.775 0 N-CA-C 113.742 1.016 . . . . 0.65 113.742 -174.204 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.532 ' HD3' ' CG ' ' A' ' 57' ' ' TRP . 60.5 Cg_endo -84.25 9.34 4.17 Favored 'Trans proline' 0 C--N 1.359 1.103 0 CA-C-N 120.873 1.347 . . . . 0.61 111.881 178.256 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -112.75 21.17 15.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.636 -0.711 . . . . 1.52 110.777 -177.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 18.2 m-30 -91.64 -16.68 26.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.481 -0.327 . . . . 1.01 111.482 -176.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -114.96 133.25 22.67 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 116.559 -0.291 . . . . 2.11 110.897 -173.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.59 ' HA ' ' OD1' ' A' ' 82' ' ' ASP . 27.3 Cg_endo -63.28 142.73 87.27 Favored 'Trans proline' 0 C--O 1.237 0.474 0 C-N-CA 122.539 2.16 . . . . 1.1 112.191 179.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 40.0 t -71.64 93.09 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 122.137 0.97 . . . . 1.46 110.466 178.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.492 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.0 OUTLIER -98.65 -3.08 36.87 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.653 -1.158 . . . . 1.85 108.978 175.272 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.492 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 81.38 -35.52 0.11 Allowed 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 114.155 -1.384 . . . . 1.43 111.703 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 42.9 mt -95.04 -48.52 12.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 120.676 0.274 . . . . 2.38 110.355 179.346 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.41 -38.04 58.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.736 -0.666 . . . . 3.34 112.074 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.8 tp -109.96 6.69 23.37 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.555 -0.293 . . . . 2.3 111.394 -175.459 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 59.24 51.45 6.87 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.265 0.555 . . . . 1.89 111.374 178.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 17.6 mt -126.97 71.7 75.59 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.83 -0.623 . . . . 2.18 110.402 179.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -72.47 -40.99 1.89 Allowed 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.338 2.025 . . . . 1.42 113.051 -174.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -92.41 26.29 2.66 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.31 0.576 . . . . 1.97 111.085 -176.016 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -70.04 -53.87 15.67 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.584 -0.734 . . . . 1.53 111.814 -178.855 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -73.96 4.99 4.6 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.796 -0.638 . . . . 1.22 112.252 -171.089 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.0 mttp -88.26 -21.82 24.27 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.591 -0.522 . . . . 3.34 109.591 179.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.7 mp -122.82 -48.33 2.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.692 -0.685 . . . . 1.5 110.443 -179.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 41.5 mm -83.26 124.42 39.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 120.898 0.38 . . . . 1.19 110.209 -179.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 10.9 mmtt -77.49 -44.88 27.36 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.88 -0.6 . . . . 2.35 110.903 -176.519 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 41.4 m-20 -113.39 97.76 44.34 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 116.197 -0.456 . . . . 2.05 110.284 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -75.12 79.4 2.7 Favored 'Trans proline' 0 CA--C 1.528 0.213 0 C-N-CA 122.9 2.4 . . . . 1.24 112.197 -178.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 4.0 mmt -119.25 151.57 38.17 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.281 0.562 . . . . 1.39 110.755 -177.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.59 ' OD1' ' HA ' ' A' ' 62' ' ' PRO . 3.2 p-10 -132.64 -112.84 0.23 Allowed 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 114.885 -1.052 . . . . 1.42 109.485 -174.094 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.6 ttm -131.66 -21.89 2.45 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 122.141 -0.349 . . . . 1.14 110.639 175.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -81.95 -33.08 27.74 Favored Glycine 0 N--CA 1.442 -0.902 0 N-CA-C 110.322 -1.111 . . . . 0.33 110.322 179.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -70.02 -35.08 74.07 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-O 121.134 0.492 . . . . 1.6 110.113 175.358 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.4 mm -56.28 -61.37 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.257 -0.883 . . . . 1.63 110.044 175.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.55 ' O ' ' HG3' ' A' ' 91' ' ' GLU . 0.3 OUTLIER -62.09 -28.68 69.79 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.428 -0.806 . . . . 1.71 111.609 -179.292 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 65.1 tttt -63.76 -42.65 97.78 Favored 'General case' 0 C--O 1.226 -0.154 0 C-N-CA 120.675 -0.41 . . . . 2.93 110.411 -179.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 6.5 mtm-85 -74.45 -24.27 59.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.93 0.395 . . . . 1.49 110.755 -177.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.418 HD11 ' SD ' ' A' ' 42' ' ' MET . 3.2 mt -75.32 -53.46 8.72 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.787 -0.642 . . . . 1.14 110.645 177.286 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.55 ' HG3' ' O ' ' A' ' 87' ' ' LYS . 13.2 mt-10 -69.56 -37.1 76.87 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.957 -0.565 . . . . 1.39 110.948 -176.876 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -78.55 -11.03 59.94 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.393 -0.367 . . . . 1.66 110.824 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 63.01 69.06 0.6 Allowed 'General case' 0 N--CA 1.462 0.172 0 O-C-N 123.844 0.715 . . . . 1.75 111.427 176.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -80.1 -47.32 14.99 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.818 -0.628 . . . . 1.3 111.145 179.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -117.42 -174.23 2.57 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.958 0.408 . . . . 1.72 110.999 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . 0.48 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 1.9 t-105 -67.07 -68.4 0.38 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.368 -0.833 . . . . 1.15 112.005 -175.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 75.3 m -121.2 168.18 11.88 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.002 -0.545 . . . . 1.05 111.582 -171.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . 0.436 ' CB ' ' HA ' ' A' ' 39' ' ' LEU . . . -68.32 -16.87 64.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.763 -0.653 . . . . 1.31 111.352 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' SER . . . . . 0.456 ' O ' ' HB2' ' A' ' 102' ' ' MET . 0.3 OUTLIER -61.15 -26.37 67.64 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.265 -0.425 . . . . 1.12 110.993 179.409 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -38.65 64.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.208 0.528 . . . . 2.44 110.147 176.595 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -21.52 63.7 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.488 -0.778 . . . . 1.24 110.367 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.456 ' HB2' ' O ' ' A' ' 99' ' ' SER . 8.5 mmt -57.23 -33.26 67.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.021 -0.536 . . . . 1.66 110.131 175.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.42 HE21 ' HB3' ' A' ' 103' ' ' GLN . 0.3 OUTLIER -72.52 -39.66 67.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.494 -0.776 . . . . 3.72 110.039 178.945 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -70.68 -38.06 73.71 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.856 -0.611 . . . . 1.87 110.323 -178.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.47 -48.53 78.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.661 -0.699 . . . . 0.45 109.919 174.26 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -59.69 -41.15 90.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.716 -0.674 . . . . 1.23 110.106 176.126 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 86.5 m -58.33 -45.97 87.11 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.672 -0.695 . . . . 1.09 111.455 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -54.47 -47.18 73.26 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.001 0.429 . . . . 1.44 110.738 176.092 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -66.19 -40.95 90.79 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.813 -0.631 . . . . 0.29 111.23 -177.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.82 -43.07 80.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.742 0.306 . . . . 1.33 110.247 178.457 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -49.85 -48.56 51.04 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.651 -0.704 . . . . 2.36 110.669 176.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . 0.43 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 1.5 t -62.48 -41.05 98.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.186 -0.461 . . . . 1.09 110.859 178.351 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -70.79 -27.11 63.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.413 -0.358 . . . . 1.17 111.625 -177.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 59.4 mt -85.22 -50.15 14.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 120.779 0.323 . . . . 1.18 111.395 -177.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -86.25 36.25 0.68 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.416 0.627 . . . . 1.6 111.738 -174.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . 0.43 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 51.6 m-80 -157.59 -172.85 4.13 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.142 -0.936 . . . . 1.37 109.703 -179.078 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . 0.411 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 2.5 mttp -96.39 150.06 36.64 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 109.539 -0.541 . . . . 3.92 109.539 174.276 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -59.68 -19.97 55.96 Favored 'Trans proline' 0 N--CA 1.475 0.389 0 C-N-CA 122.564 2.176 . . . . 1.32 112.798 -179.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -118.67 30.7 7.05 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.913 -0.585 . . . . 1.71 110.618 177.866 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 1.5 t0 -84.24 173.36 11.06 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.055 0.455 . . . . 1.34 111.886 -175.425 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -67.23 -56.66 8.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.267 -0.879 . . . . 1.44 111.736 -173.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . 0.436 ' O ' HG13 ' A' ' 122' ' ' ILE . 1.0 OUTLIER -69.17 -29.37 42.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.978 0.418 . . . . 1.16 110.542 -179.546 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 2.1 t -64.44 -43.62 96.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.268 -0.424 . . . . 1.1 110.178 177.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.0 mt -56.28 -35.69 67.76 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 115.628 -0.715 . . . . 1.22 109.817 176.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' MET . . . . . 0.457 ' O ' HD11 ' A' ' 129' ' ' LEU . 30.7 mtt -73.38 -43.81 59.85 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.015 -0.993 . . . . 1.25 110.654 -178.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -55.1 -36.57 65.83 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.831 0.348 . . . . 1.1 111.048 178.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.53 -44.36 97.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.865 -0.607 . . . . 2.08 111.211 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.44 -35.29 60.96 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.082 0.468 . . . . 1.04 110.474 178.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.457 HD11 ' O ' ' A' ' 125' ' ' MET . 1.8 mp -62.27 -44.98 95.3 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.532 -0.758 . . . . 1.16 110.914 179.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -70.8 -22.28 62.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.48 -0.327 . . . . 1.47 111.727 -176.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 37.2 mttm -70.34 -41.73 72.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.812 0.339 . . . . 2.7 110.126 -177.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . 0.451 ' HA ' ' HB2' ' A' ' 135' ' ' GLN . 1.6 pt -79.88 -21.24 12.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.401 -0.363 . . . . 1.79 110.332 176.221 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.511 ' O ' HG23 ' A' ' 137' ' ' VAL . 25.1 t80 -61.58 -61.79 2.27 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.224 -0.444 . . . . 0.52 110.258 173.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.4 pp -64.38 -25.29 67.96 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 121.028 0.442 . . . . 1.26 110.462 -177.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.451 ' HB2' ' HA ' ' A' ' 132' ' ' ILE . 0.0 OUTLIER -55.75 -47.71 76.5 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.395 -0.82 . . . . 2.07 111.117 176.373 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.44 -24.27 34.38 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.939 -0.573 . . . . 2.11 110.786 -178.112 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' ' 133' ' ' PHE . 95.6 t -66.61 -35.87 75.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 121.299 0.571 . . . . 1.09 110.066 176.46 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.97 -17.58 64.48 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.808 -0.633 . . . . 1.21 110.606 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -101.82 3.82 39.73 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.969 -0.559 . . . . 1.94 110.811 178.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' MET . . . . . 0.471 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 24.0 mtp -72.84 146.07 87.45 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.343 -0.39 . . . . 1.34 109.973 175.876 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . 0.427 ' C ' ' H ' ' A' ' 143' ' ' GLU . 42.0 Cg_endo -68.1 116.29 4.25 Favored 'Trans proline' 0 N--CA 1.464 -0.255 0 C-N-CA 122.409 2.073 . . . . 0.67 112.291 -178.461 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -78.01 15.05 0.96 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.273 0.559 . . . . 3.68 110.615 177.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . 0.427 ' H ' ' C ' ' A' ' 141' ' ' PRO . 12.2 mt-10 -99.74 -47.82 4.93 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-N 115.731 -0.668 . . . . 2.7 110.186 -178.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.429 ' CD ' ' HG1' ' A' ' 36' ' ' THR . 4.6 tp10 61.99 89.13 0.08 Allowed 'General case' 0 C--O 1.237 0.395 0 CA-C-N 115.015 -0.993 . . . . 2.34 110.41 -174.743 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . 0.569 ' O ' ' HB3' ' A' ' 37' ' ' ASN . 2.8 t -104.4 115.3 46.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.461 -0.791 . . . . 1.66 109.654 178.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -68.4 147.15 52.48 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.546 -0.297 . . . . 1.53 110.887 -177.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 12.1 mt . . . . . 0 C--O 1.248 0.989 0 CA-C-O 118.186 -0.912 . . . . 1.57 110.922 -177.705 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.2 p . . . . . 0 N--CA 1.45 -0.431 0 CA-C-O 121.347 0.594 . . . . 1.5 109.956 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.6 m -165.78 147.59 7.21 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.31 -0.859 . . . . 1.85 109.415 179.288 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.498 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 23.0 t-20 -148.83 125.99 5.53 Favored Pre-proline 0 C--N 1.317 -0.824 0 CA-C-N 115.972 -0.558 . . . . 1.62 109.605 177.789 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -66.44 -43.32 8.23 Favored 'Trans proline' 0 N--CA 1.474 0.374 0 C-N-CA 123.375 2.717 . . . . 2.05 113.282 -175.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.0 m -75.4 -26.53 58.5 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-O 121.451 0.643 . . . . 2.24 110.468 -176.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.498 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 11.1 tttm -82.77 121.93 77.99 Favored Pre-proline 0 C--N 1.318 -0.775 0 CA-C-N 115.179 -0.918 . . . . 3.33 109.985 178.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.444 ' HB2' ' CZ3' ' A' ' 96' ' ' TRP . 23.1 Cg_endo -64.96 132.33 31.86 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.027 1.818 . . . . 1.8 112.116 -179.898 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -138.38 77.7 0.33 Allowed Glycine 0 N--CA 1.445 -0.707 0 CA-C-N 115.119 -0.946 . . . . 0.97 110.947 -178.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -85.98 148.96 25.51 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.02 0.438 . . . . 2.37 111.08 -173.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.79 102.56 14.78 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.955 -0.566 . . . . 3.13 110.045 176.274 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.3 p -110.51 167.23 10.37 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.911 0.386 . . . . 1.29 111.004 176.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -63.12 -39.92 96.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.806 -0.634 . . . . 1.47 111.264 -179.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -64.6 -42.86 95.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.559 -0.291 . . . . 1.04 110.521 178.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.465 ' O ' ' HG2' ' A' ' 43' ' ' GLN . 0.5 OUTLIER -59.01 -52.31 66.3 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.272 -0.422 . . . . 1.39 110.641 -179.754 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.424 ' O ' ' HG3' ' A' ' 43' ' ' GLN . 1.4 mt-30 -70.1 -19.98 63.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.04 -0.527 . . . . 1.75 111.186 -179.586 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -64.83 -63.34 1.14 Allowed 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.966 -0.561 . . . . 1.2 111.307 178.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.495 ' O ' HG12 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -58.84 -34.84 72.02 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 111.879 0.326 . . . . 1.76 111.879 -170.922 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.465 ' HG2' ' O ' ' A' ' 39' ' ' LEU . 0.5 OUTLIER -63.81 -49.59 72.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.208 0.528 . . . . 1.47 110.398 -176.192 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -85.46 -29.89 23.95 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.894 -0.594 . . . . 0.53 111.943 -177.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 87.8 t -89.37 -58.54 3.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 112.491 0.552 . . . . 1.11 112.491 -177.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 43.8 t -78.4 -66.06 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 120.645 0.26 . . . . 1.07 111.305 -172.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.495 HG12 ' O ' ' A' ' 42' ' ' MET . 2.0 m -64.17 -33.75 64.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.366 -0.379 . . . . 1.44 111.8 -173.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.44 ' N ' HG21 ' A' ' 47' ' ' VAL . 2.5 mttp -69.5 -31.98 70.57 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.848 -0.341 . . . . 2.85 111.467 -178.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.1 m -77.22 -38.57 51.0 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.785 -0.366 . . . . 1.23 110.386 177.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -35.72 81.84 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 109.409 -0.589 . . . . 1.11 109.409 175.132 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 13.7 t-105 -62.79 -34.2 76.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.635 -0.711 . . . . 0.44 111.209 178.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.5 mttt -84.28 5.68 25.79 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.944 -0.302 . . . . 2.75 111.763 -175.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.464 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 14.3 t-80 -84.96 134.17 34.25 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.57 -0.53 . . . . 0.47 109.57 175.379 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -85.19 12.41 7.99 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.827 0.346 . . . . 1.91 111.829 -173.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.464 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.6 OUTLIER -111.97 -1.08 15.54 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.338 0.59 . . . . 1.24 109.42 172.364 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -100.9 20.21 15.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.647 -0.706 . . . . 1.09 110.534 179.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.566 ' CG ' ' HD3' ' A' ' 58' ' ' PRO . 40.5 p-90 -73.13 -35.41 2.76 Favored Pre-proline 0 CA--C 1.541 0.623 0 N-CA-C 113.025 0.75 . . . . 0.65 113.025 -175.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.566 ' HD3' ' CG ' ' A' ' 57' ' ' TRP . 2.9 Cg_exo -75.82 -1.13 11.01 Favored 'Trans proline' 0 C--N 1.361 1.208 0 C-N-CA 121.475 1.45 . . . . 0.61 110.703 174.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -102.98 -7.95 21.03 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 114.778 -1.101 . . . . 1.52 110.537 -178.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 9.0 m-30 -65.35 -50.67 64.71 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.947 -0.57 . . . . 1.01 111.365 -176.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.15 127.33 64.61 Favored Pre-proline 0 C--N 1.32 -0.686 0 CA-C-N 115.425 -0.807 . . . . 2.11 110.549 -174.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.598 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 37.8 Cg_endo -67.94 150.07 77.93 Favored 'Trans proline' 0 C--O 1.237 0.469 0 C-N-CA 122.766 2.311 . . . . 1.1 112.799 -177.355 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 4.0 t -72.02 97.97 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 122.19 0.995 . . . . 1.46 109.958 175.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -109.44 13.47 24.08 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.524 -1.217 . . . . 1.85 109.385 176.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 65.71 -73.77 0.06 Allowed 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 114.791 -1.095 . . . . 1.43 111.453 -175.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.5 mt -65.5 -39.91 86.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 120.8 0.333 . . . . 2.38 111.282 -174.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.1 -29.1 68.37 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.021 -0.536 . . . . 3.34 112.176 -177.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -120.18 7.11 10.75 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.941 -0.304 . . . . 2.3 111.785 -176.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 66.1 t30 61.84 48.82 5.14 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.292 0.568 . . . . 1.89 111.04 -179.428 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 5.3 mt -126.04 71.4 69.18 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.047 -0.524 . . . . 2.18 111.673 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -75.7 -27.62 8.76 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 121.928 1.752 . . . . 1.42 111.83 176.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.0 -4.97 59.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.257 -0.429 . . . . 1.97 110.882 -179.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -59.53 -49.6 77.16 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.805 -0.634 . . . . 1.53 110.494 179.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 72.1 m-70 -77.98 8.28 4.93 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.51 -0.768 . . . . 1.22 111.457 -175.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 24.3 mttt -99.3 -19.96 16.79 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.453 0.644 . . . . 3.34 109.595 177.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.0 mt -114.93 -50.31 4.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.731 -0.668 . . . . 1.5 109.99 177.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 24.0 mm -95.48 103.38 14.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.826 -0.625 . . . . 1.19 109.767 179.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.0 mttt -83.08 -11.78 57.7 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.954 -0.567 . . . . 2.35 110.48 -178.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 16.1 m-80 -123.93 73.05 55.0 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.67 -0.696 . . . . 2.05 109.756 174.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -80.76 102.15 1.36 Allowed 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.534 2.156 . . . . 1.24 112.759 -175.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.5 mmt -130.64 152.93 49.47 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.953 -0.567 . . . . 1.39 110.292 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.598 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 1.1 p30 -139.36 -116.23 0.14 Allowed 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.061 -0.972 . . . . 1.42 109.607 -174.603 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -125.22 -27.09 3.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.053 0.454 . . . . 1.14 110.189 177.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.505 ' O ' ' HG3' ' A' ' 88' ' ' LYS . . . -84.28 -31.75 24.55 Favored Glycine 0 N--CA 1.441 -0.999 0 N-CA-C 110.799 -0.92 . . . . 0.33 110.799 -177.712 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -70.51 -40.85 73.29 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.928 0.394 . . . . 1.6 110.503 177.264 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.534 HD12 ' O ' ' A' ' 82' ' ' ASP . 34.7 mt -63.81 -42.51 96.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.657 -0.701 . . . . 1.63 109.938 176.047 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.87 -33.14 72.62 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.034 -0.53 . . . . 1.71 111.147 178.081 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' A' ' 84' ' ' GLY . 35.8 mttt -62.09 -50.48 71.76 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-O 121.115 0.483 . . . . 2.93 110.628 179.766 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 16.3 mtp180 -69.69 -32.93 71.81 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.676 -0.693 . . . . 1.49 111.415 -176.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 8.7 mt -66.53 -54.34 24.89 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.175 -0.466 . . . . 1.14 111.316 -179.556 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -69.59 -23.33 63.52 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.258 -0.428 . . . . 1.39 111.642 -175.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . 0.414 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 0.5 OUTLIER -89.37 -2.46 58.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.653 -0.249 . . . . 1.66 110.895 -179.01 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 59.73 54.41 4.43 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.242 0.544 . . . . 1.75 111.164 -179.345 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -80.35 -27.33 38.32 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.056 -0.52 . . . . 1.3 110.54 178.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . 0.647 ' CD1' ' HB3' ' A' ' 100' ' ' GLU . 8.2 m-85 -96.88 178.32 5.33 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-O 121.844 0.831 . . . . 1.72 111.432 -178.496 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . 0.444 ' CZ3' ' HB2' ' A' ' 32' ' ' PRO . 2.2 t-105 -94.19 -56.12 2.95 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 113.703 -1.589 . . . . 1.15 108.872 170.372 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 67.3 m -129.19 167.98 16.83 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 114.919 -1.037 . . . . 1.05 109.597 -177.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -70.79 -12.29 61.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.774 0.321 . . . . 1.31 111.647 -177.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -21.49 66.31 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.068 -0.515 . . . . 1.12 110.591 177.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.647 ' HB3' ' CD1' ' A' ' 95' ' ' TYR . 2.0 tt0 -77.03 -33.22 57.41 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.054 -0.521 . . . . 2.44 109.922 179.445 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -75.81 -22.08 56.7 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.383 -0.826 . . . . 1.24 110.724 -177.446 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 5.0 ttm -59.01 -30.95 68.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.084 -0.507 . . . . 1.66 110.454 178.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.07 -43.26 74.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.674 -0.694 . . . . 3.72 110.115 178.071 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -67.87 -43.39 79.51 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.756 -0.656 . . . . 1.87 110.82 -177.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -60.42 -44.4 95.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.101 -0.5 . . . . 0.45 110.445 178.055 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 39.4 t30 -60.7 -39.64 89.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.048 -0.524 . . . . 1.23 110.301 177.438 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 85.3 m -68.53 -44.16 75.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.563 -0.744 . . . . 1.09 111.463 179.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.09 -44.09 70.91 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.174 -0.466 . . . . 1.44 111.08 178.29 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -70.3 -43.83 69.57 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.12 -0.491 . . . . 0.29 111.026 -177.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -66.33 -37.26 84.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.813 0.34 . . . . 1.33 110.665 -178.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -50.27 -51.58 43.59 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.481 -0.781 . . . . 2.36 110.901 176.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 2.0 t -60.86 -36.43 79.13 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.548 -0.296 . . . . 1.09 111.194 178.121 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -69.79 -27.65 65.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.434 -0.348 . . . . 1.17 111.536 -177.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 29.0 mt -92.13 -51.05 12.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.923 0.392 . . . . 1.18 111.618 -176.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -67.39 -38.25 84.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.28 0.562 . . . . 1.6 110.726 -177.152 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 38.8 m-20 -101.7 -172.12 2.1 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.88 -0.6 . . . . 1.37 109.669 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.31 147.28 51.82 Favored Pre-proline 0 C--N 1.32 -0.681 0 N-CA-C 110.213 -0.292 . . . . 3.92 110.213 -179.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . 0.424 ' HA ' ' CG1' ' A' ' 123' ' ' VAL . 52.0 Cg_exo -57.7 -20.13 41.29 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 123.013 2.475 . . . . 1.32 112.86 -179.452 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.0 21.11 2.83 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.802 -0.635 . . . . 1.71 111.687 -179.711 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -118.5 165.73 13.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.166 0.508 . . . . 1.34 111.763 177.658 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.49 -36.25 80.74 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.052 -0.976 . . . . 1.44 110.588 -179.683 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.1 tp -61.03 -40.56 86.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 CA-C-N 116.491 -0.322 . . . . 1.16 111.312 -177.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.442 ' O ' HG12 ' A' ' 123' ' ' VAL . 2.2 t -70.18 -39.6 77.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 C-N-CA 120.57 -0.452 . . . . 1.1 110.011 177.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.0 -35.34 74.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.857 -0.61 . . . . 1.22 109.409 178.818 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 38.0 mtt -68.67 -50.46 50.91 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.038 -0.983 . . . . 1.25 110.613 176.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -55.05 -38.57 68.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.361 -0.381 . . . . 1.1 111.106 179.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -60.35 -41.05 92.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.895 -0.593 . . . . 2.08 111.193 178.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -77.93 -39.17 43.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.997 0.427 . . . . 1.04 110.505 179.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.445 HD13 ' ND1' ' A' ' 53' ' ' HIS . 1.9 mp -58.99 -40.56 85.21 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.605 -0.725 . . . . 1.16 110.444 179.02 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -57.64 -29.71 64.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.294 -0.866 . . . . 1.47 111.996 -178.033 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.515 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -63.29 -39.34 94.32 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.829 0.347 . . . . 2.7 110.328 -176.778 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 11.1 mt -70.07 -28.31 35.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.981 -0.554 . . . . 1.79 110.851 -178.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.514 ' O ' HG22 ' A' ' 137' ' ' VAL . 26.9 t80 -62.48 -63.06 1.34 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.118 -0.492 . . . . 0.52 110.779 -179.374 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.46 -26.53 67.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.172 0.511 . . . . 1.26 110.422 -179.102 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.515 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.94 -41.96 97.28 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.538 -0.756 . . . . 2.07 111.281 179.353 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.82 -24.91 18.35 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.246 -0.434 . . . . 2.11 110.897 -177.41 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.514 HG22 ' O ' ' A' ' 133' ' ' PHE . 37.1 t -70.73 -33.64 53.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.316 -0.402 . . . . 1.09 110.833 -179.749 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -69.3 -12.55 61.76 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.13 0.491 . . . . 1.21 110.759 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -103.98 0.0 29.43 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.999 -0.546 . . . . 1.94 110.695 178.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' MET . . . . . 0.416 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 0.0 OUTLIER -59.89 146.84 80.88 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.109 -0.496 . . . . 1.34 110.812 178.465 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -74.47 94.61 0.92 Allowed 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 121.985 1.79 . . . . 0.67 111.034 178.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 8.9 mm-40 -84.77 31.86 0.53 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.456 0.646 . . . . 3.68 111.26 -175.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -116.41 -35.67 4.22 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 114.901 -1.045 . . . . 2.7 108.508 173.445 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . 0.416 ' C ' HG23 ' A' ' 145' ' ' VAL . 0.0 OUTLIER 74.18 138.37 0.06 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 113.882 -1.508 . . . . 2.34 111.468 177.724 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . 0.416 HG23 ' C ' ' A' ' 144' ' ' GLU . 45.3 t -144.32 102.27 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.185 -0.916 . . . . 1.66 109.831 -177.705 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.15 138.29 56.92 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.665 -0.495 . . . . 1.53 109.665 176.576 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 6.5 mt . . . . . 0 C--O 1.251 1.135 0 CA-C-O 118.524 -0.75 . . . . 1.57 110.745 -176.786 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.2 p . . . . . 0 N--CA 1.453 -0.279 0 CA-C-O 121.671 0.748 . . . . 1.5 108.991 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 54.0 m -167.42 146.55 5.02 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.425 -1.261 . . . . 1.85 108.745 178.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.505 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 18.4 t-20 -135.49 129.72 18.69 Favored Pre-proline 0 C--N 1.317 -0.82 0 N-CA-C 108.879 -0.785 . . . . 1.62 108.879 176.709 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -59.79 -48.5 12.55 Favored 'Trans proline' 0 N--CA 1.472 0.264 0 C-N-CA 123.368 2.712 . . . . 2.05 113.361 -174.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.7 m -81.83 -28.31 33.16 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.854 0.359 . . . . 2.24 111.337 -174.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.505 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 0.4 OUTLIER -77.38 116.58 58.95 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.106 -0.497 . . . . 3.33 110.387 178.708 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.466 ' HB2' ' CZ3' ' A' ' 96' ' ' TRP . 6.8 Cg_exo -71.53 151.51 58.97 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.224 1.949 . . . . 1.8 112.18 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -148.66 77.69 0.23 Allowed Glycine 0 N--CA 1.444 -0.793 0 CA-C-N 115.345 -0.843 . . . . 0.97 111.111 178.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.3 mtm-85 -80.32 132.77 35.86 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.699 0.285 . . . . 2.37 110.247 -177.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -72.1 109.97 6.25 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.211 -0.449 . . . . 3.13 110.285 -177.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.49 ' CG2' ' HG3' ' A' ' 146' ' ' GLU . 5.3 p -107.81 166.86 10.38 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.661 -0.416 . . . . 1.29 110.513 177.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -60.26 -43.92 95.73 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 116.22 -0.446 . . . . 1.47 110.739 -179.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -58.53 -40.19 82.27 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.658 0.266 . . . . 1.04 110.973 -179.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.412 ' HB2' ' HA ' ' A' ' 97' ' ' SER . 0.6 OUTLIER -62.62 -57.57 10.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.081 -0.509 . . . . 1.39 110.956 -179.164 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -65.85 -29.61 70.1 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 115.986 -0.552 . . . . 1.75 110.848 -179.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 53.0 t80 -59.04 -63.89 1.14 Allowed 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.904 -0.589 . . . . 1.2 110.48 177.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.473 ' O ' HG11 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -58.73 -33.77 70.6 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 121.124 -0.23 . . . . 1.76 110.755 -174.896 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -57.57 -55.38 35.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.006 0.431 . . . . 1.47 110.885 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 51.3 m-80 -85.99 -29.93 23.12 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.067 -0.515 . . . . 0.53 111.805 -176.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 99.1 t -88.4 -56.89 4.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 N-CA-C 112.284 0.476 . . . . 1.11 112.284 -174.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 41.5 t -82.22 -66.57 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 111.814 0.301 . . . . 1.07 111.814 -172.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.473 HG11 ' O ' ' A' ' 42' ' ' MET . 1.3 m -63.37 -34.62 68.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 N-CA-C 111.604 0.224 . . . . 1.44 111.604 -173.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.35 -36.26 81.04 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.752 -0.379 . . . . 2.85 111.496 -179.301 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.4 m -76.06 -36.77 58.89 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.782 -0.367 . . . . 1.23 110.467 177.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.13 -42.48 99.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.29 0.566 . . . . 1.11 109.547 174.451 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 22.1 t-105 -55.91 -36.14 67.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.984 -1.007 . . . . 0.44 111.292 178.215 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 9.8 mmtp -90.57 22.02 3.68 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 112.445 0.535 . . . . 2.75 112.445 -172.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.457 ' ND1' HD12 ' A' ' 129' ' ' LEU . 34.3 t-80 -88.57 148.25 24.19 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 110.077 -0.342 . . . . 0.47 110.077 174.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -73.25 -16.15 61.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.315 -0.402 . . . . 1.91 111.931 -175.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 19.1 m-30 -106.72 3.24 26.44 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.924 0.392 . . . . 1.24 110.764 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -92.43 5.45 50.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.136 0.493 . . . . 1.09 111.003 -178.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.521 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 56.3 p-90 -63.84 -36.0 18.94 Favored Pre-proline 0 CA--C 1.548 0.897 0 N-CA-C 114.214 1.19 . . . . 0.65 114.214 -173.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.521 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 19.4 Cg_endo -79.99 -9.6 14.18 Favored 'Trans proline' 0 C--N 1.359 1.097 0 CA-C-N 121.407 1.538 . . . . 0.61 112.289 -178.609 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -98.19 9.09 43.77 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.058 -0.519 . . . . 1.52 110.347 -179.349 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 5.3 m-30 -70.96 -37.37 72.78 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.751 -0.659 . . . . 1.01 111.36 -178.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -101.95 134.36 20.15 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.898 -0.592 . . . . 2.11 110.846 -172.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.639 ' HA ' ' OD1' ' A' ' 82' ' ' ASP . 34.8 Cg_exo -57.62 147.73 77.7 Favored 'Trans proline' 0 C--O 1.239 0.54 0 C-N-CA 122.674 2.249 . . . . 1.1 112.099 176.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 3.8 t -68.19 106.67 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 121.785 0.802 . . . . 1.46 111.307 -178.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -114.92 130.19 56.86 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.716 -1.129 . . . . 1.85 108.071 168.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.17 -2.17 14.97 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 112.265 0.468 . . . . 1.43 112.265 -171.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 12.1 mt -113.74 -52.0 5.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.495 0.188 . . . . 2.38 111.012 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.6 tttp -59.37 -51.06 71.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.929 0.395 . . . . 3.34 111.211 -179.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.25 -7.83 50.12 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.25 -0.432 . . . . 2.3 110.298 179.252 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 56.51 63.26 2.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.267 -0.879 . . . . 1.89 110.667 -176.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -114.62 72.02 2.56 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 115.542 -0.754 . . . . 2.18 109.804 178.315 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -77.85 -51.09 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.467 2.111 . . . . 1.42 112.979 -173.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -72.87 -13.07 61.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.369 0.604 . . . . 1.97 110.538 -178.244 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -58.98 -39.99 83.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.084 -0.962 . . . . 1.53 110.899 178.529 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -75.27 -2.42 28.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.691 -0.686 . . . . 1.22 111.755 -175.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -104.59 -53.59 2.67 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.072 0.463 . . . . 3.34 110.443 -177.265 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.1 mp -76.55 -38.82 32.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.733 -0.667 . . . . 1.5 110.752 -177.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 47.8 mm -94.51 125.77 47.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 109.941 -0.392 . . . . 1.19 109.941 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.68 -28.24 33.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.278 -0.419 . . . . 2.35 111.128 -175.39 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 18.9 m-80 -132.83 81.07 59.38 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.433 -0.349 . . . . 2.05 110.431 178.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -68.65 95.34 0.46 Allowed 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 123.028 2.485 . . . . 1.24 111.863 179.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 5.8 mmt -127.46 160.82 30.31 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-O 121.39 0.614 . . . . 1.39 110.313 -178.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.639 ' OD1' ' HA ' ' A' ' 62' ' ' PRO . 2.5 p-10 -136.62 -134.27 0.14 Allowed 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 114.65 -1.159 . . . . 1.42 109.61 -170.472 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -123.36 -14.75 7.35 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.172 0.511 . . . . 1.14 109.849 -177.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -89.54 -32.39 10.34 Favored Glycine 0 N--CA 1.442 -0.916 0 N-CA-C 109.65 -1.38 . . . . 0.33 109.65 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 94.5 m -67.19 -42.33 84.36 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 114.916 -0.642 . . . . 1.6 110.823 174.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 43.4 mt -62.22 -45.79 97.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.031 0.443 . . . . 1.63 110.116 177.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.487 ' HG3' ' N ' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -64.81 -31.66 72.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.133 -0.485 . . . . 1.71 110.712 178.316 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.487 ' N ' ' HG3' ' A' ' 87' ' ' LYS . 16.5 tttp -63.62 -43.31 97.21 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 121.278 0.561 . . . . 2.93 110.755 179.232 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 10.2 mtp180 -76.22 -31.03 58.17 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.812 -0.631 . . . . 1.49 111.1 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 4.5 mt -64.8 -51.46 62.05 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.028 -0.533 . . . . 1.14 111.011 177.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -66.83 -31.25 71.74 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.873 -0.603 . . . . 1.39 111.597 -177.109 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -92.68 5.08 52.35 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.923 -0.311 . . . . 1.66 111.455 -177.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 60.41 55.13 3.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.906 -0.588 . . . . 1.75 111.8 175.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -82.08 -22.39 36.32 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.338 0.59 . . . . 1.3 110.133 175.509 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . 0.591 ' CD1' ' HB3' ' A' ' 100' ' ' GLU . 46.5 m-85 -99.02 169.52 9.36 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.723 0.773 . . . . 1.72 112.151 -174.62 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . 0.466 ' CZ3' ' HB2' ' A' ' 32' ' ' PRO . 2.0 t90 -96.72 -38.1 10.04 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-N 113.994 -1.457 . . . . 1.15 108.688 169.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.412 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 8.6 t -155.88 168.54 26.88 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 115.544 -0.753 . . . . 1.05 110.166 -175.711 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -72.67 -9.4 58.58 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.481 -0.327 . . . . 1.31 111.634 -175.322 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.15 -21.76 65.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.1 0.476 . . . . 1.12 109.89 175.094 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.591 ' HB3' ' CD1' ' A' ' 95' ' ' TYR . 1.0 OUTLIER -78.16 -42.57 31.27 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.757 -0.831 . . . . 2.44 108.757 175.341 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 29.9 m -61.91 -34.84 76.79 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.054 -0.975 . . . . 1.24 110.627 177.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 3.2 ttm -58.35 -35.27 71.68 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.604 -0.725 . . . . 1.66 110.582 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -70.73 -41.21 72.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.884 -0.598 . . . . 3.72 110.123 179.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -68.83 -43.73 74.91 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.753 -0.658 . . . . 1.87 110.47 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -58.31 -46.04 86.89 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.026 -0.534 . . . . 0.45 110.058 176.421 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 14.6 t30 -56.71 -45.25 81.98 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.682 -0.69 . . . . 1.23 110.018 176.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 91.4 m -64.77 -45.99 84.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.974 -0.557 . . . . 1.09 111.504 179.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.06 -42.68 77.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.85 0.357 . . . . 1.44 110.66 178.233 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -72.89 -50.31 24.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.021 -0.536 . . . . 0.29 110.526 -178.013 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' THR . . . . . 0.417 ' O ' HG13 ' A' ' 114' ' ' ILE . 5.0 p -59.86 -35.98 75.91 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 116.373 -0.376 . . . . 1.33 111.047 -178.175 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -52.65 -42.9 65.1 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.136 -0.484 . . . . 2.36 110.679 178.571 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . 0.612 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 0.0 OUTLIER -73.81 -26.9 60.85 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.869 -0.605 . . . . 1.09 110.875 -179.207 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -85.47 -15.87 41.49 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.862 0.363 . . . . 1.17 111.194 -179.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 110' ' ' THR . 70.0 mt -89.19 -57.66 4.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.211 -0.45 . . . . 1.18 110.744 178.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 45.4 t80 -67.55 -51.59 48.87 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.853 -0.612 . . . . 1.6 110.563 -176.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . 0.612 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 28.6 m120 -79.59 176.3 9.83 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.592 -0.731 . . . . 1.37 110.707 -178.194 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 0.0 OUTLIER -101.1 153.24 37.87 Favored Pre-proline 0 C--N 1.321 -0.654 0 N-CA-C 109.329 -0.619 . . . . 3.92 109.329 177.786 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -64.44 2.74 1.06 Allowed 'Trans proline' 0 CA--C 1.535 0.548 0 C-N-CA 122.584 2.189 . . . . 1.32 112.686 178.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.31 5.03 13.51 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.165 -0.47 . . . . 1.71 110.609 177.299 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . 0.403 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 0.9 OUTLIER -75.5 164.08 26.73 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.215 0.531 . . . . 1.34 111.923 -173.407 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.7 -55.52 22.74 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.994 -1.003 . . . . 1.44 110.603 -178.134 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -62.78 -34.48 65.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.569 -0.741 . . . . 1.16 111.114 -179.627 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 1.5 t -64.75 -40.07 87.8 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-O 121.004 0.431 . . . . 1.1 110.312 178.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.1 -29.39 68.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.292 0.567 . . . . 1.22 110.055 176.736 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' MET . . . . . 0.545 ' O ' HD11 ' A' ' 129' ' ' LEU . 10.4 mtt -80.4 -48.04 13.5 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.591 -0.731 . . . . 1.25 110.438 178.563 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -53.91 -39.08 65.5 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.151 -0.477 . . . . 1.1 111.387 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -56.72 -42.87 79.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.31 -0.405 . . . . 2.08 111.301 178.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.99 -41.79 50.17 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.023 -0.535 . . . . 1.04 110.95 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.545 HD11 ' O ' ' A' ' 125' ' ' MET . 8.5 mp -57.88 -44.51 86.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.649 -0.705 . . . . 1.16 110.41 177.636 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -57.78 -26.96 62.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.116 -0.947 . . . . 1.47 111.902 -177.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.464 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -68.24 -41.46 81.16 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.648 -0.251 . . . . 2.7 110.479 -176.878 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 15.5 mt -69.24 -31.99 51.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.884 0.373 . . . . 1.79 110.17 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.498 ' O ' HG21 ' A' ' 137' ' ' VAL . 39.4 t80 -60.28 -61.94 2.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.776 -0.647 . . . . 0.52 110.599 178.347 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.8 pp -64.87 -28.12 69.33 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.907 0.384 . . . . 1.26 110.638 -177.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.464 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.7 OUTLIER -59.73 -56.58 20.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.688 -0.687 . . . . 2.07 110.778 178.726 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 1.2 mptp? -76.75 -20.46 56.46 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.768 -0.651 . . . . 2.11 111.138 -176.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.498 HG21 ' O ' ' A' ' 133' ' ' PHE . 23.1 t -73.97 -32.27 32.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.848 0.356 . . . . 1.09 110.289 178.445 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -65.13 -20.28 66.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.093 0.473 . . . . 1.21 110.14 176.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -97.24 -0.64 46.37 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.767 -0.651 . . . . 1.94 110.954 -178.323 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' MET . . . . . 0.477 ' HG3' ' HA ' ' A' ' 137' ' ' VAL . 0.6 OUTLIER -68.54 151.31 97.31 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.258 -0.428 . . . . 1.34 111.397 -178.967 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -72.87 106.56 2.16 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.583 2.189 . . . . 0.67 111.207 177.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.45 27.52 1.08 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.196 0.522 . . . . 3.68 111.726 -173.331 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -115.2 -38.93 3.72 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 115.383 -0.826 . . . . 2.7 109.536 176.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 71.78 95.76 0.07 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 114.986 -1.007 . . . . 2.34 111.106 176.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 1.7 t -112.4 139.09 38.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.847 -0.615 . . . . 1.66 109.959 178.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.49 ' HG3' ' CG2' ' A' ' 36' ' ' THR . 1.2 mt-10 -80.06 146.45 31.93 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.791 0.329 . . . . 1.53 110.825 179.192 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 51.3 mt . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.575 -0.726 . . . . 1.57 110.689 -178.736 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.448 -0.559 0 CA-C-O 121.093 0.473 . . . . 1.5 110.165 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.3 m -166.3 135.61 3.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.624 -0.717 . . . . 1.85 110.086 -179.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -140.69 123.7 9.98 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 115.782 -0.645 . . . . 1.62 110.019 -179.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -79.91 -30.05 2.44 Favored 'Trans proline' 0 N--CA 1.475 0.41 0 C-N-CA 123.354 2.703 . . . . 2.05 112.8 177.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.4 t -76.43 -20.69 56.82 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.465 0.65 . . . . 2.24 109.571 -178.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.4 tttm -105.26 136.17 19.23 Favored Pre-proline 0 C--N 1.316 -0.865 0 CA-C-N 115.165 -0.925 . . . . 3.33 109.345 177.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.457 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 19.7 Cg_endo -60.21 137.87 77.78 Favored 'Trans proline' 0 C--O 1.239 0.53 0 C-N-CA 122.417 2.078 . . . . 1.8 112.274 178.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -141.12 78.04 0.29 Allowed Glycine 0 N--CA 1.446 -0.685 0 CA-C-N 115.089 -0.959 . . . . 0.97 110.869 -179.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.495 ' HG3' ' CE2' ' A' ' 96' ' ' TRP . 0.3 OUTLIER -93.86 174.26 7.26 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 110.291 -0.263 . . . . 2.37 110.291 -177.04 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.4 ttpp -120.53 107.02 12.35 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.821 0.344 . . . . 3.13 110.507 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.447 ' HB ' ' O ' ' A' ' 145' ' ' VAL . 7.3 p -107.5 165.39 11.44 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.689 -0.404 . . . . 1.29 110.232 177.188 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.448 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 62.5 t30 -58.15 -38.93 77.54 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.917 -0.583 . . . . 1.47 110.684 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -65.14 -39.53 93.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.03 -0.532 . . . . 1.04 110.996 -178.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.442 ' HB2' ' HA ' ' A' ' 97' ' ' SER . 0.9 OUTLIER -60.19 -58.84 6.78 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.216 -0.447 . . . . 1.39 110.809 -178.89 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 20.8 mt-30 -66.82 -26.51 66.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.961 -0.563 . . . . 1.75 110.981 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.448 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 56.6 t80 -60.25 -63.69 1.21 Allowed 'General case' 0 C--O 1.22 -0.498 0 CA-C-N 116.182 -0.463 . . . . 1.2 110.378 176.216 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.421 ' SD ' ' HB3' ' A' ' 101' ' ' CYS . 0.0 OUTLIER -60.24 -28.56 68.13 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 116.593 -0.276 . . . . 1.76 111.0 -174.47 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.485 ' O ' HG13 ' A' ' 47' ' ' VAL . 6.0 tt0 -62.71 -55.9 22.51 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.034 0.445 . . . . 1.47 111.288 177.687 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -86.56 -26.44 24.5 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.857 0.361 . . . . 0.53 111.963 -176.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 94.7 t -88.8 -57.59 4.12 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 N-CA-C 111.928 0.344 . . . . 1.11 111.928 -177.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 58.5 t -81.97 -64.45 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 112.33 0.493 . . . . 1.07 112.33 -169.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' VAL . . . . . 0.485 HG13 ' O ' ' A' ' 43' ' ' GLN . 0.7 OUTLIER -66.81 -30.81 50.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 C-N-CA 120.21 -0.596 . . . . 1.44 110.967 -175.162 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -62.37 -42.25 99.27 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 120.919 -0.312 . . . . 2.85 111.304 177.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 2.8 p -69.42 -33.57 73.17 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 120.807 0.337 . . . . 1.23 110.876 179.513 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.8 -41.48 83.11 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.997 -0.547 . . . . 1.11 109.698 176.439 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 15.0 t-105 -59.02 -36.78 75.54 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.153 -0.931 . . . . 0.44 111.538 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.8 mttm -82.98 7.69 14.86 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.025 0.38 . . . . 2.75 112.025 -174.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.426 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 13.1 t-80 -89.12 131.53 35.22 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.927 -0.397 . . . . 0.47 109.927 176.386 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -80.1 21.58 0.57 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.289 -0.414 . . . . 1.91 111.702 -175.257 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.426 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.2 OUTLIER -126.07 -6.43 6.64 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.3 0.571 . . . . 1.24 109.629 174.432 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -97.61 10.63 39.42 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.456 0.646 . . . . 1.09 110.264 179.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.468 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 57.4 p-90 -68.67 -31.68 3.14 Favored Pre-proline 0 CA--C 1.545 0.78 0 N-CA-C 113.954 1.094 . . . . 0.65 113.954 -175.608 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' PRO . . . . . 0.468 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 16.7 Cg_exo -68.52 -13.19 36.8 Favored 'Trans proline' 0 C--N 1.363 1.335 0 CA-C-N 121.193 1.462 . . . . 0.61 112.103 178.246 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -104.19 11.64 34.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.272 -0.422 . . . . 1.52 110.964 -178.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 2.6 m-30 -66.08 -43.91 85.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.089 -0.505 . . . . 1.01 111.433 -178.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -95.7 133.49 25.51 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.873 -0.603 . . . . 2.11 110.432 -175.611 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.439 ' HA ' ' OD2' ' A' ' 82' ' ' ASP . 18.3 Cg_endo -61.11 133.33 46.38 Favored 'Trans proline' 0 C--O 1.237 0.448 0 C-N-CA 122.783 2.322 . . . . 1.1 112.232 -179.755 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 1.7 t -68.65 113.16 4.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.868 0.842 . . . . 1.46 110.784 179.34 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -109.97 -0.88 17.97 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.803 -1.09 . . . . 1.85 109.39 177.216 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 78.03 -72.99 0.08 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 114.631 -1.168 . . . . 1.43 110.054 -171.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 31.1 mm -68.22 -44.64 83.93 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 116.577 -0.283 . . . . 2.38 111.585 -173.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 3.2 tptp -63.51 -19.9 65.16 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.307 0.484 . . . . 3.34 112.307 -176.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -114.02 10.16 17.47 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 122.19 -0.318 . . . . 2.3 111.173 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 61.23 42.53 11.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.611 0.72 . . . . 1.89 110.637 179.241 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.434 ' HB3' ' HB2' ' A' ' 73' ' ' TYR . 0.2 OUTLIER -119.51 73.93 16.27 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 114.943 -1.026 . . . . 2.18 110.555 -175.618 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -79.51 -34.48 1.03 Allowed 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 121.731 1.621 . . . . 1.42 112.967 -176.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -89.71 1.86 55.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.345 0.593 . . . . 1.97 110.785 -176.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.434 ' HB2' ' HB3' ' A' ' 70' ' ' LEU . 8.7 t80 -61.85 -50.47 72.12 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.473 -0.785 . . . . 1.53 111.029 -178.803 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -75.75 2.9 10.91 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.536 -0.757 . . . . 1.22 111.529 -174.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.7 mttt -89.91 -25.23 21.06 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.317 0.58 . . . . 3.34 110.015 178.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.5 mt -111.91 -45.86 5.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.574 -0.739 . . . . 1.5 110.292 -178.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 35.1 mm -94.66 121.84 45.6 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-N 116.005 -0.543 . . . . 1.19 110.257 -178.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.496 ' O ' ' HD3' ' A' ' 80' ' ' PRO . 0.0 OUTLIER -88.87 -26.12 21.79 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.956 -0.565 . . . . 2.35 110.553 -177.654 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -113.18 84.72 7.54 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 115.953 -0.567 . . . . 2.05 109.922 177.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' PRO . . . . . 0.496 ' HD3' ' O ' ' A' ' 78' ' ' LYS . 6.4 Cg_exo -73.32 94.17 0.83 Allowed 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.98 2.453 . . . . 1.24 112.137 -177.188 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' MET . . . . . 0.432 ' HE2' ' O ' ' A' ' 80' ' ' PRO . 0.0 OUTLIER -130.62 155.79 45.97 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.274 0.559 . . . . 1.39 110.739 -178.655 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.48 ' O ' HD12 ' A' ' 86' ' ' ILE . 1.7 p-10 -140.61 -119.78 0.12 Allowed 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.876 -1.057 . . . . 1.42 109.098 -175.793 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 5.2 ttp -130.21 -20.0 3.09 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.912 0.387 . . . . 1.14 110.547 177.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -85.63 -30.25 24.64 Favored Glycine 0 N--CA 1.44 -1.068 0 N-CA-C 110.442 -1.063 . . . . 0.33 110.442 -179.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.77 -47.44 62.93 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.504 -0.348 . . . . 1.6 110.363 175.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.48 HD12 ' O ' ' A' ' 82' ' ' ASP . 58.4 mt -56.3 -46.97 81.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.61 -0.723 . . . . 1.63 110.126 176.652 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.445 ' O ' ' HG2' ' A' ' 91' ' ' GLU . 0.0 OUTLIER -67.74 -34.89 77.73 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 115.772 -0.649 . . . . 1.71 110.614 -178.508 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.426 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 21.3 tptt -67.05 -34.77 78.39 Favored 'General case' 0 C--N 1.339 0.124 0 CA-C-O 120.828 0.347 . . . . 2.93 110.544 -178.567 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 7.4 mtp180 -73.25 -33.5 65.31 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.032 0.444 . . . . 1.49 110.468 177.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 9.3 mt -68.0 -51.34 48.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.901 -0.591 . . . . 1.14 111.239 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.445 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 0.5 OUTLIER -66.13 -26.03 67.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.934 0.397 . . . . 1.39 111.101 -178.089 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 1.7 m-80 -90.95 5.98 46.54 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.261 -0.427 . . . . 1.66 111.012 -179.022 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 49.7 51.67 16.05 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 121.381 0.61 . . . . 1.75 111.351 -178.843 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -74.32 -21.96 59.47 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.429 0.633 . . . . 1.3 110.657 177.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -102.7 170.24 8.13 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.862 0.839 . . . . 1.72 112.017 -174.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . 0.495 ' CE2' ' HG3' ' A' ' 34' ' ' ARG . 2.1 t90 -85.73 -42.11 14.52 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 113.538 -1.664 . . . . 1.15 108.805 168.411 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.442 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 23.2 t -155.79 176.3 12.81 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.754 -1.112 . . . . 1.05 109.944 -171.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.26 -15.37 61.42 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.869 0.366 . . . . 1.31 110.793 -177.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.48 -30.91 69.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.131 0.491 . . . . 1.12 110.508 176.12 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -75.88 -30.83 58.98 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.541 -0.754 . . . . 2.44 109.883 -179.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . 0.431 ' SG ' HG21 ' A' ' 86' ' ' ILE . 0.5 OUTLIER -81.81 -22.11 37.28 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.596 -0.729 . . . . 1.24 110.43 -177.994 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 7.5 mmt -53.33 -35.29 60.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.655 -0.702 . . . . 1.66 110.617 177.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.13 -50.32 48.99 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.552 -0.749 . . . . 3.72 110.072 -178.738 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -64.53 -40.44 95.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.946 -0.57 . . . . 1.87 110.809 -176.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.8 -44.93 95.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.464 . . . . 0.45 110.629 177.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.13 -41.32 99.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.129 -0.487 . . . . 1.23 110.202 177.709 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 54.9 m -63.38 -47.68 81.04 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.722 -0.672 . . . . 1.09 111.71 -178.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.43 ' HG3' ' N ' ' A' ' 109' ' ' PHE . 0.0 OUTLIER -58.85 -35.72 73.39 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.601 0.239 . . . . 1.44 111.206 -177.907 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' PHE . . . . . 0.43 ' N ' ' HG3' ' A' ' 108' ' ' MET . 6.1 m-85 -72.3 -49.22 36.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.022 0.439 . . . . 0.29 110.802 -178.094 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -67.93 -33.36 74.53 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.099 -0.501 . . . . 1.33 110.792 -177.748 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -53.01 -42.79 65.97 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.382 -0.826 . . . . 2.36 111.023 177.582 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -67.61 -40.06 84.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.08 0.466 . . . . 1.09 110.419 179.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -69.38 -19.06 63.83 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.239 -0.437 . . . . 1.17 111.269 -178.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 69.5 mt -92.18 -49.64 12.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.26 -0.427 . . . . 1.18 110.847 179.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -68.55 -38.44 80.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.922 -0.581 . . . . 1.6 110.831 -176.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -99.99 177.9 4.96 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.033 -0.531 . . . . 1.37 110.812 -176.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -104.37 158.33 32.18 Favored Pre-proline 0 C--N 1.322 -0.623 0 N-CA-C 109.252 -0.647 . . . . 3.92 109.252 175.527 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -63.11 -7.54 12.03 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.365 2.043 . . . . 1.32 112.681 178.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.56 5.37 47.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.048 -0.523 . . . . 1.71 111.284 177.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -91.54 146.99 23.34 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.088 0.47 . . . . 1.34 111.367 -174.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -57.34 -46.72 83.0 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.075 -0.966 . . . . 1.44 111.282 -176.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' ILE . . . . . 0.408 ' O ' HG13 ' A' ' 122' ' ' ILE . 0.9 OUTLIER -65.67 -32.16 56.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.132 -0.485 . . . . 1.16 111.075 -177.473 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -66.1 -44.07 92.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.194 0.521 . . . . 1.1 109.686 176.192 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.81 -32.04 71.41 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.519 -0.764 . . . . 1.22 109.91 178.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 23.3 mtt -73.13 -45.32 57.53 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.471 -0.786 . . . . 1.25 110.57 179.171 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.04 -36.1 67.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.894 0.378 . . . . 1.1 111.236 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.21 -49.17 78.69 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.063 -0.517 . . . . 2.08 111.099 178.618 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -70.57 -37.1 73.91 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.08 0.467 . . . . 1.04 110.516 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.8 mp -59.55 -45.49 91.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.352 -0.84 . . . . 1.16 111.247 -179.138 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -65.95 -22.05 66.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.287 -0.415 . . . . 1.47 111.917 -174.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' LYS . . . . . 0.516 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.6 OUTLIER -64.67 -39.81 94.32 Favored 'General case' 0 CA--C 1.518 -0.255 0 N-CA-C 109.789 -0.449 . . . . 2.7 109.789 179.858 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' ILE . . . . . 0.41 HD11 ' CD2' ' A' ' 53' ' ' HIS . 2.7 mt -73.74 -34.0 39.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.701 -0.682 . . . . 1.79 110.023 177.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' PHE . . . . . 0.587 ' O ' HG22 ' A' ' 137' ' ' VAL . 37.0 t80 -57.92 -62.19 1.99 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.627 -0.715 . . . . 0.52 110.556 178.619 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.36 -28.19 69.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.8 0.334 . . . . 1.26 110.755 -177.554 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.516 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.65 -51.24 70.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.793 -0.639 . . . . 2.07 111.337 178.055 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.16 -29.01 57.59 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.912 -0.586 . . . . 2.11 110.786 -178.417 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.587 HG22 ' O ' ' A' ' 133' ' ' PHE . 53.9 t -70.8 -29.38 37.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.118 -0.492 . . . . 1.09 110.753 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -69.25 -17.57 63.77 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.095 0.474 . . . . 1.21 110.549 177.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -106.18 6.47 30.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.118 -0.492 . . . . 1.94 110.949 179.683 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' MET . . . . . 0.482 ' HG3' ' HA ' ' A' ' 137' ' ' VAL . 0.4 OUTLIER -70.15 149.33 96.11 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.082 -0.508 . . . . 1.34 110.322 177.214 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' PRO . . . . . 0.49 ' C ' ' H ' ' A' ' 143' ' ' GLU . 71.8 Cg_endo -75.9 102.96 1.66 Allowed 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 121.959 1.772 . . . . 0.67 111.753 -178.375 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -78.12 25.33 0.22 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.389 0.614 . . . . 3.68 110.39 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . 0.49 ' H ' ' C ' ' A' ' 141' ' ' PRO . 3.4 mm-40 -101.4 -34.17 9.7 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 115.085 -0.961 . . . . 2.7 108.822 176.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 60.15 74.81 0.43 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 114.275 -1.329 . . . . 2.34 110.029 -178.682 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' VAL . . . . . 0.447 ' O ' ' HB ' ' A' ' 36' ' ' THR . 21.9 t -97.14 139.48 19.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.364 -0.834 . . . . 1.66 109.055 -176.221 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . 0.42 ' HA ' ' HA ' ' A' ' 36' ' ' THR . 11.8 tt0 -86.1 153.15 22.3 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 120.593 -0.443 . . . . 1.53 110.253 179.038 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' LEU . . . . . 0.437 ' HG ' ' N ' ' A' ' 37' ' ' ASN . 89.5 mt . . . . . 0 C--O 1.251 1.168 0 CA-C-O 118.474 -0.774 . . . . 1.57 110.86 -176.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo . . . . . 0 N--CA 1.479 0.66 0 N-CA-C 110.198 -0.732 . . . . 6.97 110.198 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.35 84.94 3.78 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.355 0.598 . . . . 6.2 109.888 175.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 150.9 -79.5 0.2 Allowed Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 110.613 -0.995 . . . . 3.98 110.613 -177.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 11.8 p -78.73 138.33 38.2 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.777 -0.453 . . . . 2.49 109.777 173.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.73 172.73 6.66 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.776 0.798 . . . . 2.07 111.945 -174.38 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 9.2 p -122.77 -14.39 6.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-N 114.349 -1.296 . . . . 1.5 108.853 175.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -147.8 132.7 18.08 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 114.504 -1.225 . . . . 1.85 109.06 177.218 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.403 ' O ' ' HE3' ' A' ' 31' ' ' LYS . 23.8 t-20 -153.05 125.85 4.05 Favored Pre-proline 0 C--N 1.316 -0.876 0 CA-C-N 116.037 -0.529 . . . . 1.62 109.933 -178.252 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -65.85 -46.44 4.92 Favored 'Trans proline' 0 N--CA 1.474 0.378 0 C-N-CA 123.421 2.747 . . . . 2.05 113.271 -176.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.8 m -66.11 -32.53 74.04 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.293 0.568 . . . . 2.24 110.535 -177.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.403 ' HE3' ' O ' ' A' ' 28' ' ' ASN . 0.8 OUTLIER -78.52 123.66 85.55 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 115.379 -0.828 . . . . 3.33 109.73 178.215 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -48.16 136.25 24.38 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.811 2.341 . . . . 1.8 112.97 178.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.433 ' HA2' ' O ' ' A' ' 95' ' ' TYR . . . -162.64 62.32 0.27 Allowed Glycine 0 N--CA 1.444 -0.809 0 N-CA-C 110.816 -0.914 . . . . 0.97 110.816 179.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -80.09 167.9 19.81 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.006 0.431 . . . . 2.37 110.488 -177.468 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.8 mmtm -102.95 108.44 19.63 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 116.332 -0.395 . . . . 3.13 110.048 178.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.7 p -109.0 171.65 7.31 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 120.774 -0.37 . . . . 1.29 110.826 174.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -61.69 -50.51 72.19 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.801 -0.636 . . . . 1.47 110.937 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.568 ' HG2' ' SD ' ' A' ' 140' ' ' MET . 1.3 mt-30 -56.68 -44.37 81.38 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.714 0.292 . . . . 1.04 110.983 179.115 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.419 ' HB2' ' HA ' ' A' ' 97' ' ' SER . 0.8 OUTLIER -59.42 -56.0 27.52 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.088 -0.505 . . . . 1.39 111.13 -178.53 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -65.54 -33.48 76.02 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.013 -0.539 . . . . 1.75 110.48 -179.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.647 ' CE1' ' HG2' ' A' ' 140' ' ' MET . 61.2 t80 -58.17 -63.89 1.1 Allowed 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.758 -0.656 . . . . 1.2 110.858 178.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.65 -29.61 70.75 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.721 -0.392 . . . . 1.76 110.932 -171.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -62.16 -55.83 24.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.778 -0.646 . . . . 1.47 110.874 -179.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -87.2 -29.63 21.6 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.928 0.394 . . . . 0.53 111.91 -177.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 93.7 t -88.39 -57.66 4.07 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 N-CA-C 112.443 0.534 . . . . 1.11 112.443 -174.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 81.7 t -79.24 -66.27 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 C-N-CA 120.782 -0.367 . . . . 1.07 111.953 -170.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.2 p -67.72 -35.43 72.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 C-N-CA 120.518 -0.473 . . . . 1.44 111.498 -174.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.8 mttt -67.31 -31.31 71.52 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 122.013 -0.43 . . . . 2.85 111.619 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 48.1 m -81.34 -36.88 29.16 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.84 -0.344 . . . . 1.23 110.634 176.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.45 -40.46 71.6 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 108.703 -0.851 . . . . 1.11 108.703 171.326 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 10.5 t-105 -60.14 -37.69 80.84 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.441 -1.254 . . . . 0.44 111.912 178.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -77.23 -5.15 48.21 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.212 0.449 . . . . 2.75 112.212 -172.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.435 ' ND1' HD13 ' A' ' 129' ' ' LEU . 3.1 t-80 -72.62 130.41 40.51 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.672 -0.492 . . . . 0.47 109.672 176.329 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -75.55 -4.76 41.73 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.284 -0.416 . . . . 1.91 111.214 -174.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -100.06 -3.71 31.4 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.203 0.525 . . . . 1.24 109.866 175.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -93.81 10.06 34.67 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.856 -0.611 . . . . 1.09 110.913 -178.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.546 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 48.9 p-90 -65.46 -33.01 6.89 Favored Pre-proline 0 CA--C 1.548 0.889 0 N-CA-C 113.57 0.952 . . . . 0.65 113.57 -175.471 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.546 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 12.7 Cg_exo -71.54 -6.93 20.2 Favored 'Trans proline' 0 C--N 1.365 1.44 0 CA-C-N 121.088 1.424 . . . . 0.61 112.104 177.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -105.97 14.2 28.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.125 0.488 . . . . 1.52 110.137 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 10.4 m-30 -82.0 -11.21 58.95 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.839 -0.618 . . . . 1.01 110.714 179.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -122.19 125.09 26.7 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 116.281 -0.418 . . . . 2.11 111.06 -175.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.624 ' HA ' ' OD1' ' A' ' 82' ' ' ASP . 50.3 Cg_endo -71.07 150.93 61.06 Favored 'Trans proline' 0 C--O 1.236 0.422 0 C-N-CA 122.795 2.33 . . . . 1.1 112.49 -179.116 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 38.3 t -73.34 92.24 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 122.061 0.934 . . . . 1.46 110.395 176.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -87.11 -10.18 53.5 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.683 -1.144 . . . . 1.85 109.229 175.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 76.18 -45.26 0.51 Allowed 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 114.573 -1.194 . . . . 1.43 111.745 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 41.5 mm -80.04 -53.01 13.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 120.751 0.31 . . . . 2.38 110.639 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -53.28 -52.86 57.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.742 -0.663 . . . . 3.34 112.328 -177.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.2 tp -90.66 0.24 57.46 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.26 -0.427 . . . . 2.3 111.108 -177.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 57.23 56.6 5.05 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.688 -0.687 . . . . 1.89 112.083 178.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 7.5 mt -121.21 79.05 34.87 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 115.664 -0.698 . . . . 2.18 110.357 178.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -78.63 -37.52 0.65 Allowed 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.575 2.183 . . . . 1.42 113.131 -175.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.3 p-10 -86.62 -3.96 59.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.284 0.564 . . . . 1.97 110.604 -178.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -58.83 -39.34 80.94 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.328 -0.851 . . . . 1.53 110.496 175.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.404 ' ND1' ' HG2' ' A' ' 80' ' ' PRO . 3.2 m-70 -76.94 0.77 19.82 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.228 -0.896 . . . . 1.22 111.417 -176.584 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.9 mttt -109.81 -41.38 4.53 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.448 -0.342 . . . . 3.34 111.099 -178.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.2 mt -86.43 -49.85 14.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 120.901 0.381 . . . . 1.5 111.082 -178.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 20.0 mm -80.57 131.8 33.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.329 -0.396 . . . . 1.19 110.324 -177.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.4 -56.68 8.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.029 -0.532 . . . . 2.35 111.214 -175.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.431 ' OD1' HG21 ' A' ' 107' ' ' THR . 0.3 OUTLIER -122.27 89.75 49.05 Favored Pre-proline 0 C--N 1.324 -0.538 0 N-CA-C 110.067 -0.345 . . . . 2.05 110.067 178.432 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.404 ' HG2' ' ND1' ' A' ' 74' ' ' HIS . 32.4 Cg_exo -60.99 91.97 0.1 OUTLIER 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 123.038 2.492 . . . . 1.24 112.345 177.617 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 1.7 mmt -134.05 167.29 20.9 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.736 -0.665 . . . . 1.39 109.763 -179.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.624 ' OD1' ' HA ' ' A' ' 62' ' ' PRO . 5.6 p-10 -143.05 -116.71 0.1 Allowed 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.289 -0.869 . . . . 1.42 109.696 -173.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -128.33 -22.95 3.31 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.954 0.407 . . . . 1.14 110.337 177.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -82.75 -23.12 56.77 Favored Glycine 0 N--CA 1.441 -1.026 0 N-CA-C 110.738 -0.945 . . . . 0.33 110.738 -178.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.85 -41.66 22.82 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.304 -0.448 . . . . 1.6 110.552 177.305 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.419 HD11 ' O ' ' A' ' 82' ' ' ASP . 47.0 mt -58.42 -51.0 76.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.827 -0.624 . . . . 1.63 110.153 175.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.418 ' HZ3' ' CD ' ' A' ' 91' ' ' GLU . 0.1 OUTLIER -66.53 -24.68 66.42 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.903 -0.59 . . . . 1.71 111.185 -178.69 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.35 -45.42 76.41 Favored 'General case' 0 C--O 1.23 0.045 0 CA-C-O 120.772 0.32 . . . . 2.93 110.752 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.581 ' HD2' ' CD2' ' A' ' 94' ' ' TYR . 6.3 mtm180 -69.31 -30.54 68.62 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.345 -0.388 . . . . 1.49 110.757 177.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 12.6 mt -70.54 -49.62 46.24 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.441 -0.345 . . . . 1.14 111.284 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.418 ' CD ' ' HZ3' ' A' ' 87' ' ' LYS . 16.4 pt-20 -70.04 -21.53 63.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.812 0.339 . . . . 1.39 111.174 -177.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -96.53 5.66 50.33 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.181 -0.463 . . . . 1.66 110.618 179.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 53.36 54.25 10.46 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.84 -0.618 . . . . 1.75 111.478 178.295 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . 0.581 ' CD2' ' HD2' ' A' ' 89' ' ' ARG . 8.5 t80 -70.67 -44.19 67.56 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.292 -0.413 . . . . 1.3 111.786 -178.448 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.457 ' CD1' ' HB3' ' A' ' 100' ' ' GLU . 0.3 OUTLIER -91.7 -172.35 3.19 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.67 0.748 . . . . 1.72 111.39 -179.272 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -94.59 -42.81 8.61 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 114.132 -1.395 . . . . 1.15 108.898 175.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.419 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 9.4 t -145.95 170.66 16.16 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.014 -0.994 . . . . 1.05 109.619 -176.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -69.16 -12.12 61.4 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.978 0.362 . . . . 1.31 111.978 -174.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.27 -26.76 68.93 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.845 0.355 . . . . 1.12 111.094 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.457 ' HB3' ' CD1' ' A' ' 95' ' ' TYR . 4.4 tp10 -82.13 -22.92 35.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.014 0.435 . . . . 2.44 110.37 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.6 t -76.65 -21.76 55.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.75 -0.659 . . . . 1.24 110.112 178.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -21.18 59.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.798 -0.637 . . . . 1.66 110.778 178.402 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -73.64 -57.18 4.17 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 116.022 -0.536 . . . . 3.72 110.602 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.99 -36.98 80.94 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.042 -0.526 . . . . 1.87 111.005 -176.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -61.19 -39.59 90.74 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.062 0.458 . . . . 0.45 110.847 177.021 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -67.46 -39.37 85.31 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.921 -0.581 . . . . 1.23 110.709 -178.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' THR . . . . . 0.431 HG21 ' OD1' ' A' ' 79' ' ' ASN . 47.5 m -70.69 -39.74 73.3 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.236 -0.438 . . . . 1.09 111.675 -177.444 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.519 ' HG3' ' N ' ' A' ' 109' ' ' PHE . 0.0 OUTLIER -54.05 -37.86 64.59 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.745 0.307 . . . . 1.44 111.278 -178.913 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . 0.519 ' N ' ' HG3' ' A' ' 108' ' ' MET . 7.3 m-85 -76.95 -43.73 34.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.362 -0.381 . . . . 0.29 110.98 -178.218 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -67.19 -39.96 86.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.042 0.449 . . . . 1.33 110.716 -177.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -49.85 -46.53 51.45 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.246 -0.888 . . . . 2.36 111.139 177.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.76 -39.98 91.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.325 -0.398 . . . . 1.09 110.773 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -67.14 -29.85 69.69 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.339 -0.391 . . . . 1.17 111.25 -177.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 37.0 mt -84.64 -54.95 7.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.174 -0.466 . . . . 1.18 111.739 -176.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -67.4 -40.04 85.58 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.763 0.316 . . . . 1.6 110.849 -176.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -97.56 152.74 18.72 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.132 -0.486 . . . . 1.37 110.592 -176.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.52 151.71 85.22 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 116.228 -0.442 . . . . 3.92 110.264 179.282 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -64.49 -7.15 13.52 Favored 'Trans proline' 0 CA--C 1.533 0.435 0 C-N-CA 122.978 2.452 . . . . 1.32 113.068 -177.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -102.46 5.51 39.58 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.793 0.33 . . . . 1.71 111.281 178.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -82.93 155.4 24.06 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.098 0.475 . . . . 1.34 110.851 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . 0.468 ' HB2' ' H ' ' B' ' 315' ' ' ALY . 0.8 OUTLIER -66.82 -40.54 88.05 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.458 -0.792 . . . . 1.44 110.423 -177.342 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.3 tp -62.04 -36.95 77.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.99 -0.55 . . . . 1.16 110.67 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 2.3 t -67.72 -46.38 82.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 109.877 -0.416 . . . . 1.1 109.877 177.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.37 -38.38 74.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.541 -0.754 . . . . 1.22 110.031 178.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' MET . . . . . 0.524 ' O ' HD12 ' A' ' 129' ' ' LEU . 25.9 mtt -69.78 -48.81 57.81 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.309 -0.86 . . . . 1.25 110.785 178.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.27 -40.46 67.85 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.274 -0.421 . . . . 1.1 111.372 -179.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -58.23 -42.54 86.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.021 -0.536 . . . . 2.08 111.039 179.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -77.58 -38.26 48.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.985 0.422 . . . . 1.04 110.66 -179.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.524 HD12 ' O ' ' A' ' 125' ' ' MET . 4.6 mp -56.48 -38.1 71.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.52 -0.764 . . . . 1.16 110.676 177.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -62.23 -23.78 66.86 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.423 -0.808 . . . . 1.47 111.953 -178.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.424 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 1.3 mptt -68.18 -47.57 67.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.69 0.281 . . . . 2.7 110.46 -176.102 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 129' ' ' LEU . 0.1 OUTLIER -71.98 -23.2 21.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.308 -0.405 . . . . 1.79 110.467 179.601 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.531 ' O ' HG22 ' A' ' 137' ' ' VAL . 24.7 t80 -61.56 -62.02 2.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.091 -0.504 . . . . 0.52 110.213 175.136 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 2.2 pp -65.98 -28.41 68.88 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.928 0.394 . . . . 1.26 110.818 -178.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.439 ' HB2' ' HA ' ' A' ' 132' ' ' ILE . 0.1 OUTLIER -54.62 -50.93 66.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.571 -0.741 . . . . 2.07 111.383 178.997 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.28 -24.42 34.71 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.47 -0.786 . . . . 2.11 110.981 -176.236 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.531 HG22 ' O ' ' A' ' 133' ' ' PHE . 41.1 t -74.01 -36.4 44.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.809 -0.632 . . . . 1.09 110.852 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.19 -19.29 65.54 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.081 0.467 . . . . 1.21 110.238 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -100.42 6.04 44.36 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.55 -0.75 . . . . 1.94 110.447 -178.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' MET . . . . . 0.647 ' HG2' ' CE1' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -61.18 150.38 79.43 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 115.865 -0.607 . . . . 1.34 110.898 177.218 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -61.23 103.22 0.24 Allowed 'Trans proline' 0 N--CA 1.461 -0.426 0 C-N-CA 122.161 1.907 . . . . 0.67 110.88 173.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -73.4 3.2 6.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.899 -0.591 . . . . 3.68 112.122 -173.308 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.401 ' O ' ' HB3' ' A' ' 144' ' ' GLU . 0.9 OUTLIER -112.44 -36.72 5.18 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 116.049 -0.523 . . . . 2.7 110.949 -176.148 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.557 ' OE2' ' HB2' ' A' ' 38' ' ' GLN . 5.9 tp10 74.28 135.37 0.05 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 114.991 -1.004 . . . . 2.34 110.845 -178.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 39.5 t -139.39 108.6 3.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.23 -0.896 . . . . 1.66 109.268 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -67.27 130.92 44.64 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.464 -0.569 . . . . 1.53 109.464 177.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 11.1 mt . . . . . 0 C--O 1.252 1.216 0 CA-C-O 118.493 -0.765 . . . . 1.57 110.27 -175.145 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.779 0 N-CA-C 111.655 -0.578 . . . . 2.47 111.655 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 141.67 76.3 0.04 OUTLIER Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.924 -0.655 . . . . 1.97 112.19 -179.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt 61.55 84.02 0.14 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.377 0.608 . . . . 3.98 111.622 176.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 315' ' ' ALY . . . . . 0.468 ' H ' ' HB2' ' A' ' 121' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 316' ' ' LYS . . . . . 0.435 ' HZ2' ' CG ' ' A' ' 121' ' ' ASP . 1.2 ptpm? . . . . . 0 C--O 1.244 0.805 0 CA-C-O 118.428 -0.796 . . . . 4.91 110.38 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo . . . . . 0 N--CA 1.477 0.529 0 N-CA-C 110.548 -0.597 . . . . 6.97 110.548 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 30.1 tp -100.76 151.94 21.08 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.131 -0.322 . . . . 6.2 110.131 178.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 90.73 -47.77 3.01 Favored Glycine 0 N--CA 1.45 -0.387 0 N-CA-C 111.464 -0.654 . . . . 3.98 111.464 -178.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.8 p -81.47 156.17 25.45 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 110.145 -0.317 . . . . 2.49 110.145 175.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.55 ' HG3' ' CE1' ' A' ' 94' ' ' TYR . 12.0 pt-20 -132.13 165.93 22.93 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.5 0.667 . . . . 2.07 110.878 -179.158 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 7.9 p -127.54 -7.48 4.26 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 115.225 -0.898 . . . . 1.5 108.994 176.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -151.47 145.31 25.12 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 114.713 -1.131 . . . . 1.85 108.997 178.574 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.435 ' HB3' ' CB ' ' A' ' 31' ' ' LYS . 11.9 t-20 -156.15 125.52 3.13 Favored Pre-proline 0 C--N 1.314 -0.935 0 CA-C-N 116.568 -0.287 . . . . 1.62 110.41 176.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -73.94 -39.96 1.55 Allowed 'Trans proline' 0 N--CA 1.473 0.308 0 C-N-CA 123.23 2.62 . . . . 2.05 113.231 -178.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.5 m -80.25 -21.03 43.23 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.208 0.528 . . . . 2.24 110.529 -175.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.435 ' CB ' ' HB3' ' A' ' 28' ' ' ASN . 9.2 tttp -74.46 135.45 75.56 Favored Pre-proline 0 C--N 1.319 -0.734 0 CA-C-N 114.917 -1.038 . . . . 3.33 111.027 179.34 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -57.97 137.21 79.74 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.142 1.895 . . . . 1.8 111.49 169.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -173.17 90.93 0.09 OUTLIER Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 111.221 -0.752 . . . . 0.97 111.221 -176.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -110.35 177.9 4.55 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.923 0.392 . . . . 2.37 110.434 -177.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.4 mtpp -108.1 104.38 13.79 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.219 -0.446 . . . . 3.13 110.276 179.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.6 p -99.11 168.52 10.02 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.821 0.343 . . . . 1.29 110.466 177.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.471 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 6.7 t30 -62.08 -40.0 94.32 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 115.932 -0.576 . . . . 1.47 110.35 178.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -67.71 -40.6 84.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.764 0.316 . . . . 1.04 110.883 -178.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.34 -49.83 74.01 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.117 0.484 . . . . 1.39 110.541 179.461 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 21.7 mm100 -70.38 -28.84 65.41 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.739 -0.664 . . . . 1.75 110.587 179.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.485 ' CE1' ' HG2' ' A' ' 140' ' ' MET . 52.7 t80 -59.83 -63.9 1.14 Allowed 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.754 -0.657 . . . . 1.2 110.762 176.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.33 -31.9 69.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.579 0.228 . . . . 1.76 110.462 -174.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.486 ' O ' HG12 ' A' ' 47' ' ' VAL . 9.9 tt0 -56.12 -58.7 6.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.604 -0.726 . . . . 1.47 111.087 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -87.11 -27.19 23.25 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.105 -0.498 . . . . 0.53 112.323 -177.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 97.0 t -89.12 -57.59 4.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 112.347 0.499 . . . . 1.11 112.347 -175.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 60.7 t -80.12 -65.93 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 C-N-CA 120.931 -0.308 . . . . 1.07 111.637 -170.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.486 HG12 ' O ' ' A' ' 43' ' ' GLN . 0.2 OUTLIER -66.1 -37.09 79.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.284 0 C-N-CA 120.7 -0.4 . . . . 1.44 111.266 -174.535 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -36.34 82.94 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.751 0.278 . . . . 2.85 111.751 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.9 m -79.05 -33.44 44.69 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.835 -0.346 . . . . 1.23 110.87 178.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.59 -36.17 83.36 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 121.486 0.66 . . . . 1.11 109.371 174.046 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 12.4 t-105 -61.96 -28.12 69.33 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.127 -0.942 . . . . 0.44 111.272 177.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 37.5 mtpt -92.41 28.81 1.85 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.104 0.478 . . . . 2.75 111.439 -176.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.425 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 14.5 t-80 -103.11 133.87 47.49 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.212 -0.449 . . . . 0.47 110.054 176.1 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.69 -11.4 60.92 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.306 -0.406 . . . . 1.91 111.789 -176.085 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.476 ' CG ' ' HG2' ' A' ' 125' ' ' MET . 0.2 OUTLIER -101.97 -4.46 26.08 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.912 0.387 . . . . 1.24 110.407 178.799 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -94.58 16.39 15.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.201 0.524 . . . . 1.09 110.802 -179.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.589 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 42.1 p-90 -70.44 -30.89 1.99 Allowed Pre-proline 0 CA--C 1.545 0.766 0 N-CA-C 113.706 1.002 . . . . 0.65 113.706 -174.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.589 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 6.4 Cg_exo -76.17 -4.92 15.71 Favored 'Trans proline' 0 C--N 1.359 1.108 0 C-N-CA 121.273 1.315 . . . . 0.61 111.252 172.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -109.15 45.81 1.03 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.246 -0.888 . . . . 1.52 109.893 -176.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.47 ' CE2' ' HA ' ' A' ' 57' ' ' TRP . 11.2 m-30 -120.99 -12.48 8.74 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.502 -0.772 . . . . 1.01 110.987 -176.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -123.28 113.37 29.48 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 116.252 -0.431 . . . . 2.11 110.816 -169.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -56.45 129.81 36.72 Favored 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.418 2.079 . . . . 1.1 111.608 -178.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 20.5 t -65.02 103.39 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.708 0.766 . . . . 1.46 111.188 -176.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -110.21 30.54 6.66 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.029 -0.987 . . . . 1.85 109.283 174.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 55.68 -88.29 0.02 OUTLIER 'General case' 0 C--O 1.226 -0.18 0 CA-C-N 114.687 -1.142 . . . . 1.43 111.716 -178.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 40.7 mm -62.78 -34.47 65.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.475 -0.33 . . . . 2.38 111.397 -173.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -57.81 -29.83 65.23 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.952 -0.567 . . . . 3.34 112.025 -177.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.7 tp -128.06 14.91 6.81 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.864 0.364 . . . . 2.3 110.825 -177.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 61.26 56.08 2.78 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.474 -0.785 . . . . 1.89 111.351 179.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -120.15 71.4 16.68 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 115.959 -0.564 . . . . 2.18 110.564 174.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -84.43 -39.87 0.1 Allowed 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.638 2.225 . . . . 1.42 112.218 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -81.25 -14.69 57.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.337 0.589 . . . . 1.97 109.962 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.41 ' HA ' ' CE1' ' A' ' 115' ' ' TYR . 44.7 t80 -58.74 -40.51 84.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.139 -0.937 . . . . 1.53 110.593 177.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -77.72 1.9 18.53 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.49 -0.777 . . . . 1.22 111.557 -175.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -91.13 -47.42 7.54 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.397 0.618 . . . . 3.34 109.415 178.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.5 mp -88.92 -43.87 15.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.14 -0.936 . . . . 1.5 110.608 -177.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 35.2 mm -87.46 126.78 41.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.027 -0.533 . . . . 1.19 110.449 -178.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.9 mtmt -89.97 -23.34 21.57 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.725 -0.67 . . . . 2.35 110.948 -177.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -123.24 90.47 50.42 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 116.14 -0.482 . . . . 2.05 109.975 179.09 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_endo -67.19 93.44 0.34 Allowed 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.614 2.21 . . . . 1.24 112.5 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 22.4 mmt -125.96 169.59 12.54 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.392 0.615 . . . . 1.39 111.036 -177.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.5 ' CG ' ' H ' ' A' ' 83' ' ' MET . 23.0 t70 -151.06 -142.15 0.12 Allowed 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.18 -1.373 . . . . 1.42 107.349 -177.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' MET . . . . . 0.5 ' H ' ' CG ' ' A' ' 82' ' ' ASP . 0.1 OUTLIER -115.64 -15.17 11.42 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 108.3 -1.0 . . . . 1.14 108.3 176.177 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -80.04 -24.49 59.58 Favored Glycine 0 N--CA 1.441 -0.967 0 N-CA-C 109.653 -1.379 . . . . 0.33 109.653 178.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.99 -34.82 43.8 Favored 'General case' 0 N--CA 1.44 -0.953 0 CA-C-N 114.81 -0.695 . . . . 1.6 110.421 176.306 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 36.4 mm -58.3 -56.76 14.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.325 -0.852 . . . . 1.63 109.996 175.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.25 -34.49 66.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.247 -0.888 . . . . 1.71 110.891 177.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.599 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 0.1 OUTLIER -63.19 -52.98 60.16 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-O 120.599 0.238 . . . . 2.93 111.121 -176.868 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.422 ' HB2' ' HH ' ' A' ' 95' ' ' TYR . 8.0 mmm-85 -64.4 -32.98 74.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.516 -0.311 . . . . 1.49 111.135 -178.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 10.1 mt -69.81 -52.27 26.53 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.275 -0.42 . . . . 1.14 111.162 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -71.78 -26.23 62.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.911 0.386 . . . . 1.39 110.711 -177.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.599 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 1.2 t30 -76.14 -15.6 60.04 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.375 -0.375 . . . . 1.66 110.509 176.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 59.31 54.79 4.56 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 115.544 -0.753 . . . . 1.75 109.712 -176.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . 0.55 ' CE1' ' HG3' ' A' ' 25' ' ' GLU . 25.1 t80 -74.72 -46.58 36.65 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.194 -0.912 . . . . 1.3 111.486 -176.138 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.422 ' HH ' ' HB2' ' A' ' 89' ' ' ARG . 0.1 OUTLIER -107.17 -176.89 3.2 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.212 0.53 . . . . 1.72 111.208 -179.65 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -77.66 -43.34 31.63 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.228 -0.896 . . . . 1.15 111.307 -176.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -147.05 170.12 17.8 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-O 121.154 0.502 . . . . 1.05 111.825 -168.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.54 -10.55 59.66 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.788 -0.642 . . . . 1.31 111.527 -178.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 48.9 m -64.75 -24.09 67.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.273 0.559 . . . . 1.12 110.045 177.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -80.77 -38.56 28.35 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.785 -0.643 . . . . 2.44 110.195 175.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -69.11 -23.4 63.99 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.623 -0.717 . . . . 1.24 111.029 -178.05 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.4 ttm -61.29 -29.9 70.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.195 -0.457 . . . . 1.66 110.282 177.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -73.96 -34.69 64.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.868 -0.605 . . . . 3.72 109.935 178.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -71.78 -47.05 56.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.806 -0.634 . . . . 1.87 110.317 -179.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -55.3 -46.73 76.22 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.808 -0.633 . . . . 0.45 110.634 177.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -59.21 -44.95 92.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.747 -0.661 . . . . 1.23 110.611 178.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 80.9 m -62.2 -46.76 87.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.941 -0.572 . . . . 1.09 111.112 179.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.63 -41.09 69.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.19 -0.459 . . . . 1.44 111.108 178.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -73.06 -45.42 57.52 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.357 -0.383 . . . . 0.29 111.219 -177.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.1 p -67.45 -33.25 74.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.351 -0.386 . . . . 1.33 111.067 -177.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 -49.31 -47.41 47.09 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.643 -0.708 . . . . 2.36 111.192 178.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -65.69 -38.1 88.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.803 -0.635 . . . . 1.09 110.792 -178.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -72.6 -25.83 61.47 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.112 -0.494 . . . . 1.17 111.202 -177.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 62.0 mt -88.32 -50.82 13.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.059 0.457 . . . . 1.18 111.18 -179.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . 0.41 ' CE1' ' HA ' ' A' ' 73' ' ' TYR . 63.8 t80 -70.9 -34.87 71.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.136 -0.484 . . . . 1.6 111.495 -175.537 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 44.0 m-20 -110.85 157.81 19.42 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.891 0.377 . . . . 1.37 111.542 -172.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.529 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 0.2 OUTLIER -74.3 149.8 87.02 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 115.771 -0.65 . . . . 3.92 110.767 -177.468 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -62.24 -16.64 52.33 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.933 2.422 . . . . 1.32 112.976 -178.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.52 6.42 48.14 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.994 0.426 . . . . 1.71 111.25 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . 0.529 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 0.5 OUTLIER -78.56 157.39 28.8 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 116.162 -0.472 . . . . 1.34 110.618 -178.414 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -67.5 -42.16 83.33 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.598 -0.728 . . . . 1.44 110.345 -177.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 5.5 tp -60.29 -35.84 64.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.972 -0.558 . . . . 1.16 111.009 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 2.4 t -68.97 -45.76 79.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.963 -0.384 . . . . 1.1 109.963 178.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.82 -29.69 67.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.906 -0.588 . . . . 1.22 110.13 177.617 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' MET . . . . . 0.476 ' HG2' ' CG ' ' A' ' 55' ' ' PHE . 32.8 mtt -76.42 -42.21 44.97 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.376 -0.829 . . . . 1.25 110.654 178.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.38 -45.17 72.77 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.073 -0.512 . . . . 1.1 112.095 -177.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.44 -44.18 92.97 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.913 0.387 . . . . 2.08 110.86 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -68.38 -37.69 80.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 1.04 110.627 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.475 HD12 ' N ' ' A' ' 129' ' ' LEU . 5.0 mp -64.83 -40.93 95.99 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.394 -0.821 . . . . 1.16 110.734 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -59.27 -24.75 63.51 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.662 -0.699 . . . . 1.47 111.849 -176.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.566 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -62.66 -44.0 97.37 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 110.158 -0.312 . . . . 2.7 110.158 -177.895 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . 0.5 HG21 HD11 ' A' ' 132' ' ' ILE . 22.1 mt -66.96 -35.61 75.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.128 -0.487 . . . . 1.79 110.343 -179.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.558 ' O ' HG22 ' A' ' 137' ' ' VAL . 36.1 t80 -59.89 -62.71 1.67 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.819 -0.628 . . . . 0.52 110.77 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 2.0 pp -64.74 -28.38 69.55 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.954 0.407 . . . . 1.26 110.782 -177.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.566 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.3 OUTLIER -60.82 -51.72 68.14 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.673 -0.694 . . . . 2.07 111.024 178.992 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.36 -26.51 35.47 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.852 -0.613 . . . . 2.11 110.885 -175.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.558 HG22 ' O ' ' A' ' 133' ' ' PHE . 52.4 t -68.86 -29.7 44.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.128 0.489 . . . . 1.09 110.262 176.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.51 -14.77 63.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.162 -0.472 . . . . 1.21 110.531 177.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -106.88 -0.57 23.17 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.895 -0.593 . . . . 1.94 110.325 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' MET . . . . . 0.485 ' HG2' ' CE1' ' A' ' 41' ' ' TYR . 0.3 OUTLIER -70.07 147.29 95.63 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 115.874 -0.603 . . . . 1.34 110.752 -178.287 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.463 ' C ' ' H ' ' A' ' 143' ' ' GLU . 50.6 Cg_endo -86.18 79.95 1.85 Allowed 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 122.308 2.005 . . . . 0.67 111.324 178.118 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -76.08 21.39 0.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.273 0.558 . . . . 3.68 111.234 -177.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.463 ' H ' ' C ' ' A' ' 141' ' ' PRO . 2.4 mt-10 -90.62 -32.92 16.06 Favored 'General case' 0 N--CA 1.439 -0.982 0 N-CA-C 108.218 -1.031 . . . . 2.7 108.218 170.41 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 75.18 113.03 0.07 Allowed 'General case' 0 C--O 1.228 -0.064 0 CA-C-N 113.569 -1.651 . . . . 2.34 111.227 176.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 15.3 t -125.83 116.73 47.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.825 -0.625 . . . . 1.66 109.613 176.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -73.62 147.11 44.11 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.724 0.297 . . . . 1.53 110.499 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 64.6 mt . . . . . 0 C--O 1.247 0.931 0 CA-C-O 118.834 -0.603 . . . . 1.57 109.991 179.521 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.758 0 N-CA-C 112.173 -0.371 . . . . 2.47 112.173 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . -175.96 -80.98 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.511 0 N-CA-C 111.064 -0.814 . . . . 1.97 111.064 178.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 8.0 tmtm? -93.02 127.56 38.59 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.783 -0.821 . . . . 3.98 108.783 172.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 315' ' ' ALY . . . . . 0.442 ' HE3' ' CH2' ' A' ' 57' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.152 -0.928 . . . . 4.91 109.639 -177.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo . . . . . 0 N--CA 1.482 0.816 0 N-CA-C 110.506 -0.613 . . . . 6.97 110.506 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -101.98 42.91 1.1 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.796 0.331 . . . . 6.2 110.342 -178.5 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.9 60.89 3.02 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.492 -0.861 . . . . 3.98 111.083 -174.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.3 p 58.55 176.77 0.07 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.378 0.671 . . . . 2.49 111.8 -173.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.713 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 4.1 mt-10 -53.56 123.72 12.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.177 -0.465 . . . . 2.07 111.236 174.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.4 p -99.9 -14.48 7.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 121.216 0.531 . . . . 1.5 110.387 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -178.44 154.01 0.77 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.341 -0.845 . . . . 1.85 109.661 177.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.516 ' HB3' ' HB2' ' A' ' 31' ' ' LYS . 42.8 t-20 -160.53 124.38 2.0 Allowed Pre-proline 0 C--N 1.318 -0.779 0 CA-C-N 115.846 -0.616 . . . . 1.62 109.52 -179.397 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -65.06 -33.87 48.96 Favored 'Trans proline' 0 N--CA 1.48 0.729 0 C-N-CA 123.407 2.738 . . . . 2.05 112.994 -177.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.4 t -74.3 -20.7 60.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.577 0.703 . . . . 2.24 109.678 -179.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.516 ' HB2' ' HB3' ' A' ' 28' ' ' ASN . 2.1 tttp -87.11 134.75 36.03 Favored Pre-proline 0 C--N 1.319 -0.736 0 CA-C-N 115.0 -1.0 . . . . 3.33 109.755 178.464 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.487 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 35.9 Cg_endo -65.66 137.72 51.14 Favored 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.256 1.971 . . . . 1.8 112.317 177.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -153.88 109.27 0.4 Allowed Glycine 0 N--CA 1.442 -0.939 0 N-CA-C 110.788 -0.925 . . . . 0.97 110.788 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -123.81 155.77 37.36 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.789 0.328 . . . . 2.37 110.57 -176.312 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.62 84.36 5.04 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.191 0.52 . . . . 3.13 110.292 176.486 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.465 ' HA ' ' HA ' ' A' ' 146' ' ' GLU . 1.2 p -92.02 165.55 13.13 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.228 -0.442 . . . . 1.29 110.826 -179.225 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.421 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 64.0 t30 -63.99 -40.88 97.38 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.282 -0.417 . . . . 1.47 110.591 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -64.51 -38.97 92.86 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 110.203 -0.295 . . . . 1.04 110.203 177.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.483 ' O ' ' HG3' ' A' ' 43' ' ' GLN . 0.7 OUTLIER -63.52 -55.68 22.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.916 -0.584 . . . . 1.39 110.501 178.838 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.476 ' HA ' ' OE1' ' A' ' 43' ' ' GLN . 2.7 mm-40 -63.81 -31.53 72.73 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.966 -0.561 . . . . 1.75 110.891 -179.166 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.421 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 63.8 t80 -53.57 -62.68 1.5 Allowed 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.52 -0.764 . . . . 1.2 110.922 176.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 3.5 ttm -59.07 -29.98 67.73 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.428 -0.351 . . . . 1.76 111.645 -173.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.483 ' HG3' ' O ' ' A' ' 39' ' ' LEU . 24.9 mt-30 -60.12 -58.56 7.98 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.097 0.475 . . . . 1.47 110.502 178.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -84.27 -29.7 26.23 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.702 -0.681 . . . . 0.53 111.534 -174.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 97.9 t -87.9 -56.63 5.02 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 N-CA-C 112.336 0.495 . . . . 1.11 112.336 -175.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 53.6 t -83.03 -67.26 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 112.076 0.399 . . . . 1.07 112.076 -171.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.419 HG11 ' O ' ' A' ' 43' ' ' GLN . 2.5 p -72.76 -34.13 46.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 C-N-CA 120.822 -0.351 . . . . 1.44 111.7 -171.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 43' ' ' GLN . 0.0 OUTLIER -61.48 -35.4 77.55 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.778 0.323 . . . . 2.85 110.779 179.196 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 27.3 m -80.75 -37.77 29.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.454 -0.339 . . . . 1.23 110.878 178.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.47 -40.78 95.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.903 0.383 . . . . 1.11 110.03 177.417 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 23.2 t-105 -64.73 -31.63 72.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.932 -0.576 . . . . 0.44 111.385 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.6 mttt -79.74 -9.83 59.7 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 111.815 0.302 . . . . 2.75 111.815 -175.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.414 ' ND1' HD12 ' A' ' 129' ' ' LEU . 10.5 t-80 -69.1 129.67 40.56 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.588 -0.523 . . . . 0.47 109.588 176.234 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -81.34 9.4 7.23 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.938 0.399 . . . . 1.91 111.658 -173.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -110.45 -3.52 16.02 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.303 0.573 . . . . 1.24 109.626 173.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -92.79 9.11 36.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.607 -0.724 . . . . 1.09 110.642 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.467 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 55.9 p-90 -64.31 -31.43 5.93 Favored Pre-proline 0 CA--C 1.546 0.803 0 N-CA-C 113.954 1.094 . . . . 0.65 113.954 -175.313 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.467 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 10.8 Cg_exo -73.11 -4.4 15.35 Favored 'Trans proline' 0 C--N 1.363 1.324 0 CA-C-N 121.151 1.447 . . . . 0.61 111.946 176.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -110.19 19.38 18.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.173 0.511 . . . . 1.52 110.008 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -85.84 -8.86 57.81 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.722 -0.672 . . . . 1.01 110.434 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.09 131.42 19.78 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.282 -0.417 . . . . 2.11 110.877 -172.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -67.58 154.74 72.68 Favored 'Trans proline' 0 C--O 1.236 0.398 0 C-N-CA 122.689 2.26 . . . . 1.1 113.044 -178.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 9.4 t -97.61 101.94 12.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.672 -0.694 . . . . 1.46 109.491 -178.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -108.48 7.33 26.83 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.619 -0.719 . . . . 1.85 110.84 -178.26 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 86.05 -21.62 0.21 Allowed 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 114.737 -1.12 . . . . 1.43 112.29 178.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.7 mt -113.11 -42.69 4.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 O-C-N 122.224 -0.297 . . . . 2.38 111.105 -178.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 53.7 tptt -52.91 -54.61 32.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.14 -0.482 . . . . 3.34 110.975 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 9.4 tp -93.48 2.01 56.6 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.263 -0.426 . . . . 2.3 110.605 178.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . 0.43 ' O ' HD12 ' A' ' 70' ' ' LEU . 3.4 t-20 56.29 71.78 0.54 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.618 -0.719 . . . . 1.89 110.648 -177.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.533 ' HG ' ' CD1' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -132.35 75.01 74.98 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.168 -0.924 . . . . 2.18 109.921 -175.614 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -73.17 -37.06 3.65 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.561 2.174 . . . . 1.42 113.416 -173.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -91.48 -0.91 57.67 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.244 0.545 . . . . 1.97 110.937 -176.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.533 ' CD1' ' HG ' ' A' ' 70' ' ' LEU . 0.9 OUTLIER -65.71 -43.34 89.44 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.491 -0.777 . . . . 1.53 110.768 179.369 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -76.86 10.41 2.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.664 -0.698 . . . . 1.22 112.006 -173.573 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.6 mmtt -97.87 -47.85 5.4 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.125 -0.694 . . . . 3.34 109.125 176.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.7 mp -89.09 -52.63 10.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.322 -0.854 . . . . 1.5 110.608 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.9 mm -91.01 97.43 7.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.043 0.449 . . . . 1.19 109.879 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.3 mtmt -75.04 -11.19 60.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.887 -0.597 . . . . 2.35 111.13 -177.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -122.13 82.67 44.64 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 115.985 -0.552 . . . . 2.05 110.212 177.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -76.71 72.7 5.57 Favored 'Trans proline' 0 CA--C 1.53 0.28 0 C-N-CA 122.91 2.406 . . . . 1.24 112.016 -178.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -110.06 154.39 23.29 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.49 0.662 . . . . 1.39 110.924 -175.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.437 ' O ' HG12 ' A' ' 86' ' ' ILE . 13.9 p-10 -133.61 -129.21 0.17 Allowed 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 114.635 -1.166 . . . . 1.42 109.23 -173.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -120.44 -18.21 7.94 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.514 -0.55 . . . . 1.14 109.514 177.322 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -78.41 -35.59 32.79 Favored Glycine 0 N--CA 1.439 -1.13 0 N-CA-C 109.642 -1.383 . . . . 0.33 109.642 177.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 23.4 m -71.68 -35.54 70.31 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.254 -0.473 . . . . 1.6 110.63 174.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.437 HG12 ' O ' ' A' ' 82' ' ' ASP . 0.2 OUTLIER -62.83 -52.88 53.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.256 -0.646 . . . . 1.63 109.256 176.914 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.68 -25.5 67.36 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.945 -0.57 . . . . 1.71 111.104 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.456 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 14.9 tttp -68.54 -51.43 42.97 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 120.518 0.199 . . . . 2.93 110.65 179.386 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 11.4 mtp180 -66.54 -28.8 68.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.911 0.386 . . . . 1.49 110.683 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.711 ' HG ' ' SG ' ' A' ' 101' ' ' CYS . 5.6 mt -66.44 -58.55 5.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.936 -0.574 . . . . 1.14 110.96 173.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -68.19 -22.94 64.79 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.204 -0.453 . . . . 1.39 111.384 -176.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.456 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 7.6 t30 -89.38 -7.32 55.48 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.294 -0.412 . . . . 1.66 110.715 178.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 56.76 67.0 1.05 Allowed 'General case' 0 N--CA 1.464 0.251 0 O-C-N 123.648 0.593 . . . . 1.75 110.713 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . 0.713 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 14.1 t80 -77.87 -32.25 51.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.556 -0.747 . . . . 1.3 111.664 -178.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.419 ' CE2' ' HD2' ' A' ' 94' ' ' TYR . 0.0 OUTLIER -127.68 -172.72 2.74 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.612 0.72 . . . . 1.72 111.717 -175.897 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . 0.487 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 2.2 t-105 -76.17 -59.8 2.61 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 114.236 -1.347 . . . . 1.15 111.087 -177.283 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 8.2 m -128.31 166.37 18.75 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.999 0.428 . . . . 1.05 111.567 -172.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -70.5 -12.56 61.65 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.297 -0.411 . . . . 1.31 111.358 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -62.13 -22.79 66.13 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.387 0.613 . . . . 1.12 109.887 174.499 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -81.14 -44.95 17.15 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.411 -0.813 . . . . 2.44 110.348 176.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . 0.711 ' SG ' ' HG ' ' A' ' 90' ' ' LEU . 1.6 t -69.49 -25.21 63.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.106 -0.497 . . . . 1.24 111.53 -176.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.1 ptm -66.74 -16.75 64.46 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.637 -0.425 . . . . 1.66 110.292 177.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -78.5 -44.01 25.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 3.72 110.594 177.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . 0.559 ' OD1' ' HA ' ' A' ' 101' ' ' CYS . 0.4 OUTLIER -75.07 -31.27 61.21 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.847 -0.427 . . . . 1.87 109.847 177.95 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -54.71 -51.54 65.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.807 -0.633 . . . . 0.45 109.945 170.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 -60.43 -46.01 91.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.398 -0.819 . . . . 1.23 110.026 176.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 63.3 m -54.69 -45.97 74.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.595 -0.73 . . . . 1.09 111.742 -177.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -54.26 -45.68 72.48 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 120.769 0.318 . . . . 1.44 110.73 176.094 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -64.94 -47.3 78.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.834 -0.621 . . . . 0.29 111.049 -178.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.31 -41.29 96.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.944 0.402 . . . . 1.33 110.686 -178.644 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -52.06 -46.05 64.98 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.374 -0.83 . . . . 2.36 110.547 177.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . 0.478 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 0.0 OUTLIER -70.32 -37.74 74.78 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.92 -0.582 . . . . 1.09 110.855 -178.68 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -71.7 -32.77 68.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.625 -0.261 . . . . 1.17 111.353 -177.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 76.9 mt -73.32 -57.98 5.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.531 -0.304 . . . . 1.18 111.33 -177.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -70.32 -41.55 73.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.381 -0.372 . . . . 1.6 111.318 -174.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . 0.478 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 71.7 m-80 -86.28 168.14 14.18 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.926 0.393 . . . . 1.37 111.031 -174.273 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.04 147.27 83.4 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.984 -0.553 . . . . 3.92 110.397 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_endo -60.35 -21.24 66.52 Favored 'Trans proline' 0 C--N 1.343 0.241 0 C-N-CA 122.447 2.098 . . . . 1.32 111.959 177.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.15 34.82 4.79 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.059 -0.519 . . . . 1.71 110.638 176.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . 0.51 ' OD1' ' HA2' ' B' ' 313' ' ' GLY . 2.3 t70 -83.84 167.48 17.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.882 -0.599 . . . . 1.34 110.673 179.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -67.28 -49.67 63.4 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.868 -0.605 . . . . 1.44 110.49 -177.285 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -64.3 -40.05 87.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.046 -0.525 . . . . 1.16 110.655 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.455 ' O ' HG12 ' A' ' 123' ' ' VAL . 6.6 t -65.45 -38.68 83.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.057 0.456 . . . . 1.1 110.681 -179.75 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.31 -28.29 68.0 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.029 -0.532 . . . . 1.22 110.276 177.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 3.1 mtt -82.52 -44.98 15.26 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.764 -0.653 . . . . 1.25 110.582 177.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.41 -33.24 58.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.679 -0.691 . . . . 1.1 111.697 -179.21 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -59.21 -45.87 89.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.373 -0.376 . . . . 2.08 110.986 178.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -73.86 -35.5 64.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.104 -0.498 . . . . 1.04 110.509 179.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.414 HD12 ' ND1' ' A' ' 53' ' ' HIS . 5.6 mp -61.37 -46.14 91.44 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.42 -0.809 . . . . 1.16 110.615 179.132 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -62.7 -23.87 67.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.321 -0.854 . . . . 1.47 111.831 -176.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.544 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -62.97 -49.63 73.97 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 109.914 -0.402 . . . . 2.7 109.914 -176.77 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.94 -30.09 45.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.953 -0.567 . . . . 1.79 110.481 179.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.562 ' O ' HG22 ' A' ' 137' ' ' VAL . 34.8 t80 -61.72 -62.88 1.49 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.984 -0.553 . . . . 0.52 110.99 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.8 pp -66.62 -29.91 70.05 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.821 0.343 . . . . 1.26 110.534 -175.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.544 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.3 OUTLIER -63.39 -48.79 76.41 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.623 -0.717 . . . . 2.07 111.203 -179.549 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 2.8 mttm -80.89 -14.03 58.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.403 -0.362 . . . . 2.11 111.285 -177.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.562 HG22 ' O ' ' A' ' 133' ' ' PHE . 30.9 t -82.53 -34.99 12.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.052 0.453 . . . . 1.09 109.882 178.025 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -66.44 -19.38 65.78 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.197 0.522 . . . . 1.21 110.432 178.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -100.05 10.61 41.01 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.991 -0.55 . . . . 1.94 111.172 -179.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -61.21 152.08 73.46 Favored Pre-proline 0 N--CA 1.466 0.341 0 CA-C-N 116.267 -0.424 . . . . 1.34 111.055 175.167 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -68.61 121.38 8.3 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.384 2.056 . . . . 0.67 112.074 179.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -71.97 1.95 6.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.32 -0.4 . . . . 3.68 112.065 -176.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -97.69 -41.3 8.17 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 116.387 -0.37 . . . . 2.7 111.678 -171.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 60.55 65.7 1.02 Allowed 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.66 0.6 . . . . 2.34 109.979 -175.553 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 16.6 t -98.21 127.78 50.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.699 -0.682 . . . . 1.66 110.294 -177.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.465 ' HA ' ' HA ' ' A' ' 36' ' ' THR . 8.8 tt0 -71.24 138.86 49.79 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.892 -0.41 . . . . 1.53 109.892 175.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 40.7 mt . . . . . 0 C--O 1.247 0.953 0 CA-C-O 118.395 -0.812 . . . . 1.57 110.516 -176.146 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.564 0 N-CA-C 111.453 -0.659 . . . . 2.47 111.453 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 313' ' ' GLY . . . . . 0.51 ' HA2' ' OD1' ' A' ' 120' ' ' ASP . . . 97.39 -5.51 62.77 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.705 -0.759 . . . . 1.97 112.897 178.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -143.12 125.83 15.98 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.654 0.264 . . . . 3.98 110.626 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.178 0 CA-C-N 115.421 -0.808 . . . . 4.91 110.653 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo . . . . . 0 N--CA 1.481 0.747 0 N-CA-C 109.919 -0.839 . . . . 6.97 109.919 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.92 144.17 33.03 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.978 -0.379 . . . . 6.2 109.978 177.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 145.89 -115.7 0.84 Allowed Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.926 -0.654 . . . . 3.98 111.743 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -144.96 173.3 11.99 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.919 -0.4 . . . . 2.49 109.919 178.074 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.586 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 3.5 mt-10 -55.3 122.82 11.96 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 121.066 0.46 . . . . 2.07 111.555 175.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.7 p -106.98 -18.57 7.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.653 -0.703 . . . . 1.5 110.158 177.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 73.1 m -166.95 142.57 4.26 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.551 -0.749 . . . . 1.85 109.347 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.456 ' HB3' ' CB ' ' A' ' 31' ' ' LYS . 34.8 t-20 -145.97 127.91 7.73 Favored Pre-proline 0 C--N 1.319 -0.754 0 N-CA-C 109.663 -0.495 . . . . 1.62 109.663 178.366 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -63.42 -36.12 57.06 Favored 'Trans proline' 0 N--CA 1.478 0.587 0 C-N-CA 123.224 2.616 . . . . 2.05 112.783 -177.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.5 m -80.35 -19.68 45.89 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 115.576 -0.738 . . . . 2.24 110.324 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.456 ' CB ' ' HB3' ' A' ' 28' ' ' ASN . 11.1 tttp -90.33 129.27 46.02 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.114 -0.948 . . . . 3.33 110.254 179.324 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.438 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 35.6 Cg_endo -69.17 135.72 32.63 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 121.96 1.773 . . . . 1.8 112.284 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -145.46 86.05 0.18 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.317 -0.856 . . . . 0.97 111.002 -178.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.49 ' HG3' ' CE2' ' A' ' 96' ' ' TRP . 1.7 mmm180 -97.97 163.38 12.8 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.879 0.371 . . . . 2.37 110.498 -176.161 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.3 mtmt -104.93 108.92 20.69 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.084 -0.507 . . . . 3.13 110.121 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.3 p -111.94 166.89 10.82 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.889 0.376 . . . . 1.29 110.864 176.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.524 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 60.3 t30 -59.75 -37.41 78.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.928 -0.578 . . . . 1.47 110.893 178.249 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -71.07 -37.47 72.48 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.854 0.359 . . . . 1.04 110.409 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.18 -53.27 55.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.117 -0.492 . . . . 1.39 110.557 178.507 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -69.48 -21.43 63.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.093 -0.503 . . . . 1.75 110.81 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.524 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 52.8 t80 -64.36 -63.41 1.15 Allowed 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.003 -0.544 . . . . 1.2 110.868 178.307 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -57.91 -31.45 66.79 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.534 -0.303 . . . . 1.76 110.867 -174.633 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.449 ' O ' HG12 ' A' ' 47' ' ' VAL . 13.9 tt0 -59.69 -55.24 36.83 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.909 -0.587 . . . . 1.47 111.209 178.097 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -86.56 -28.89 23.04 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 112.28 0.474 . . . . 0.53 112.28 -176.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 95.1 t -89.23 -57.51 4.19 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 N-CA-C 112.479 0.548 . . . . 1.11 112.479 -175.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 39.7 t -81.47 -65.63 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 111.739 0.274 . . . . 1.07 111.739 -169.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.449 HG12 ' O ' ' A' ' 43' ' ' GLN . 2.6 p -67.53 -34.26 67.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 C-N-CA 120.851 -0.34 . . . . 1.44 111.548 -174.253 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.4 mmtt -60.03 -39.5 86.08 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 122.243 -0.285 . . . . 2.85 111.574 177.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.3 m -75.97 -36.12 59.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.67 0.272 . . . . 1.23 110.713 178.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.88 -37.51 79.58 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.406 0.622 . . . . 1.11 109.541 174.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 16.7 t-105 -63.9 -27.36 69.1 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.041 -0.982 . . . . 0.44 112.096 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.1 mtpt -88.97 0.79 56.34 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.038 0.384 . . . . 2.75 112.038 -174.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.411 ' ND1' ' HB2' ' A' ' 55' ' ' PHE . 8.7 t-80 -76.76 134.51 39.13 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.893 -0.41 . . . . 0.47 109.893 177.028 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 40.1 mm-40 -72.42 -13.39 61.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.417 -0.356 . . . . 1.91 111.743 -175.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.411 ' HB2' ' ND1' ' A' ' 53' ' ' HIS . 3.1 m-85 -96.08 -1.79 47.97 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.152 0.501 . . . . 1.24 110.341 178.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -97.28 13.9 27.91 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.411 0.624 . . . . 1.09 110.311 -179.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.619 ' HA ' ' CE2' ' A' ' 60' ' ' TYR . 54.3 p-90 -65.91 -33.6 7.45 Favored Pre-proline 0 CA--C 1.545 0.775 0 N-CA-C 113.787 1.032 . . . . 0.65 113.787 -174.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.482 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 1.3 Cg_endo -85.13 12.0 3.2 Favored 'Trans proline' 0 C--N 1.359 1.115 0 C-N-CA 121.695 1.597 . . . . 0.61 111.325 176.682 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -110.57 -0.39 17.32 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.389 -0.823 . . . . 1.52 110.781 -177.241 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.619 ' CE2' ' HA ' ' A' ' 57' ' ' TRP . 16.3 m-30 -82.21 -23.24 35.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.878 0.37 . . . . 1.01 111.179 -178.318 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.98 127.53 27.82 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.214 -0.448 . . . . 2.11 110.717 -174.373 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.408 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 45.4 Cg_endo -69.79 158.22 57.65 Favored 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 122.835 2.357 . . . . 1.1 112.843 -177.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 41.7 t -77.07 94.45 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.618 0.723 . . . . 1.46 110.167 178.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.82 -10.24 40.54 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.103 -0.953 . . . . 1.85 110.507 178.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 80.37 -32.27 0.12 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.882 0.873 . . . . 1.43 112.646 176.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 24.0 mt -99.94 -57.24 4.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 O-C-N 122.122 -0.361 . . . . 2.38 111.724 -175.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.99 -33.46 75.62 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.98 0.419 . . . . 3.34 110.92 -176.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 2.8 tp -90.27 -5.85 55.84 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.121 -0.49 . . . . 2.3 110.843 177.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 57.44 57.15 4.55 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.843 -0.617 . . . . 1.89 111.242 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.402 ' O ' ' HB2' ' A' ' 73' ' ' TYR . 25.9 mt -129.07 64.51 71.07 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.564 -0.744 . . . . 2.18 110.812 176.486 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -77.23 -27.74 6.37 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.322 2.015 . . . . 1.42 111.891 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -84.52 2.98 38.65 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.653 -0.703 . . . . 1.97 110.114 -179.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.525 ' HH ' HH32 ' B' ' 312' ' ' ALY . 1.5 t80 -65.19 -45.46 84.71 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.418 -0.81 . . . . 1.53 110.929 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -78.45 5.97 9.54 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.595 -0.73 . . . . 1.22 111.59 -172.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.0 mmmt -89.77 -22.84 21.95 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 108.989 -0.745 . . . . 3.34 108.989 178.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 53.6 mt -118.3 -56.09 3.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 CA-C-N 115.257 -0.883 . . . . 1.5 110.332 179.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 37.5 mm -88.83 107.46 17.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.959 -0.564 . . . . 1.19 110.564 -177.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.95 -10.43 59.27 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.895 -0.593 . . . . 2.35 110.889 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -117.58 82.94 16.45 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.004 -0.544 . . . . 2.05 110.109 176.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -76.32 91.05 1.14 Allowed 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.755 2.304 . . . . 1.24 112.0 -176.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -129.94 171.22 12.99 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.457 0.646 . . . . 1.39 111.245 -175.016 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.432 ' O ' HG12 ' A' ' 86' ' ' ILE . 12.9 p-10 -153.98 -134.81 0.05 OUTLIER 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.519 -1.219 . . . . 1.42 108.248 -174.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.2 ttm -113.25 -19.92 11.6 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.123 -0.695 . . . . 1.14 109.123 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.413 ' O ' ' HB2' ' A' ' 88' ' ' LYS . . . -79.81 -30.88 41.84 Favored Glycine 0 N--CA 1.44 -1.093 0 N-CA-C 109.863 -1.295 . . . . 0.33 109.863 178.006 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 28.5 m -77.14 -29.83 54.82 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.441 -0.379 . . . . 1.6 111.047 174.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.442 HD12 ' HB2' ' A' ' 104' ' ' ASP . 0.2 OUTLIER -65.52 -51.7 60.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 109.305 -0.628 . . . . 1.63 109.305 177.076 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.537 ' O ' ' HG2' ' A' ' 91' ' ' GLU . 0.0 OUTLIER -63.91 -27.35 69.09 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.156 -0.474 . . . . 1.71 110.164 177.548 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.539 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 0.8 OUTLIER -63.09 -52.27 63.31 Favored 'General case' 0 C--O 1.227 -0.09 0 CA-C-N 116.129 -0.487 . . . . 2.93 110.616 177.454 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.2 mmm-85 -63.91 -33.88 76.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.748 0.309 . . . . 1.49 110.724 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.8 mt -66.58 -57.89 6.31 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.936 -0.575 . . . . 1.14 111.598 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 11.4 pt-20 -78.55 -14.99 59.07 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.197 0.443 . . . . 1.39 112.197 -173.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.539 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 1.0 OUTLIER -90.41 -4.02 57.3 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 110.058 -0.349 . . . . 1.66 110.058 174.977 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.49 58.99 2.75 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.408 -0.815 . . . . 1.75 111.347 179.361 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . 0.586 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 24.7 t80 -71.85 -45.12 62.46 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.999 0.428 . . . . 1.3 110.773 179.349 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -108.59 -171.71 1.91 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.9 -0.591 . . . . 1.72 110.896 -175.263 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . 0.49 ' CE2' ' HG3' ' A' ' 34' ' ' ARG . 2.0 t90 -86.9 -41.59 13.86 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.556 -0.747 . . . . 1.15 110.394 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 28.6 t -148.96 175.67 11.09 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.255 0.55 . . . . 1.05 111.62 -172.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.0 -10.93 59.94 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.618 -0.719 . . . . 1.31 110.653 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.66 -33.25 72.54 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.792 0.806 . . . . 1.12 109.493 173.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -82.19 -35.31 28.46 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 114.647 -1.16 . . . . 2.44 110.144 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . 0.504 ' HA ' ' OD1' ' A' ' 104' ' ' ASP . 48.5 t -64.76 -24.61 67.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.984 -0.553 . . . . 1.24 110.709 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.5 mtt -59.73 -25.9 65.2 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.079 -0.509 . . . . 1.66 110.282 176.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.61 -47.36 26.92 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.025 -0.534 . . . . 3.72 110.896 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . 0.504 ' OD1' ' HA ' ' A' ' 101' ' ' CYS . 0.2 OUTLIER -70.77 -37.21 73.36 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.806 -0.357 . . . . 1.87 110.472 -179.367 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -56.09 -48.22 76.53 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.153 0.502 . . . . 0.45 110.043 173.543 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -64.54 -47.29 79.33 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.619 -0.719 . . . . 1.23 110.508 177.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 90.1 m -52.27 -45.4 65.44 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.372 -0.376 . . . . 1.09 111.332 -178.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 6.2 ttp -54.64 -38.97 67.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.348 -0.387 . . . . 1.44 111.453 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -78.78 -51.82 9.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.739 0.304 . . . . 0.29 110.605 -175.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.45 -39.72 73.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.171 -0.468 . . . . 1.33 111.165 178.267 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -53.82 -49.3 68.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.073 -0.512 . . . . 2.36 110.964 178.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.46 -38.16 90.04 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 116.391 -0.368 . . . . 1.09 110.612 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -67.85 -33.19 74.28 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.288 -0.414 . . . . 1.17 111.135 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 70.0 mt -80.79 -50.65 16.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.36 -0.382 . . . . 1.18 111.971 -176.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . 0.43 ' CE1' ' HA ' ' A' ' 73' ' ' TYR . 64.3 t80 -68.3 -34.37 76.02 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.862 0.363 . . . . 1.6 111.154 -175.491 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 -98.7 -163.73 1.07 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.991 -0.549 . . . . 1.37 110.892 -175.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.67 156.51 44.72 Favored Pre-proline 0 C--N 1.325 -0.464 0 N-CA-C 109.999 -0.371 . . . . 3.92 109.999 179.545 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -59.41 -21.64 62.16 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.333 2.022 . . . . 1.32 111.99 176.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.94 8.64 42.17 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.55 -0.75 . . . . 1.71 111.56 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . 0.534 ' OD2' ' HA2' ' B' ' 313' ' ' GLY . 3.3 t70 -76.04 155.98 34.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.186 0.517 . . . . 1.34 111.401 -175.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.47 -42.73 74.45 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.144 -0.935 . . . . 1.44 109.889 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.462 HG23 ' OD1' ' A' ' 120' ' ' ASP . 2.4 tp -66.17 -33.75 65.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 115.977 -0.556 . . . . 1.16 110.535 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 2.8 t -69.94 -41.4 79.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.128 0.49 . . . . 1.1 110.131 177.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.29 -33.52 71.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.92 -0.582 . . . . 1.22 109.968 177.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' MET . . . . . 0.493 ' O ' HD11 ' A' ' 129' ' ' LEU . 21.5 mtt -76.49 -46.6 26.0 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.524 -0.762 . . . . 1.25 110.746 178.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -52.83 -36.71 59.02 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.284 -0.416 . . . . 1.1 111.634 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -60.73 -39.11 87.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.132 -0.486 . . . . 2.08 111.272 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.91 -36.9 35.76 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.153 0.501 . . . . 1.04 110.438 178.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.493 HD11 ' O ' ' A' ' 125' ' ' MET . 5.2 mp -60.46 -40.2 90.33 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.46 -0.791 . . . . 1.16 110.697 179.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -60.52 -24.54 65.43 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.943 -0.571 . . . . 1.47 111.961 -178.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.482 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -65.15 -39.41 92.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.681 0.277 . . . . 2.7 110.41 -177.521 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 11.3 mt -67.47 -28.55 42.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 1.79 110.846 -178.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.546 ' O ' HG23 ' A' ' 137' ' ' VAL . 33.3 t80 -61.46 -63.05 1.41 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.955 -0.566 . . . . 0.52 110.487 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.3 pp -65.89 -25.3 67.1 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.334 0.588 . . . . 1.26 110.51 -178.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.482 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -63.95 -34.15 77.33 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.484 -0.78 . . . . 2.07 111.446 -179.339 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.13 -21.98 14.31 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.891 0.377 . . . . 2.11 111.036 -178.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.546 HG23 ' O ' ' A' ' 133' ' ' PHE . 40.9 t -73.13 -31.28 34.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.078 0.466 . . . . 1.09 110.518 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -72.25 -6.35 42.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.322 0.582 . . . . 1.21 110.36 178.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -111.55 2.79 17.58 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.541 -0.754 . . . . 1.94 110.117 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -65.54 149.85 96.73 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 115.941 -0.572 . . . . 1.34 111.623 -179.736 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -84.84 87.26 1.07 Allowed 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.435 2.09 . . . . 0.67 111.165 177.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 6.6 mm-40 -70.47 11.03 0.39 Allowed 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.407 0.521 . . . . 3.68 112.407 -174.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -83.76 -39.6 19.86 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 108.85 -0.796 . . . . 2.7 108.85 173.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 67.82 98.55 0.05 Allowed 'General case' 0 C--O 1.231 0.115 0 CA-C-N 114.263 -1.335 . . . . 2.34 111.017 -177.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 9.4 t -100.55 107.47 21.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.746 -0.661 . . . . 1.66 109.304 175.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -66.21 140.13 58.15 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.741 -0.466 . . . . 1.53 109.741 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 11.1 mt . . . . . 0 C--O 1.246 0.906 0 CA-C-O 118.661 -0.685 . . . . 1.57 110.205 -177.308 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.695 0 N-CA-C 111.687 -0.565 . . . . 2.47 111.687 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 312' ' ' ALY . . . . . 0.525 HH32 ' HH ' ' A' ' 73' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 313' ' ' GLY . . . . . 0.534 ' HA2' ' OD2' ' A' ' 120' ' ' ASP . . . 99.71 -38.34 3.16 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.796 -0.716 . . . . 1.97 112.115 -179.113 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -128.8 79.29 1.9 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.214 0.531 . . . . 3.98 110.446 179.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.645 -0.693 . . . . 4.91 110.273 -177.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo . . . . . 0 N--CA 1.482 0.813 0 N-CA-C 109.99 -0.812 . . . . 6.97 109.99 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.17 138.81 37.71 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.428 -0.582 . . . . 6.2 109.428 177.656 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.77 -32.79 5.78 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 110.703 -0.959 . . . . 3.98 110.703 -174.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 92.6 p -78.46 177.35 8.59 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.632 -0.784 . . . . 2.49 109.942 173.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.497 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 9.6 mt-10 -57.28 127.35 31.56 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.255 0.55 . . . . 2.07 112.125 177.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.454 ' O ' ' HB2' ' A' ' 94' ' ' TYR . 4.4 p -123.49 -13.12 6.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.118 -0.946 . . . . 1.5 109.157 172.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.7 m -173.66 116.4 0.25 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 114.976 -1.011 . . . . 1.85 108.855 -179.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.462 ' OD1' ' HD2' ' A' ' 29' ' ' PRO . 20.3 t30 -140.5 132.69 14.39 Favored Pre-proline 0 C--N 1.319 -0.734 0 C-N-CA 120.918 -0.313 . . . . 1.62 110.75 -173.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . 0.462 ' HD2' ' OD1' ' A' ' 28' ' ' ASN . 70.7 Cg_endo -69.42 -38.76 8.08 Favored 'Trans proline' 0 N--CA 1.474 0.368 0 C-N-CA 123.044 2.496 . . . . 2.05 112.002 177.332 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 7.2 m -71.65 -17.22 62.27 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.392 -0.822 . . . . 2.24 110.571 -179.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.8 tmtm? -101.55 110.29 61.39 Favored Pre-proline 0 C--N 1.318 -0.802 0 CA-C-N 115.348 -0.842 . . . . 3.33 109.453 175.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.623 ' HB2' ' CZ3' ' A' ' 96' ' ' TRP . 24.5 Cg_endo -63.54 133.95 42.2 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 121.549 1.5 . . . . 1.8 111.978 -179.01 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -160.18 80.67 0.15 Allowed Glycine 0 N--CA 1.44 -1.099 0 CA-C-N 115.023 -0.989 . . . . 0.97 110.917 -177.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.1 mtm180 -73.92 -117.09 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.95 0.405 . . . . 2.37 110.186 -179.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -175.06 129.04 0.29 Allowed 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.447 -0.575 . . . . 3.13 109.447 178.413 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.411 ' HA ' ' HA ' ' A' ' 146' ' ' GLU . 4.1 p -118.94 159.76 23.22 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 109.841 -0.429 . . . . 1.29 109.841 174.002 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -57.71 -36.47 72.06 Favored 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 110.091 -0.337 . . . . 1.47 110.091 178.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.423 ' OE1' ' HB3' ' A' ' 140' ' ' MET . 0.9 OUTLIER -57.05 -44.09 82.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.696 -0.683 . . . . 1.04 110.922 178.32 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.436 ' HB2' ' HA ' ' A' ' 97' ' ' SER . 0.4 OUTLIER -63.41 -55.63 22.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.059 -0.518 . . . . 1.39 110.822 -179.052 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -62.98 -33.98 76.55 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.849 -0.614 . . . . 1.75 110.516 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -57.74 -63.38 1.26 Allowed 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 115.973 -0.558 . . . . 1.2 110.388 176.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.553 ' HB2' ' SD ' ' A' ' 140' ' ' MET . 8.6 ttp -59.81 -30.66 69.07 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.41 -0.359 . . . . 1.76 110.54 -175.656 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.44 ' O ' HG12 ' A' ' 47' ' ' VAL . 3.0 tt0 -61.5 -55.92 25.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.665 -0.698 . . . . 1.47 111.101 178.247 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 62.6 m-80 -85.72 -27.24 25.41 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.092 0.404 . . . . 0.53 112.092 -176.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 94.9 t -89.36 -57.73 4.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 N-CA-C 112.305 0.483 . . . . 1.11 112.305 -177.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 48.0 t -82.15 -66.66 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 112.143 0.423 . . . . 1.07 112.143 -169.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.44 HG12 ' O ' ' A' ' 43' ' ' GLN . 0.9 OUTLIER -65.97 -37.18 79.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 C-N-CA 120.707 -0.397 . . . . 1.44 111.248 -174.248 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.517 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 0.2 OUTLIER -56.7 -39.95 74.76 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.544 0.212 . . . . 2.85 111.164 178.702 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 12.2 m -77.47 -35.78 53.44 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 121.131 -0.228 . . . . 1.23 111.158 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.02 -39.05 90.95 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.269 0.557 . . . . 1.11 109.581 175.012 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 33.1 t-105 -62.74 -29.35 70.62 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.549 -0.751 . . . . 0.44 111.235 177.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.517 ' HG3' ' O ' ' A' ' 48' ' ' LYS . 12.7 mtpt -82.5 -5.54 58.78 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 111.949 0.352 . . . . 2.75 111.949 -175.394 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.506 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 4.7 t-80 -74.71 128.19 34.95 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.01 0.433 . . . . 0.47 110.028 177.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -82.61 15.7 2.47 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.247 -0.433 . . . . 1.91 111.445 -176.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.506 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.4 OUTLIER -112.15 -7.42 14.05 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.175 -0.676 . . . . 1.24 109.175 171.296 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -96.24 11.42 34.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.63 -0.713 . . . . 1.09 110.498 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.492 ' CG ' ' HD3' ' A' ' 58' ' ' PRO . 42.9 p-90 -63.27 -33.33 10.32 Favored Pre-proline 0 CA--C 1.545 0.778 0 N-CA-C 113.849 1.055 . . . . 0.65 113.849 -175.64 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.492 ' HD3' ' CG ' ' A' ' 57' ' ' TRP . 10.3 Cg_exo -73.37 -13.76 25.35 Favored 'Trans proline' 0 C--N 1.356 0.956 0 C-N-CA 121.423 1.415 . . . . 0.61 111.88 176.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -94.91 -0.89 53.58 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.986 -0.552 . . . . 1.52 110.665 -178.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 12.5 m-30 -66.64 -34.53 78.07 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.017 -0.538 . . . . 1.01 110.987 -179.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -94.68 138.35 22.26 Favored Pre-proline 0 C--N 1.325 -0.479 0 CA-C-N 115.857 -0.611 . . . . 2.11 110.663 -175.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.591 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 41.2 Cg_endo -69.38 141.95 48.23 Favored 'Trans proline' 0 C--O 1.237 0.468 0 C-N-CA 122.523 2.149 . . . . 1.1 112.65 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 53.1 t -77.32 87.93 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.798 0.809 . . . . 1.46 109.319 177.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.596 ' O ' ' HB2' ' A' ' 65' ' ' ALA . 0.0 OUTLIER -102.98 1.92 34.29 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.286 -0.87 . . . . 1.85 110.41 -178.015 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.596 ' HB2' ' O ' ' A' ' 64' ' ' ASP . . . 85.72 -21.31 0.22 Allowed 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 114.804 -1.089 . . . . 1.43 112.186 177.091 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.408 HG22 HD11 ' A' ' 66' ' ' ILE . 35.0 mm -112.26 -49.37 5.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 120.859 0.361 . . . . 2.38 111.002 -178.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.43 -36.32 73.46 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.004 -0.544 . . . . 3.34 111.699 -178.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -108.58 4.8 24.43 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.328 -0.396 . . . . 2.3 110.456 178.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 55.33 52.27 11.69 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.349 -0.842 . . . . 1.89 111.597 -179.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 19.2 mt -127.05 64.9 62.37 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 116.058 -0.519 . . . . 2.18 111.61 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -75.76 -20.23 15.59 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 121.956 1.771 . . . . 1.42 110.865 176.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -75.78 -19.8 58.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.958 -1.019 . . . . 1.97 110.361 179.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.942 ' HH ' ' HB3' ' A' ' 111' ' ' ASN . 0.5 OUTLIER -64.77 -39.07 93.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.336 -0.847 . . . . 1.53 110.299 178.98 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -78.29 6.28 8.59 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.507 -0.769 . . . . 1.22 111.456 -174.44 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -97.36 -53.99 3.29 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.096 0.474 . . . . 3.34 109.727 -179.291 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.9 mp -90.53 -47.02 14.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.563 -0.744 . . . . 1.5 110.878 -178.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 26.8 mm -78.18 114.83 19.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.964 -0.562 . . . . 1.19 110.353 -177.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.9 mtmm -72.86 -27.01 61.67 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.677 -0.692 . . . . 2.35 111.441 -176.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -127.13 81.78 69.32 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 116.276 -0.42 . . . . 2.05 110.817 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -65.95 93.63 0.27 Allowed 'Trans proline' 0 C--O 1.236 0.392 0 C-N-CA 122.601 2.201 . . . . 1.24 111.94 178.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 1.6 mmt -126.26 157.55 38.02 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.893 -0.594 . . . . 1.39 110.335 -178.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.591 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 1.2 p-10 -139.65 -121.72 0.12 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.023 -0.989 . . . . 1.42 109.427 -172.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 3.6 ttp -130.72 -17.31 3.23 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.033 0.444 . . . . 1.14 110.434 178.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -88.71 -27.76 23.44 Favored Glycine 0 N--CA 1.442 -0.944 0 N-CA-C 110.235 -1.146 . . . . 0.33 110.235 -179.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -74.23 -36.0 63.9 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.271 -0.464 . . . . 1.6 110.655 176.138 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 75.5 mt -61.73 -53.05 53.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.796 -0.638 . . . . 1.63 110.093 175.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.512 ' O ' ' HG2' ' A' ' 91' ' ' GLU . 0.2 OUTLIER -63.08 -28.18 69.9 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.157 -0.474 . . . . 1.71 111.247 178.843 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 2.3 tptt -64.36 -47.18 80.3 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.894 0.378 . . . . 2.93 110.581 178.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.49 ' HB3' ' CE2' ' A' ' 95' ' ' TYR . 6.9 mtp180 -65.33 -29.71 70.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.008 -0.542 . . . . 1.49 110.447 178.222 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 12.4 mt -73.22 -54.92 7.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.759 -0.655 . . . . 1.14 111.674 -179.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 2.6 pt-20 -66.77 -31.56 72.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.432 -0.349 . . . . 1.39 111.215 -175.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -81.32 -4.78 56.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.33 -0.395 . . . . 1.66 110.507 178.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.5 t30 56.82 58.56 4.0 Favored 'General case' 0 CA--C 1.522 -0.097 0 CA-C-N 115.731 -0.668 . . . . 1.75 111.363 -179.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . 0.497 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 62.1 t80 -87.54 -35.2 18.28 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.31 -0.404 . . . . 1.3 111.067 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.49 ' CE2' ' HB3' ' A' ' 89' ' ' ARG . 54.1 m-85 -77.71 168.8 19.36 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-O 121.823 0.821 . . . . 1.72 111.624 -176.031 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . 0.623 ' CZ3' ' HB2' ' A' ' 32' ' ' PRO . 2.0 t90 -87.48 -44.25 11.45 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 114.116 -1.402 . . . . 1.15 109.432 168.166 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.436 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 3.3 t -153.22 170.89 19.45 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 114.949 -1.023 . . . . 1.05 110.265 -170.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -65.43 -23.43 66.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.746 0.308 . . . . 1.31 111.121 -177.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.3 -25.25 67.76 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.09 -0.505 . . . . 1.12 111.03 178.268 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.403 ' HB3' ' CD1' ' A' ' 95' ' ' TYR . 16.6 tt0 -83.86 -29.5 27.19 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.227 0.537 . . . . 2.44 109.653 179.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . 0.542 ' SG ' ' HE2' ' A' ' 42' ' ' MET . 5.2 t -82.45 -30.98 29.7 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.715 -0.675 . . . . 1.24 111.076 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.02 -30.96 69.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.258 -0.428 . . . . 1.66 110.775 -179.533 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -63.59 -43.07 98.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.13 -0.486 . . . . 3.72 110.261 175.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -68.31 -43.16 78.23 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.036 -0.529 . . . . 1.87 109.715 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.92 -52.18 63.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.478 -0.783 . . . . 0.45 110.508 176.138 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -59.78 -40.65 88.98 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.838 -0.619 . . . . 1.23 110.67 178.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' THR . . . . . 0.417 ' HA ' ' OG1' ' A' ' 110' ' ' THR . 97.3 m -63.34 -43.71 96.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.118 -0.492 . . . . 1.09 111.276 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.49 -44.3 68.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.987 0.422 . . . . 1.44 110.82 177.024 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -71.63 -41.08 69.29 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.124 -0.489 . . . . 0.29 111.24 -179.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' THR . . . . . 0.417 ' OG1' ' HA ' ' A' ' 107' ' ' THR . 0.1 OUTLIER -65.0 -42.15 94.73 Favored 'General case' 0 CA--C 1.52 -0.21 0 C-N-CA 120.88 -0.328 . . . . 1.33 110.623 -179.851 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . 0.942 ' HB3' ' HH ' ' A' ' 73' ' ' TYR . 59.6 m-20 -48.75 -52.55 23.1 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.656 -0.702 . . . . 2.36 111.114 178.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 1.8 t -56.26 -46.42 79.68 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.694 -0.684 . . . . 1.09 111.573 177.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -73.58 -20.81 60.52 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.83 0.307 . . . . 1.17 111.83 -174.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 89.0 mt -91.8 -55.93 5.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.653 0.263 . . . . 1.18 111.301 -176.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -76.19 -39.98 53.48 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.823 0.344 . . . . 1.6 110.905 -175.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -93.01 150.9 20.22 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.339 -0.391 . . . . 1.37 110.414 -176.232 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 2.9 ttpp -64.98 142.03 98.55 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.859 -0.609 . . . . 3.92 110.195 178.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -59.46 -13.1 19.31 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.832 2.355 . . . . 1.32 112.376 178.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -111.45 26.91 10.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.119 -0.491 . . . . 1.71 110.811 178.286 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -88.09 158.7 18.5 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.178 -0.465 . . . . 1.34 110.76 179.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.81 -43.66 98.41 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.153 -0.93 . . . . 1.44 110.611 -179.313 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.433 HG22 ' N ' ' A' ' 123' ' ' VAL . 1.0 OUTLIER -69.16 -36.65 74.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-O 120.998 0.428 . . . . 1.16 110.872 -178.688 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.433 ' N ' HG22 ' A' ' 122' ' ' ILE . 3.1 t -67.66 -36.52 76.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.075 0.464 . . . . 1.1 110.302 -179.187 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.34 -33.78 71.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.812 -0.631 . . . . 1.22 110.112 178.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 16.9 mtt -79.61 -42.93 23.86 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.819 -0.628 . . . . 1.25 110.677 179.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.94 -36.79 65.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.042 -0.526 . . . . 1.1 111.755 -178.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -62.43 -40.91 98.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.471 . . . . 2.08 111.055 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.04 -37.71 61.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.078 0.466 . . . . 1.04 110.523 179.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.478 HD12 ' ND1' ' A' ' 53' ' ' HIS . 1.6 mp -58.85 -39.59 81.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.416 -0.811 . . . . 1.16 110.536 179.037 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -61.47 -25.12 67.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.517 -0.765 . . . . 1.47 112.075 -177.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.525 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -66.45 -39.45 88.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.777 0.322 . . . . 2.7 110.433 -176.924 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 8.9 mt -70.06 -30.9 45.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.069 -0.514 . . . . 1.79 110.416 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.607 ' O ' HG22 ' A' ' 137' ' ' VAL . 61.5 t80 -59.78 -62.87 1.55 Allowed 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.835 -0.621 . . . . 0.52 110.491 179.447 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.61 -30.26 71.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.937 0.398 . . . . 1.26 110.665 -177.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.525 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -57.16 -47.42 81.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.491 -0.777 . . . . 2.07 111.267 179.724 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.18 -18.55 26.91 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.91 -0.587 . . . . 2.11 111.139 -176.304 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.607 HG22 ' O ' ' A' ' 133' ' ' PHE . 40.5 t -72.34 -31.79 40.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 109.77 -0.455 . . . . 1.09 109.77 177.174 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -60.3 -27.38 67.26 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.48 -0.782 . . . . 1.21 110.588 175.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -91.02 -8.86 47.89 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.054 -0.975 . . . . 1.94 111.123 -173.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' MET . . . . . 0.553 ' SD ' ' HB2' ' A' ' 42' ' ' MET . 0.9 OUTLIER -64.81 144.59 98.93 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.11 -0.495 . . . . 1.34 111.171 -178.208 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.474 ' C ' ' H ' ' A' ' 143' ' ' GLU . 57.9 Cg_endo -70.34 107.38 1.96 Allowed 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.453 2.102 . . . . 0.67 111.324 178.347 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.78 29.45 0.11 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.273 0.559 . . . . 3.68 111.759 -173.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.474 ' H ' ' C ' ' A' ' 141' ' ' PRO . 22.3 mt-10 -105.33 -39.71 6.07 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.782 -0.644 . . . . 2.7 109.631 174.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 63.27 73.27 0.46 Allowed 'General case' 0 C--N 1.334 -0.089 0 CA-C-N 114.788 -1.096 . . . . 2.34 109.829 -174.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 1.5 t -89.62 122.01 40.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.698 -0.683 . . . . 1.66 109.734 -176.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.411 ' HA ' ' HA ' ' A' ' 36' ' ' THR . 7.9 tt0 -70.71 147.58 48.91 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.758 0.313 . . . . 1.53 110.698 -179.291 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 64.9 mt . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.584 -0.722 . . . . 1.57 110.239 -178.856 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.578 0 N-CA-C 111.769 -0.533 . . . . 2.47 111.769 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 120.96 -33.72 4.3 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.987 -0.625 . . . . 1.97 111.766 -179.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -142.89 127.48 17.99 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.884 -0.413 . . . . 3.98 109.884 178.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt . . . . . 0 C--O 1.251 1.137 0 O-C-N 124.253 0.971 . . . . 4.91 112.507 179.501 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo . . . . . 0 N--CA 1.477 0.558 0 N-CA-C 109.952 -0.826 . . . . 6.97 109.952 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.1 mt -149.67 -178.78 6.64 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.862 -0.421 . . . . 6.2 109.862 177.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.76 -73.09 2.72 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.786 -0.721 . . . . 3.98 112.38 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.3 p -124.72 178.19 5.59 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.86 0.362 . . . . 2.49 110.791 -178.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -69.4 151.25 46.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.933 -0.576 . . . . 2.07 111.177 174.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.5 p -120.15 -14.99 7.93 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 115.556 -0.747 . . . . 1.5 109.48 171.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.2 m -177.11 138.78 0.25 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-N 114.957 -1.02 . . . . 1.85 109.827 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.462 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 35.3 t-20 -135.34 127.17 17.73 Favored Pre-proline 0 C--N 1.322 -0.625 0 N-CA-C 109.472 -0.566 . . . . 1.62 109.472 178.313 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -61.46 -38.3 64.55 Favored 'Trans proline' 0 N--CA 1.475 0.426 0 C-N-CA 123.239 2.626 . . . . 2.05 113.034 -178.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.1 m -80.34 -19.65 46.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.216 0.531 . . . . 2.24 110.49 -178.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.462 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 5.6 tttp -96.61 107.07 34.15 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.522 -0.763 . . . . 3.33 110.502 178.432 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.457 ' HB2' ' CZ3' ' A' ' 96' ' ' TRP . 3.2 Cg_exo -72.85 149.02 46.99 Favored 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 122.413 2.075 . . . . 1.8 112.391 -178.119 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -145.92 85.68 0.18 Allowed Glycine 0 N--CA 1.442 -0.965 0 N-CA-C 110.746 -0.941 . . . . 0.97 110.746 178.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -74.54 159.25 32.44 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.15 0.5 . . . . 2.37 110.976 -175.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.59 104.74 17.19 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.241 -0.436 . . . . 3.13 109.886 179.382 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.5 p -104.36 164.29 11.84 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.048 -0.524 . . . . 1.29 110.513 178.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -60.46 -41.37 93.99 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.268 -0.424 . . . . 1.47 110.551 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -61.92 -44.66 96.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.238 -0.437 . . . . 1.04 110.565 178.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.16 -52.96 63.11 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.824 -0.625 . . . . 1.39 111.092 -178.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 20.7 mm100 -69.26 -28.25 66.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.042 -0.526 . . . . 1.75 110.919 -179.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.463 ' CE1' ' HG2' ' A' ' 140' ' ' MET . 53.2 t80 -61.23 -63.84 1.15 Allowed 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.994 -0.548 . . . . 1.2 110.137 177.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.403 ' O ' ' HG3' ' A' ' 42' ' ' MET . 0.3 OUTLIER -61.52 -30.52 70.68 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.946 -0.301 . . . . 1.76 110.611 -173.091 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -58.71 -59.18 5.81 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.684 -0.689 . . . . 1.47 111.245 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 63.4 m-80 -87.81 -25.95 23.09 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 112.231 0.456 . . . . 0.53 112.231 -177.016 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 97.4 t -89.1 -57.97 3.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 112.386 0.513 . . . . 1.11 112.386 -175.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 59.6 t -81.97 -66.25 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 111.941 0.348 . . . . 1.07 111.941 -170.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.1 p -66.99 -32.7 59.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 C-N-CA 120.925 -0.31 . . . . 1.44 111.345 -174.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.2 -34.0 75.63 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.775 -0.37 . . . . 2.85 111.001 176.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 38.2 m -79.89 -36.59 36.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.725 0.297 . . . . 1.23 110.302 177.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -44.7 95.7 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.169 -0.469 . . . . 1.11 109.768 175.399 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 17.6 t-105 -62.76 -30.43 71.44 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.457 -0.792 . . . . 0.44 111.556 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.9 mtpp -90.7 7.62 38.6 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.018 0.377 . . . . 2.75 112.018 -174.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 41.3 t-80 -75.61 143.55 42.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.913 0.387 . . . . 0.47 110.133 177.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -69.12 -25.09 64.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.166 -0.47 . . . . 1.91 112.205 -175.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.501 ' HB3' ' HB2' ' A' ' 125' ' ' MET . 21.7 m-85 -105.23 8.42 33.96 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.065 0.459 . . . . 1.24 110.619 -178.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -93.15 8.13 41.4 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.135 0.493 . . . . 1.09 110.837 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.437 ' CG ' ' HD3' ' A' ' 58' ' ' PRO . 62.3 p-90 -62.44 -34.47 15.06 Favored Pre-proline 0 CA--C 1.548 0.872 0 N-CA-C 113.873 1.064 . . . . 0.65 113.873 -175.577 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.626 ' HG2' ' SD ' ' A' ' 125' ' ' MET . 5.6 Cg_exo -80.14 3.66 7.44 Favored 'Trans proline' 0 C--N 1.36 1.173 0 C-N-CA 121.636 1.557 . . . . 0.61 112.221 179.219 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.41 ' CE2' HD12 ' A' ' 122' ' ' ILE . 31.4 m-85 -113.9 47.05 1.23 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.702 0.763 . . . . 1.52 109.166 178.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -114.18 -13.61 12.38 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.146 -0.934 . . . . 1.01 109.903 -178.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.76 117.0 24.43 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 115.268 -0.878 . . . . 2.11 110.602 -169.377 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.32 143.23 93.55 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 122.337 2.024 . . . . 1.1 112.196 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.422 HG12 ' CD2' ' A' ' 73' ' ' TYR . 2.9 t -67.5 106.09 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-O 121.715 0.769 . . . . 1.46 110.047 178.226 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -107.51 0.93 23.06 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.859 -1.064 . . . . 1.85 109.379 178.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 77.31 -55.73 0.53 Allowed 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 114.274 -1.33 . . . . 1.43 111.595 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.0 mt -77.77 -49.41 21.99 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.817 0 N-CA-C 111.635 0.235 . . . . 2.38 111.635 -173.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.71 -19.73 64.38 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.805 0.298 . . . . 3.34 111.805 -175.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 1.4 tp -109.84 -0.86 18.17 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.888 -0.325 . . . . 2.3 111.288 179.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 61.88 42.78 9.98 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.711 -0.677 . . . . 1.89 112.129 178.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -126.51 68.37 67.74 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 115.969 -0.56 . . . . 2.18 110.683 176.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -72.1 -26.0 18.61 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.093 1.862 . . . . 1.42 111.869 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 -84.28 -4.14 58.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.741 -0.663 . . . . 1.97 110.484 -178.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.468 ' HA ' ' CE1' ' A' ' 115' ' ' TYR . 27.0 t80 -65.29 -30.89 71.79 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.699 -0.682 . . . . 1.53 110.307 178.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -80.89 2.93 24.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.548 -0.751 . . . . 1.22 111.613 -171.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.7 mtpt -96.75 -51.08 4.43 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.078 0.466 . . . . 3.34 109.859 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.7 mp -81.58 -45.0 20.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.865 -0.607 . . . . 1.5 110.539 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 45.0 mm -89.56 123.32 41.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.192 -0.458 . . . . 1.19 110.019 -178.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.45 ' O ' ' HD3' ' A' ' 80' ' ' PRO . 0.9 OUTLIER -86.44 -36.12 19.29 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.263 -0.426 . . . . 2.35 111.295 -175.235 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -112.33 90.4 14.15 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 109.708 -0.479 . . . . 2.05 109.708 176.598 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.45 ' HD3' ' O ' ' A' ' 78' ' ' LYS . 13.1 Cg_exo -69.11 87.11 0.47 Allowed 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.996 2.464 . . . . 1.24 111.937 -178.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.0 mmt -124.0 164.38 19.47 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.888 -0.596 . . . . 1.39 110.766 -176.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.485 ' CG ' ' H ' ' A' ' 83' ' ' MET . 19.9 t70 -143.18 -144.64 0.16 Allowed 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 106.755 -1.572 . . . . 1.42 106.755 -177.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' MET . . . . . 0.485 ' H ' ' CG ' ' A' ' 82' ' ' ASP . 0.5 OUTLIER -107.84 -18.06 13.91 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 107.924 -1.139 . . . . 1.14 107.924 177.758 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -74.98 -26.26 67.16 Favored Glycine 0 N--CA 1.439 -1.135 0 N-CA-C 109.398 -1.481 . . . . 0.33 109.398 177.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -83.9 -37.22 22.65 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 114.868 -0.666 . . . . 1.6 111.079 177.324 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.405 HD12 ' N ' ' A' ' 86' ' ' ILE . 0.2 OUTLIER -61.11 -49.96 82.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.003 -0.544 . . . . 1.63 109.719 178.095 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.457 ' HZ2' ' CD ' ' A' ' 91' ' ' GLU . 0.1 OUTLIER -66.58 -26.44 67.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.863 -0.608 . . . . 1.71 111.001 179.957 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.411 ' N ' ' HG3' ' A' ' 87' ' ' LYS . 1.2 tptt -67.47 -51.36 52.26 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-O 120.688 0.28 . . . . 2.93 110.703 -179.327 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.446 HH22 ' CG ' ' A' ' 104' ' ' ASP . 10.0 mtm-85 -67.66 -24.05 65.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.944 0.402 . . . . 1.49 110.81 -179.153 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.403 HD11 ' SG ' ' A' ' 101' ' ' CYS . 4.0 mt -73.33 -59.52 2.67 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.957 -0.565 . . . . 1.14 111.041 177.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.457 ' CD ' ' HZ2' ' A' ' 87' ' ' LYS . 19.9 pt-20 -66.63 -36.73 83.29 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.738 -0.665 . . . . 1.39 111.114 -175.019 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -79.26 -4.41 50.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.384 -0.371 . . . . 1.66 110.6 -179.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 58.25 72.04 0.55 Allowed 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.428 0.632 . . . . 1.75 110.731 176.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -93.97 -49.94 5.56 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.002 -0.544 . . . . 1.3 110.98 179.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.436 ' CE1' ' HB2' ' A' ' 101' ' ' CYS . 0.2 OUTLIER -96.07 -179.67 4.76 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.846 0.355 . . . . 1.72 110.94 -177.933 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . 0.457 ' CZ3' ' HB2' ' A' ' 32' ' ' PRO . 2.1 t-105 -82.58 -46.52 13.23 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.74 -0.664 . . . . 1.15 111.878 -174.055 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.4 t -144.93 172.3 13.24 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 120.424 -0.511 . . . . 1.05 110.929 -173.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -68.16 -17.88 64.46 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.081 -0.508 . . . . 1.31 111.458 -176.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.06 -33.81 73.91 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 121.019 0.437 . . . . 1.12 109.976 175.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.4 -37.35 63.4 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.877 -0.601 . . . . 2.44 109.571 177.179 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . 0.436 ' HB2' ' CE1' ' A' ' 95' ' ' TYR . 41.3 t -68.01 -39.49 83.17 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.565 -0.743 . . . . 1.24 111.322 -178.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.23 -22.99 67.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.359 -0.382 . . . . 1.66 110.912 -177.029 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -67.2 -44.29 79.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.064 0.459 . . . . 3.72 110.466 175.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . 0.446 ' CG ' HH22 ' A' ' 89' ' ' ARG . 0.6 OUTLIER -78.76 -29.97 45.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.36 -0.382 . . . . 1.87 110.194 -179.348 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.84 -40.72 93.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.77 -0.65 . . . . 0.45 109.647 173.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -68.72 -34.52 75.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.771 -0.65 . . . . 1.23 110.126 174.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 86.3 m -63.02 -51.93 64.86 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.891 -0.595 . . . . 1.09 111.265 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 10.7 ptm -59.57 -32.75 70.65 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.783 0.325 . . . . 1.44 111.291 -178.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -73.13 -47.51 43.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.509 -0.314 . . . . 0.29 110.764 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.1 p -64.84 -38.97 92.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.756 0.312 . . . . 1.33 110.589 179.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.0 m-20 -47.83 -53.08 16.65 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.529 -0.759 . . . . 2.36 110.731 177.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 10.6 t -60.84 -43.81 97.78 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.312 -0.858 . . . . 1.09 111.02 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -66.14 -33.98 77.02 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.492 -0.322 . . . . 1.17 111.541 -177.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 70.6 mt -80.32 -55.46 8.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.575 -0.284 . . . . 1.18 111.622 -176.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . 0.468 ' CE1' ' HA ' ' A' ' 73' ' ' TYR . 57.6 t80 -68.3 -35.87 78.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.908 0.385 . . . . 1.6 111.43 -174.048 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 63.6 m-80 -94.23 -170.23 2.24 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.137 -0.483 . . . . 1.37 110.725 -175.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.31 154.5 40.54 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 116.32 -0.4 . . . . 3.92 110.363 -177.563 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -61.9 -25.54 78.21 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.415 2.076 . . . . 1.32 111.67 176.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.26 22.07 12.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.787 -0.642 . . . . 1.71 111.018 178.273 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -87.23 155.57 20.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 1.34 110.341 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . 0.464 ' HB3' ' HB2' ' B' ' 315' ' ' ALY . 42.8 m-20 -68.83 -42.36 77.31 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.728 -0.669 . . . . 1.44 110.244 -178.292 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.7 ' HA ' ' SD ' ' A' ' 125' ' ' MET . 1.4 tp -65.21 -32.81 59.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.853 -0.612 . . . . 1.16 110.743 -177.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 2.7 t -74.09 -37.71 47.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.145 0.498 . . . . 1.1 110.105 178.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.14 -38.45 79.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.681 -0.691 . . . . 1.22 110.515 -178.495 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' MET . . . . . 0.7 ' SD ' ' HA ' ' A' ' 122' ' ' ILE . 0.0 OUTLIER -82.5 -39.28 22.67 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.325 -0.398 . . . . 1.25 111.311 177.991 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.23 -32.24 64.26 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.753 0.311 . . . . 1.1 111.566 -178.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -63.98 -44.39 92.84 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.17 -0.468 . . . . 2.08 110.692 177.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.63 -41.23 84.23 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.236 -0.438 . . . . 1.04 110.565 177.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.584 HD12 ' O ' ' A' ' 125' ' ' MET . 9.3 mp -56.73 -45.34 82.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.81 -0.632 . . . . 1.16 110.549 177.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -65.05 -23.32 67.15 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.649 -0.705 . . . . 1.47 111.551 -177.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.2 -49.16 53.07 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 110.17 -0.308 . . . . 2.7 110.17 -177.11 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 129' ' ' LEU . 1.0 OUTLIER -72.41 -24.92 22.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.41 -0.359 . . . . 1.79 110.324 178.07 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.487 ' O ' HG21 ' A' ' 137' ' ' VAL . 39.9 t80 -60.76 -62.07 2.12 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.97 -0.559 . . . . 0.52 110.406 174.597 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.82 -25.58 67.28 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.897 0.379 . . . . 1.26 110.629 -177.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.402 ' HB2' ' HA ' ' A' ' 132' ' ' ILE . 1.3 mm-40 -60.84 -44.06 97.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.68 -0.691 . . . . 2.07 111.042 -179.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 30.6 mttm -91.73 -13.0 32.36 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.955 0.407 . . . . 2.11 111.017 -177.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.487 HG21 ' O ' ' A' ' 133' ' ' PHE . 19.5 t -81.73 -29.12 10.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.207 0.527 . . . . 1.09 110.04 178.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -71.76 -7.76 50.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.436 0.636 . . . . 1.21 110.324 176.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -107.68 2.87 24.12 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.237 -0.892 . . . . 1.94 110.378 179.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' MET . . . . . 0.463 ' HG2' ' CE1' ' A' ' 41' ' ' TYR . 0.6 OUTLIER -61.77 149.51 84.85 Favored Pre-proline 0 C--O 1.232 0.182 0 CA-C-N 115.669 -0.696 . . . . 1.34 110.676 177.022 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -74.02 90.68 0.96 Allowed 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 121.902 1.734 . . . . 0.67 110.832 175.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -63.79 -4.15 2.94 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.996 -0.547 . . . . 3.68 111.736 -175.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -79.06 -34.77 43.42 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.771 -0.649 . . . . 2.7 110.066 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 67.68 93.26 0.08 Allowed 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 114.813 -1.085 . . . . 2.34 109.524 -177.024 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -113.04 118.73 58.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.818 -0.628 . . . . 1.66 110.142 -176.245 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -74.28 132.59 42.23 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.676 -0.49 . . . . 1.53 109.676 178.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 34.3 mt . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.744 -0.646 . . . . 1.57 110.133 -177.062 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.692 0 N-CA-C 111.648 -0.581 . . . . 2.47 111.648 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 123.09 -38.29 2.54 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.864 -0.684 . . . . 1.97 111.716 -177.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.88 136.13 26.72 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.793 -0.447 . . . . 3.98 109.793 175.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 315' ' ' ALY . . . . . 0.464 ' HB2' ' HB3' ' A' ' 121' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 3.9 pttt . . . . . 0 C--O 1.247 0.963 0 CA-C-O 118.812 -0.613 . . . . 4.91 110.122 175.785 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_endo . . . . . 0 N--CA 1.477 0.547 0 N-CA-C 110.729 -0.527 . . . . 6.97 110.729 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -152.88 91.35 1.54 Allowed 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.381 -0.6 . . . . 6.2 109.381 178.347 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.77 40.73 5.85 Favored Glycine 0 N--CA 1.449 -0.485 0 N-CA-C 110.059 -1.216 . . . . 3.98 110.059 -170.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.77 158.45 30.89 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 114.892 -0.654 . . . . 2.49 111.808 -175.451 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.531 ' HG3' ' CE1' ' A' ' 94' ' ' TYR . 11.1 pt-20 -99.76 165.62 11.5 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.757 -0.656 . . . . 2.07 109.511 174.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 7.9 p -126.63 -10.35 4.64 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.103 0 CA-C-O 121.897 0.856 . . . . 1.5 108.696 173.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -146.43 138.42 24.88 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 114.32 -1.309 . . . . 1.85 108.416 177.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.508 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 16.4 t-20 -143.01 122.33 7.6 Favored Pre-proline 0 C--N 1.313 -0.98 0 C-N-CA 120.786 -0.366 . . . . 1.62 110.459 176.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -67.39 -46.29 2.97 Favored 'Trans proline' 0 N--CA 1.475 0.439 0 C-N-CA 123.43 2.753 . . . . 2.05 113.351 -177.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.8 m -71.81 -39.52 69.79 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.975 -0.557 . . . . 2.24 110.502 -175.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.508 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 0.2 OUTLIER -66.38 130.37 94.2 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.338 -0.846 . . . . 3.33 110.005 179.638 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -60.97 156.79 42.11 Favored 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.7 2.267 . . . . 1.8 112.554 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -160.67 63.11 0.29 Allowed Glycine 0 N--CA 1.446 -0.667 0 N-CA-C 110.658 -0.977 . . . . 0.97 110.658 -179.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.462 ' HG3' ' CZ2' ' A' ' 96' ' ' TRP . 5.8 mtm-85 -79.53 132.54 36.34 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.848 0.356 . . . . 2.37 110.142 -174.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.4 ttmt -80.33 119.75 23.47 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.104 -0.498 . . . . 3.13 110.438 -173.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.425 ' HA ' ' HA ' ' A' ' 146' ' ' GLU . 0.6 OUTLIER -112.76 160.34 18.06 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.815 -0.354 . . . . 1.29 111.154 178.421 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.641 ' ND2' ' HG3' ' A' ' 141' ' ' PRO . 11.9 t30 -55.51 -46.56 76.96 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 115.786 -0.643 . . . . 1.47 110.321 176.384 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -54.32 -46.31 72.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.648 -0.706 . . . . 1.04 110.925 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.0 -57.96 10.75 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.643 -0.708 . . . . 1.39 111.561 -177.409 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -70.86 -25.29 62.74 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.066 -0.515 . . . . 1.75 110.79 -176.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.581 ' CE1' ' HG2' ' A' ' 140' ' ' MET . 54.0 t80 -61.85 -62.39 1.83 Allowed 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 116.064 -0.516 . . . . 1.2 110.345 175.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.52 ' O ' HG13 ' A' ' 47' ' ' VAL . 0.1 OUTLIER -59.15 -35.22 73.14 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 120.792 0.33 . . . . 1.76 110.15 -175.329 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -56.75 -54.66 43.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.567 -0.742 . . . . 1.47 111.159 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.437 ' O ' ' HB2' ' A' ' 48' ' ' LYS . 69.5 m-80 -87.02 -28.62 22.51 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.362 0.504 . . . . 0.53 112.362 -177.217 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 74.8 t -89.19 -58.24 3.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 112.3 0.482 . . . . 1.11 112.3 -175.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 43.3 t -79.52 -62.67 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 116.482 -0.326 . . . . 1.07 111.359 -170.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.52 HG13 ' O ' ' A' ' 42' ' ' MET . 1.5 m -62.92 -33.22 59.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 111.669 0.248 . . . . 1.44 111.669 -175.146 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.437 ' HB2' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -67.48 -35.24 78.79 Favored 'General case' 0 CA--C 1.528 0.118 0 C-N-CA 120.936 -0.305 . . . . 2.85 111.488 179.275 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.4 m -74.24 -37.76 63.7 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.78 -0.368 . . . . 1.23 110.51 178.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.417 HD11 ' SD ' ' A' ' 83' ' ' MET . 0.1 OUTLIER -66.59 -37.61 85.27 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.255 0.55 . . . . 1.11 109.844 175.253 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 9.7 t-105 -65.41 -25.72 67.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.47 -0.786 . . . . 0.44 111.623 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -89.74 3.16 53.65 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 120.61 -0.436 . . . . 2.75 111.665 -177.107 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.519 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 15.7 t-80 -89.1 129.96 35.63 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.647 -0.501 . . . . 0.47 109.647 175.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.97 -3.27 41.1 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.188 0.44 . . . . 1.91 112.188 -172.198 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.519 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 2.1 m-30 -93.05 -10.38 36.36 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.157 0.503 . . . . 1.24 110.114 175.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -92.4 19.93 6.67 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.972 -0.558 . . . . 1.09 110.514 178.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.635 ' HA ' ' CE2' ' A' ' 60' ' ' TYR . 44.8 p-90 -67.89 -34.45 6.34 Favored Pre-proline 0 CA--C 1.543 0.675 0 N-CA-C 113.309 0.855 . . . . 0.65 113.309 -175.008 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.602 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 3.4 Cg_exo -82.31 10.15 3.68 Favored 'Trans proline' 0 C--N 1.358 1.055 0 C-N-CA 121.711 1.607 . . . . 0.61 111.203 174.129 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -112.57 -15.65 13.0 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.546 -0.752 . . . . 1.52 111.182 -177.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.635 ' CE2' ' HA ' ' A' ' 57' ' ' TRP . 12.5 m-85 -66.6 -28.58 68.61 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.389 0.614 . . . . 1.01 110.147 177.445 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -98.35 116.57 65.48 Favored Pre-proline 0 C--N 1.32 -0.693 0 CA-C-N 115.063 -0.971 . . . . 2.11 110.431 -172.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.637 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 18.0 Cg_endo -62.56 133.08 40.77 Favored 'Trans proline' 0 C--O 1.24 0.597 0 C-N-CA 122.564 2.176 . . . . 1.1 112.52 -178.589 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.1 t -62.33 111.14 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 CA-C-O 121.893 0.854 . . . . 1.46 109.846 178.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.474 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.2 OUTLIER -122.5 -3.53 8.84 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.684 -1.144 . . . . 1.85 109.717 -175.058 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.474 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 74.95 -40.43 0.44 Allowed 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 114.967 -1.015 . . . . 1.43 111.596 -178.004 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.8 mt -86.43 -60.92 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 120.677 0.275 . . . . 2.38 111.25 -176.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.408 ' HG2' ' HB3' ' A' ' 64' ' ' ASP . 6.1 pttt -71.5 -10.6 60.01 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.246 0.462 . . . . 3.34 112.246 -175.342 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -114.58 -1.57 13.34 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.921 0.391 . . . . 2.3 110.596 175.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 52.9 50.33 18.24 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.849 -0.614 . . . . 1.89 111.735 -178.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 12.7 mt -120.81 71.07 19.32 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.804 -0.634 . . . . 2.18 109.628 174.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.71 -31.47 20.7 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.805 2.337 . . . . 1.42 113.458 -170.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.442 ' OD1' ' HG3' ' A' ' 75' ' ' LYS . 0.4 OUTLIER -100.11 10.86 40.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.925 0.393 . . . . 1.97 111.316 -176.763 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 15.8 t80 -63.46 -37.41 87.19 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.073 -0.512 . . . . 1.53 110.266 178.071 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 8.6 m-70 -78.99 -1.11 33.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.678 -0.692 . . . . 1.22 111.415 -175.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.442 ' HG3' ' OD1' ' A' ' 72' ' ' ASP . 13.0 mmtm -96.24 -18.01 20.35 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.216 0.531 . . . . 3.34 110.159 -179.272 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.3 mp -114.82 -45.43 4.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.66 -0.7 . . . . 1.5 110.171 178.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 33.3 mm -93.72 116.38 34.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 120.953 0.406 . . . . 1.19 110.116 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.85 -28.41 60.66 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.904 -0.589 . . . . 2.35 111.282 -177.028 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -122.33 85.33 47.4 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 116.23 -0.441 . . . . 2.05 110.842 -177.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -68.34 89.95 0.39 Allowed 'Trans proline' 0 CA--C 1.528 0.209 0 C-N-CA 122.527 2.152 . . . . 1.24 112.198 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 10.2 mmt -131.73 157.38 43.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.067 -0.515 . . . . 1.39 110.331 -178.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.637 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 1.2 p-10 -151.67 -115.39 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.699 -0.682 . . . . 1.42 109.637 -172.227 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' MET . . . . . 0.417 ' SD ' HD11 ' A' ' 50' ' ' LEU . 11.6 ttp -129.45 -22.28 3.06 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 121.922 -0.486 . . . . 1.14 110.789 176.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -83.3 -25.88 46.0 Favored Glycine 0 N--CA 1.444 -0.816 0 N-CA-C 110.607 -0.997 . . . . 0.33 110.607 179.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.82 -44.86 30.83 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.375 -0.413 . . . . 1.6 110.504 175.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.488 HD13 ' O ' ' A' ' 82' ' ' ASP . 83.6 mt -58.5 -48.68 84.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.732 -0.667 . . . . 1.63 110.257 175.199 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.416 ' HB3' ' O ' ' A' ' 83' ' ' MET . 0.0 OUTLIER -59.6 -32.93 70.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.116 -0.493 . . . . 1.71 110.902 178.397 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 8.6 tppt? -67.4 -50.39 59.81 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 120.601 0.239 . . . . 2.93 110.696 -179.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.691 ' HB3' ' CE1' ' A' ' 95' ' ' TYR . 15.2 mtp180 -68.22 -28.25 67.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.911 0.386 . . . . 1.49 110.643 179.29 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 5.8 mt -68.14 -56.59 8.24 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.86 -0.609 . . . . 1.14 111.635 177.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -65.92 -26.36 67.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.982 0.42 . . . . 1.39 111.24 -176.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -87.96 -4.68 58.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.989 -0.551 . . . . 1.66 110.715 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 50.63 61.66 3.1 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.739 -0.664 . . . . 1.75 110.766 -176.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . 0.531 ' CE1' ' HG3' ' A' ' 25' ' ' GLU . 72.4 t80 -85.07 -32.83 22.64 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 115.913 -0.585 . . . . 1.3 111.014 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.691 ' CE1' ' HB3' ' A' ' 89' ' ' ARG . 0.1 OUTLIER -80.71 -145.15 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.797 0.808 . . . . 1.72 110.398 178.885 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . 0.462 ' CZ2' ' HG3' ' A' ' 34' ' ' ARG . 2.3 t-105 -126.83 -53.59 1.43 Allowed 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 114.479 -1.237 . . . . 1.15 108.091 174.397 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 12.6 t -133.93 -173.06 3.14 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 115.043 -0.98 . . . . 1.05 110.072 -177.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.81 -5.49 58.24 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.611 0.243 . . . . 1.31 111.345 -177.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.45 -41.92 98.65 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.902 0.382 . . . . 1.12 110.552 177.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -69.66 -28.68 66.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.332 0.587 . . . . 2.44 109.593 177.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 4.2 t -71.77 -30.75 65.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.305 -0.862 . . . . 1.24 110.543 177.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.6 ttm -64.89 -40.37 94.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.08 -0.509 . . . . 1.66 109.935 177.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.2 -37.37 83.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.73 -0.668 . . . . 3.72 110.123 176.674 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . 0.416 ' HB3' HG12 ' A' ' 86' ' ' ILE . 1.1 m-20 -58.6 -55.58 33.28 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.601 -0.727 . . . . 1.87 110.509 177.14 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -58.31 -44.58 88.65 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.782 -0.645 . . . . 0.45 110.913 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -56.87 -44.98 82.77 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.28 -0.418 . . . . 1.23 110.294 177.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 54.3 m -65.12 -47.53 76.81 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.125 -0.489 . . . . 1.09 111.037 178.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.72 -41.57 74.05 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.083 -0.508 . . . . 1.44 111.313 -179.706 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -73.41 -45.79 52.59 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.422 -0.354 . . . . 0.29 110.633 -177.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.0 p -63.81 -35.6 81.14 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.607 -0.27 . . . . 1.33 110.871 -179.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 49.2 m-20 -46.28 -52.08 13.3 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.638 -0.71 . . . . 2.36 111.348 176.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 7.4 t -61.02 -38.42 86.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.451 -0.795 . . . . 1.09 111.085 -178.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -75.97 -16.21 60.03 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.336 -0.393 . . . . 1.17 111.71 -175.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 57.1 mt -92.39 -51.66 11.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.95 0.405 . . . . 1.18 110.816 178.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -71.52 -35.6 70.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.841 -0.618 . . . . 1.6 111.654 -175.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -105.3 -179.82 4.05 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.912 0.387 . . . . 1.37 110.982 -175.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.4 154.83 39.27 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.195 -0.457 . . . . 3.92 110.921 -177.027 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -61.48 -17.8 55.81 Favored 'Trans proline' 0 N--CA 1.476 0.49 0 C-N-CA 122.733 2.289 . . . . 1.32 112.373 177.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.16 0.42 51.22 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.832 -0.622 . . . . 1.71 111.515 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . 0.488 ' OD2' ' HA2' ' B' ' 313' ' ' GLY . 1.4 t70 -71.43 156.25 39.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.446 0.641 . . . . 1.34 111.734 -173.488 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -69.58 -41.59 75.61 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.91 -1.041 . . . . 1.44 109.884 -179.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 3.1 tp -67.46 -28.11 40.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.602 -0.727 . . . . 1.16 110.627 -179.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 1.3 t -70.48 -45.61 73.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 109.794 -0.447 . . . . 1.1 109.794 176.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.68 -33.23 71.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.668 -0.696 . . . . 1.22 109.736 177.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 30.5 mtt -71.15 -46.62 61.12 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.475 -0.784 . . . . 1.25 110.506 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.58 -40.42 75.2 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.253 -0.43 . . . . 1.1 111.481 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -44.96 96.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.468 -0.333 . . . . 2.08 111.217 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -70.68 -36.89 73.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.074 0.464 . . . . 1.04 110.564 178.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.29 -44.06 92.82 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.567 -0.742 . . . . 1.16 110.667 179.589 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -62.18 -25.91 68.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.744 -0.662 . . . . 1.47 111.349 -178.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.465 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 17.0 ttpt -64.25 -42.39 96.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.22 -0.445 . . . . 2.7 110.029 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . 0.421 ' HA ' ' HB2' ' A' ' 135' ' ' GLN . 0.1 OUTLIER -77.27 -23.69 14.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.09 -0.505 . . . . 1.79 110.501 -179.625 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.464 ' O ' HG23 ' A' ' 137' ' ' VAL . 30.3 t80 -62.09 -62.1 2.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.074 -0.512 . . . . 0.52 110.168 176.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.11 -26.46 68.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.126 0.489 . . . . 1.26 110.205 -178.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.465 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.01 -33.66 72.3 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.385 -0.825 . . . . 2.07 111.762 179.314 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.96 -25.14 15.09 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.135 0.493 . . . . 2.11 110.597 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.514 ' O ' ' HB2' ' A' ' 140' ' ' MET . 53.9 t -69.79 -32.35 51.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.948 -0.569 . . . . 1.09 110.619 179.176 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.59 -16.98 64.03 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.124 -0.489 . . . . 1.21 110.49 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -100.29 0.03 39.37 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.741 -0.663 . . . . 1.94 110.223 -179.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' MET . . . . . 0.581 ' HG2' ' CE1' ' A' ' 41' ' ' TYR . 0.1 OUTLIER -71.65 161.2 79.86 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.69 -0.686 . . . . 1.34 110.195 176.903 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.641 ' HG3' ' ND2' ' A' ' 37' ' ' ASN . 65.3 Cg_endo -74.7 107.67 2.52 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 121.714 1.609 . . . . 0.67 109.796 173.306 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -72.29 2.39 6.12 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.801 0.334 . . . . 3.68 111.881 -171.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -100.22 -111.52 0.19 Allowed 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 108.652 -0.87 . . . . 2.7 108.652 171.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 178.3 131.35 0.07 Allowed 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.606 -0.887 . . . . 2.34 108.606 173.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 2.8 t -129.04 94.05 2.27 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.705 -0.48 . . . . 1.66 109.705 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.425 ' HA ' ' HA ' ' A' ' 36' ' ' THR . 4.8 tt0 -67.99 146.28 53.7 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 110.148 -0.316 . . . . 1.53 110.148 177.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 9.8 mt . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.427 -0.797 . . . . 1.57 110.133 -178.598 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.586 0 N-CA-C 112.177 -0.369 . . . . 2.47 112.177 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 313' ' ' GLY . . . . . 0.488 ' HA2' ' OD2' ' A' ' 120' ' ' ASP . . . 114.4 -37.33 3.58 Favored Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 111.276 -0.73 . . . . 1.97 111.276 -174.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -158.09 126.06 5.3 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.907 -0.775 . . . . 3.98 108.907 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.842 -0.599 . . . . 4.91 109.597 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_endo . . . . . 0 N--CA 1.48 0.709 0 N-CA-C 110.483 -0.622 . . . . 6.97 110.483 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -137.2 70.08 1.4 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.167 0.508 . . . . 6.2 110.244 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 121.03 43.04 0.45 Allowed Glycine 0 N--CA 1.447 -0.61 0 CA-C-N 115.696 -0.684 . . . . 3.98 112.058 -179.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 33.3 p -69.4 151.3 46.29 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.63 -0.285 . . . . 2.49 110.438 178.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.465 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 6.1 mt-10 -55.85 123.51 14.49 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 121.471 0.653 . . . . 2.07 112.407 -178.169 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.459 ' O ' ' HB2' ' A' ' 94' ' ' TYR . 5.1 p -116.43 -16.68 8.47 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.939 0 CA-C-N 114.783 -1.099 . . . . 1.5 109.216 173.558 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -160.52 142.14 12.38 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.305 -0.861 . . . . 1.85 109.053 175.591 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.445 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 23.0 t-20 -134.92 127.12 18.16 Favored Pre-proline 0 C--N 1.316 -0.871 0 CA-C-O 120.639 0.257 . . . . 1.62 110.57 -179.661 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -72.97 -44.89 0.52 Allowed 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 122.837 2.358 . . . . 2.05 112.344 175.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.0 m -74.15 -38.22 63.81 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.743 -0.662 . . . . 2.24 110.719 -175.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.445 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 0.2 OUTLIER -85.78 130.31 51.22 Favored Pre-proline 0 C--N 1.322 -0.612 0 N-CA-C 109.055 -0.72 . . . . 3.33 109.055 177.183 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.434 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 18.6 Cg_endo -57.5 137.8 83.14 Favored 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.794 2.329 . . . . 1.8 112.907 -175.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -150.67 84.66 0.16 Allowed Glycine 0 N--CA 1.446 -0.656 0 CA-C-N 114.775 -1.102 . . . . 0.97 110.503 -178.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -100.78 -177.84 3.59 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.101 0.477 . . . . 2.37 111.338 -172.277 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.3 ttmt -123.76 100.0 6.56 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.712 -0.676 . . . . 3.13 110.09 177.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 18.0 p -101.13 173.94 6.23 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 116.41 -0.359 . . . . 1.29 110.042 175.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.518 HD22 ' HG2' ' A' ' 141' ' ' PRO . 0.0 OUTLIER -65.68 -38.4 89.18 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.252 -0.431 . . . . 1.47 110.598 178.779 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.508 ' NE2' ' HG2' ' A' ' 144' ' ' GLU . 1.5 tt0 -62.9 -42.77 99.89 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 120.619 0.247 . . . . 1.04 110.856 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.401 ' HB2' ' HA ' ' A' ' 97' ' ' SER . 0.8 OUTLIER -61.07 -54.09 49.03 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.165 -0.471 . . . . 1.39 110.601 179.917 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.3 mm-40 -63.36 -35.55 80.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.988 -0.551 . . . . 1.75 110.781 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -58.39 -64.05 1.06 Allowed 'General case' 0 C--O 1.217 -0.641 0 CA-C-N 116.181 -0.463 . . . . 1.2 110.359 177.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.556 ' SD ' ' HB3' ' A' ' 101' ' ' CYS . 3.3 ttm -60.15 -32.84 71.42 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.414 -0.217 . . . . 1.76 110.414 -174.479 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -59.31 -58.11 10.06 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.904 -0.589 . . . . 1.47 111.056 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.4 m-80 -86.19 -28.04 24.14 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.146 -0.479 . . . . 0.53 112.054 -175.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 95.7 t -88.63 -56.57 5.06 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.926 0 CA-C-N 116.093 -0.503 . . . . 1.11 111.641 -176.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 92.5 t -80.08 -65.74 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.395 -0.366 . . . . 1.07 111.892 -170.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -63.57 -34.45 67.69 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 C-N-CA 120.601 -0.439 . . . . 1.44 111.526 -174.425 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.89 -32.0 73.25 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.935 -0.306 . . . . 2.85 111.442 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 51.1 m -75.64 -37.5 59.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.842 0.353 . . . . 1.23 110.329 177.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.56 -40.81 97.94 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.162 -0.681 . . . . 1.11 109.162 174.031 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 12.4 t-105 -59.12 -37.56 77.51 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.115 -0.948 . . . . 0.44 111.494 178.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 14.3 mttm -88.86 9.27 25.37 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.178 0.436 . . . . 2.75 112.178 -175.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 16.3 t-80 -79.51 144.98 33.46 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.422 -0.584 . . . . 0.47 109.422 174.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -79.9 -12.75 59.72 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.616 0.246 . . . . 1.91 111.543 -174.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 3.7 m-30 -99.43 -8.16 25.12 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.992 0.425 . . . . 1.24 110.653 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -95.36 16.34 17.07 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.084 0.469 . . . . 1.09 110.808 -179.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.443 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 60.3 p-90 -62.38 -34.14 14.14 Favored Pre-proline 0 CA--C 1.548 0.867 0 N-CA-C 114.282 1.216 . . . . 0.65 114.282 -174.577 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.443 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 59.4 Cg_endo -90.58 9.88 3.05 Favored 'Trans proline' 0 C--N 1.36 1.148 0 CA-C-N 121.204 1.466 . . . . 0.61 112.866 -178.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -106.39 6.97 30.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.184 -0.462 . . . . 1.52 110.88 -177.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.8 m-30 -75.66 -24.87 56.4 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.212 -0.449 . . . . 1.01 111.966 -175.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.16 128.15 31.43 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 116.482 -0.326 . . . . 2.11 111.325 -171.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.499 ' HA ' ' OD2' ' A' ' 82' ' ' ASP . 27.0 Cg_endo -63.12 133.22 39.91 Favored 'Trans proline' 0 C--O 1.236 0.424 0 C-N-CA 122.667 2.244 . . . . 1.1 111.482 178.037 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.7 t -59.62 110.48 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 122.189 0.995 . . . . 1.46 111.676 -178.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -121.17 125.89 48.3 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 113.848 -1.524 . . . . 1.85 106.977 167.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.518 ' HB1' ' NE2' ' A' ' 74' ' ' HIS . . . -63.09 -12.49 27.26 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.62 0.6 . . . . 1.43 112.62 -170.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.9 mp -106.58 -42.44 6.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 120.84 0.352 . . . . 2.38 110.497 -177.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 36.1 tptt -67.09 -44.12 80.81 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.056 -0.52 . . . . 3.34 111.076 179.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -97.54 -3.77 39.12 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.374 -0.375 . . . . 2.3 110.693 -179.123 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 53.37 63.04 2.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.607 -0.724 . . . . 1.89 110.689 -176.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -119.81 70.09 13.58 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 115.749 -0.66 . . . . 2.18 110.235 -179.037 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.79 -24.78 8.34 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.388 2.059 . . . . 1.42 112.622 -175.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -96.76 -8.18 31.9 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.004 0.43 . . . . 1.97 110.708 -178.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.57 ' O ' ' HB ' ' A' ' 77' ' ' ILE . 17.6 t80 -61.91 -40.17 94.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.762 -0.654 . . . . 1.53 110.208 178.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.518 ' NE2' ' HB1' ' A' ' 65' ' ' ALA . 9.5 m-70 -80.33 3.82 19.83 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.877 -0.601 . . . . 1.22 111.174 -178.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -108.16 -50.12 3.09 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.032 0.444 . . . . 3.34 110.114 179.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.0 mt -78.71 -36.95 20.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.74 -0.664 . . . . 1.5 110.692 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.57 ' HB ' ' O ' ' A' ' 73' ' ' TYR . 28.1 mm -99.79 135.6 34.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.903 -0.59 . . . . 1.19 109.819 -178.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.66 -40.64 14.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.813 0.339 . . . . 2.35 111.019 -176.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 10.1 m-20 -113.26 95.73 36.5 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.196 -0.456 . . . . 2.05 110.03 177.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -68.59 92.87 0.42 Allowed 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.924 2.416 . . . . 1.24 112.306 -178.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 13.3 mmt -135.79 167.28 21.46 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.121 -0.49 . . . . 1.39 110.633 -178.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.499 ' OD2' ' HA ' ' A' ' 62' ' ' PRO . 3.0 p-10 -151.49 -123.19 0.04 OUTLIER 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.044 -0.98 . . . . 1.42 108.788 -177.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -125.31 -17.77 5.55 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.082 0.467 . . . . 1.14 110.301 177.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.448 ' O ' ' HB2' ' A' ' 88' ' ' LYS . . . -88.65 -23.97 34.57 Favored Glycine 0 N--CA 1.44 -1.088 0 N-CA-C 110.304 -1.118 . . . . 0.33 110.304 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -76.89 -39.98 49.08 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.332 -0.434 . . . . 1.6 110.442 175.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.528 HG22 ' SG ' ' A' ' 101' ' ' CYS . 38.9 mt -59.8 -49.09 85.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.707 -0.679 . . . . 1.63 110.369 176.764 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.402 ' HG3' ' O ' ' A' ' 84' ' ' GLY . 0.2 OUTLIER -67.14 -28.94 68.55 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.367 -0.379 . . . . 1.71 110.682 179.138 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.448 ' HB2' ' O ' ' A' ' 84' ' ' GLY . 11.1 tttt -64.89 -41.73 95.38 Favored 'General case' 0 N--CA 1.457 -0.089 0 CA-C-O 121.049 0.452 . . . . 2.93 110.691 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 10.0 mtp180 -75.25 -32.35 61.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.012 -0.54 . . . . 1.49 110.68 178.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 8.1 mt -63.52 -53.17 56.09 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.863 -0.608 . . . . 1.14 111.167 178.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -66.79 -30.38 70.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.079 -0.51 . . . . 1.39 111.211 -176.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 12.4 m-80 -84.15 0.0 50.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.151 -0.477 . . . . 1.66 111.184 -177.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 60.52 50.97 5.42 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.705 0.628 . . . . 1.75 111.393 178.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . 0.465 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 61.3 t80 -82.87 -33.59 26.99 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.082 -0.508 . . . . 1.3 111.193 179.279 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.68 ' CD1' ' HB3' ' A' ' 100' ' ' GLU . 41.0 m-85 -90.78 169.45 10.94 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 121.541 0.686 . . . . 1.72 111.607 -176.148 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . 0.434 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 2.0 t90 -88.3 -44.7 10.62 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 114.526 -1.215 . . . . 1.15 109.2 169.314 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.401 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 35.3 t -152.12 177.18 10.77 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.139 -0.937 . . . . 1.05 110.224 -172.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -69.29 -18.05 63.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.928 0.394 . . . . 1.31 111.284 -177.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.57 -18.44 64.87 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.075 -0.511 . . . . 1.12 110.874 178.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.68 ' HB3' ' CD1' ' A' ' 95' ' ' TYR . 1.5 mt-10 -86.32 -39.95 15.96 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 109.435 -0.58 . . . . 2.44 109.435 177.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . 0.556 ' HB3' ' SD ' ' A' ' 42' ' ' MET . 0.1 OUTLIER -68.58 -30.84 69.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.432 -0.804 . . . . 1.24 110.758 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 9.6 ttm -56.78 -33.43 66.63 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.031 -0.532 . . . . 1.66 110.595 177.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -66.28 -41.35 89.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.847 -0.615 . . . . 3.72 110.539 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -76.51 -38.91 54.44 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.089 -0.505 . . . . 1.87 110.494 -178.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.7 -47.0 87.36 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.159 -0.473 . . . . 0.45 110.194 177.06 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -57.53 -47.1 82.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.852 -0.613 . . . . 1.23 109.823 175.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 89.1 m -59.95 -50.15 74.88 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.657 -0.701 . . . . 1.09 111.077 179.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.03 -41.69 68.33 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 122.594 0.357 . . . . 1.44 111.496 -178.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -70.31 -47.5 60.84 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.0 0.429 . . . . 0.29 110.043 -177.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 38.1 p -66.63 -30.52 70.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.883 -0.599 . . . . 1.33 111.144 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . 0.497 ' HB3' ' HH ' ' A' ' 73' ' ' TYR . 23.3 m-20 -54.9 -45.54 74.72 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-O 121.188 0.518 . . . . 2.36 110.127 178.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 18.6 t -61.76 -41.5 97.76 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.252 -0.885 . . . . 1.09 110.808 179.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -71.16 -22.96 61.98 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.168 -0.469 . . . . 1.17 111.531 -176.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 51.7 mt -93.15 -52.3 10.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.968 0.413 . . . . 1.18 111.609 -179.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -66.31 -35.31 80.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.685 -0.689 . . . . 1.6 111.474 -173.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -106.49 -174.41 2.53 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.119 -0.491 . . . . 1.37 110.73 -176.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.439 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 0.0 OUTLIER -80.93 145.73 57.83 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 116.585 -0.28 . . . . 3.92 110.257 178.978 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -64.29 -9.08 18.55 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.671 2.248 . . . . 1.32 112.628 179.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.35 26.68 7.28 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.037 -0.528 . . . . 1.71 110.369 177.154 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . 0.439 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 0.4 OUTLIER -84.18 171.35 12.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.499 . . . . 1.34 111.197 -177.518 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -65.03 -53.05 51.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.745 -0.661 . . . . 1.44 110.607 -177.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 3.1 tp -63.97 -29.61 47.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.629 -0.714 . . . . 1.16 111.104 -178.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 2.0 t -70.35 -43.62 78.19 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-O 121.085 0.469 . . . . 1.1 110.02 177.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.32 -37.29 74.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.508 -0.769 . . . . 1.22 109.55 177.315 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' MET . . . . . 0.445 ' O ' HD12 ' A' ' 129' ' ' LEU . 33.1 mtt -70.54 -45.68 65.05 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.179 -0.919 . . . . 1.25 110.825 178.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.84 -34.91 63.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 1.1 111.973 -178.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.39 -47.06 85.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.69 -0.232 . . . . 2.08 111.054 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -70.81 -39.27 73.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.061 0.457 . . . . 1.04 110.606 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.445 HD12 ' O ' ' A' ' 125' ' ' MET . 4.7 mp -56.9 -41.37 77.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.431 -0.804 . . . . 1.16 110.491 177.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -59.82 -30.34 68.86 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.281 -0.872 . . . . 1.47 112.355 -178.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.532 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 9.3 mmtp -63.25 -49.1 75.45 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 120.629 0.252 . . . . 2.7 110.605 -171.26 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -72.49 -24.57 21.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.359 -0.382 . . . . 1.79 110.86 -179.53 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.514 ' O ' HG22 ' A' ' 137' ' ' VAL . 26.4 t80 -63.16 -62.58 1.6 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.247 -0.433 . . . . 0.52 110.564 178.165 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.59 -22.75 62.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.888 0.375 . . . . 1.26 110.689 -175.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.532 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -65.03 -51.16 63.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.849 -0.614 . . . . 2.07 110.447 179.798 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 40.8 mttt -80.8 -15.31 56.74 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.058 -0.519 . . . . 2.11 111.146 -175.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.514 HG22 ' O ' ' A' ' 133' ' ' PHE . 38.8 t -80.49 -35.22 15.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.227 -0.442 . . . . 1.09 110.083 177.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -69.51 -11.17 60.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.215 0.531 . . . . 1.21 110.793 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -97.48 -8.63 28.81 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.84 -0.618 . . . . 1.94 110.616 179.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -71.71 139.66 83.51 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 116.094 -0.503 . . . . 1.34 111.018 -177.465 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.518 ' HG2' HD22 ' A' ' 37' ' ' ASN . 56.2 Cg_endo -72.0 98.43 0.9 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.653 2.235 . . . . 0.67 111.969 177.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . 0.421 ' HA ' ' NE2' ' A' ' 38' ' ' GLN . 0.3 OUTLIER -73.66 -8.45 56.04 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.014 0.435 . . . . 3.68 110.604 -179.996 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -66.81 -35.46 80.11 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.082 -0.71 . . . . 2.7 109.082 174.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.508 ' HG2' ' NE2' ' A' ' 38' ' ' GLN . 0.0 OUTLIER 74.72 143.17 0.07 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 114.037 -1.438 . . . . 2.34 112.651 174.31 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . 0.43 ' O ' ' HB3' ' A' ' 37' ' ' ASN . 2.9 t -140.62 104.16 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-N 114.321 -1.309 . . . . 1.66 108.86 176.025 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -72.29 141.32 48.88 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.877 -0.416 . . . . 1.53 109.877 178.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 34.8 mt . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.495 -0.764 . . . . 1.57 109.829 -178.543 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.658 0 N-CA-C 111.759 -0.536 . . . . 2.47 111.759 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 104.71 -68.79 0.26 Allowed Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.927 -0.654 . . . . 1.97 111.708 -177.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -114.54 115.02 26.54 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.252 -0.647 . . . . 3.98 109.252 -179.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.729 0 CA-C-O 118.73 -0.652 . . . . 4.91 109.861 179.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_endo . . . . . 0 N--CA 1.48 0.707 0 N-CA-C 110.255 -0.709 . . . . 6.97 110.255 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -104.08 152.5 22.01 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.788 -0.449 . . . . 6.2 109.788 178.007 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.45 -83.37 0.88 Allowed Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.852 -0.69 . . . . 3.98 112.122 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 78.5 p -86.45 133.84 33.73 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.742 0.306 . . . . 2.49 111.401 -177.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.631 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 6.0 mt-10 -65.89 132.04 47.7 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.882 -0.599 . . . . 2.07 111.836 177.323 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -113.04 -12.46 11.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.512 -0.767 . . . . 1.5 110.218 176.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.2 m -156.21 138.92 15.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.502 -0.772 . . . . 1.85 109.204 178.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.472 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 19.6 t-20 -144.5 138.01 14.27 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-O 120.696 0.284 . . . . 1.62 110.412 178.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -69.94 -48.25 0.72 Allowed 'Trans proline' 0 CA--C 1.531 0.366 0 C-N-CA 123.138 2.559 . . . . 2.05 113.287 177.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.515 ' O ' ' HD3' ' A' ' 32' ' ' PRO . 28.2 t -77.1 -33.07 57.01 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.952 0.406 . . . . 2.24 110.729 -175.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.472 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 0.6 OUTLIER -92.01 104.22 10.11 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.82 -0.627 . . . . 3.33 109.85 177.981 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.515 ' HD3' ' O ' ' A' ' 30' ' ' SER . 16.2 Cg_exo -68.64 154.13 72.05 Favored 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 122.69 2.26 . . . . 1.8 112.845 -177.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -131.27 121.85 3.29 Favored Glycine 0 N--CA 1.441 -0.973 0 N-CA-C 110.291 -1.124 . . . . 0.97 110.291 178.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.476 ' HG3' ' CE2' ' A' ' 96' ' ' TRP . 1.5 mmm180 -131.47 171.91 12.83 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.895 0.379 . . . . 2.37 110.576 -174.289 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.94 103.32 12.34 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.105 -0.498 . . . . 3.13 110.134 179.341 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.421 ' HA ' ' HA ' ' A' ' 146' ' ' GLU . 23.9 p -109.05 170.18 8.21 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.182 -0.463 . . . . 1.29 111.066 178.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.418 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 55.6 t30 -62.67 -49.78 73.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.964 -0.562 . . . . 1.47 110.8 -179.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.8 tt0 -61.6 -37.43 83.88 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 120.689 0.281 . . . . 1.04 110.781 -179.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.2 -59.2 5.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.932 -0.576 . . . . 1.39 110.884 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -67.37 -29.44 68.97 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 116.081 -0.509 . . . . 1.75 110.742 -178.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.418 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 44.7 t80 -60.63 -63.39 1.32 Allowed 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.796 -0.638 . . . . 1.2 110.872 177.06 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 23.6 ttp -61.04 -28.62 69.19 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.851 0.358 . . . . 1.76 110.358 -173.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 -61.41 -58.48 8.02 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.54 -0.755 . . . . 1.47 111.273 177.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -86.01 -26.59 25.33 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.364 -0.38 . . . . 0.53 111.777 -175.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 93.6 t -89.37 -57.84 3.94 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 N-CA-C 112.382 0.512 . . . . 1.11 112.382 -176.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 67.9 t -81.82 -66.59 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 112.016 0.376 . . . . 1.07 112.016 -170.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -66.43 -34.21 68.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 120.477 -0.489 . . . . 1.44 111.298 -174.016 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.447 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -59.53 -38.04 79.95 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 121.012 -0.275 . . . . 2.85 111.437 178.456 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.7 m -74.6 -35.83 62.97 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.865 -0.334 . . . . 1.23 110.711 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.26 -33.86 76.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.266 0.555 . . . . 1.11 109.574 176.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 18.2 t-105 -65.06 -31.18 72.27 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.472 -0.786 . . . . 0.44 110.877 177.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.447 ' HG3' ' O ' ' A' ' 48' ' ' LYS . 13.6 mtpp -83.65 14.87 3.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.888 0.375 . . . . 2.75 111.646 -176.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.503 ' ND1' HD11 ' A' ' 129' ' ' LEU . 4.6 t-80 -98.82 128.43 45.03 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.095 -0.705 . . . . 0.47 109.095 173.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.413 ' NE2' ' HA ' ' A' ' 54' ' ' GLN . 0.0 OUTLIER -85.57 9.74 15.15 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.698 -0.401 . . . . 1.91 111.797 -173.991 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -103.35 -6.95 21.43 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.26 -0.644 . . . . 1.24 109.26 170.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -94.64 14.99 19.29 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.43 -0.804 . . . . 1.09 110.11 177.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.569 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 48.9 p-90 -66.92 -34.54 7.57 Favored Pre-proline 0 CA--C 1.544 0.74 0 N-CA-C 113.467 0.914 . . . . 0.65 113.467 -175.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.569 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 7.6 Cg_exo -73.79 -2.67 12.55 Favored 'Trans proline' 0 C--N 1.364 1.357 0 CA-C-N 121.108 1.431 . . . . 0.61 111.512 177.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.421 ' HZ ' ' SG ' ' A' ' 112' ' ' CYS . 1.9 m-85 -105.64 0.16 26.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.824 -0.626 . . . . 1.52 110.462 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 6.2 m-30 -66.47 -40.47 89.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.331 0.586 . . . . 1.01 110.88 -178.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.64 129.48 28.76 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-N 115.467 -0.788 . . . . 2.11 110.179 -176.587 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.58 ' HA ' ' OD2' ' A' ' 82' ' ' ASP . 19.5 Cg_endo -59.95 147.12 94.03 Favored 'Trans proline' 0 C--O 1.238 0.512 0 C-N-CA 122.964 2.443 . . . . 1.1 113.475 -176.233 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.5 t -86.84 98.88 7.56 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 N-CA-C 108.408 -0.96 . . . . 1.46 108.408 177.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -109.78 12.12 24.14 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 114.812 -1.085 . . . . 1.85 110.896 -174.328 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 77.93 -17.55 0.56 Allowed 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 114.721 -1.127 . . . . 1.43 112.526 177.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.6 mt -109.29 -49.11 7.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 120.811 0.339 . . . . 2.38 110.762 -177.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.6 ttmm -56.96 -43.38 81.53 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.96 -0.563 . . . . 3.34 110.95 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -95.2 0.99 54.56 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.038 -0.528 . . . . 2.3 111.086 179.043 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 53.16 60.43 3.76 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 109.106 -0.701 . . . . 1.89 109.106 -174.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -128.6 66.07 73.52 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 115.497 -0.774 . . . . 2.18 111.662 -170.124 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -77.49 -27.79 6.03 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.186 1.924 . . . . 1.42 111.828 177.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -76.83 -23.99 52.74 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.591 -0.731 . . . . 1.97 110.448 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.46 -43.59 93.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.452 -0.795 . . . . 1.53 110.468 178.254 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -77.66 6.31 7.56 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.254 -0.885 . . . . 1.22 111.195 -175.323 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -108.93 -57.98 2.08 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 120.869 0.366 . . . . 3.34 110.046 -179.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 26.9 mt -73.45 -42.7 56.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.835 -0.62 . . . . 1.5 110.852 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.468 HG13 ' OD1' ' A' ' 111' ' ' ASN . 27.1 mm -87.54 126.39 41.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.188 0.518 . . . . 1.19 110.004 -178.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.05 -53.99 45.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.515 -0.766 . . . . 2.35 110.879 -176.67 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -120.48 95.3 49.02 Favored Pre-proline 0 C--N 1.324 -0.539 0 N-CA-C 109.75 -0.463 . . . . 2.05 109.75 178.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -67.87 100.25 0.6 Allowed 'Trans proline' 0 CA--C 1.528 0.206 0 C-N-CA 122.19 1.926 . . . . 1.24 111.775 178.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.81 159.64 34.22 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.449 0.642 . . . . 1.39 111.428 -176.234 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.58 ' OD2' ' HA ' ' A' ' 62' ' ' PRO . 2.3 p-10 -136.99 -116.21 0.16 Allowed 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.383 -1.281 . . . . 1.42 108.649 -177.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' MET . . . . . 0.408 ' HB2' ' HB3' ' A' ' 59' ' ' PHE . 3.5 ttp -132.71 -19.51 2.34 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.795 0.331 . . . . 1.14 110.645 176.045 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -84.1 -29.13 31.97 Favored Glycine 0 N--CA 1.442 -0.905 0 N-CA-C 110.556 -1.018 . . . . 0.33 110.556 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.19 -39.01 68.93 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.925 0.393 . . . . 1.6 110.492 176.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 62.1 mt -59.76 -50.41 80.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.559 -0.746 . . . . 1.63 110.304 177.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 91' ' ' GLU . 0.0 OUTLIER -70.6 -21.9 62.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.337 -0.392 . . . . 1.71 111.37 -178.6 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.518 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 12.5 tppt? -65.09 -42.6 93.93 Favored 'General case' 0 CA--C 1.526 0.043 0 CA-C-O 120.714 0.292 . . . . 2.93 110.765 179.683 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.459 HH21 ' HE2' ' A' ' 94' ' ' TYR . 63.4 mtp180 -68.26 -32.33 72.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.96 0.409 . . . . 1.49 110.456 176.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.71 ' HG ' ' HH ' ' A' ' 95' ' ' TYR . 4.7 mt -69.13 -59.72 2.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.543 -0.753 . . . . 1.14 111.662 -177.195 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.504 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 16.6 pt-20 -73.95 -15.98 61.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.044 -0.526 . . . . 1.39 111.819 -173.031 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.518 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 0.9 OUTLIER -94.9 -3.39 48.79 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.997 -0.281 . . . . 1.66 110.363 176.962 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 52.3 57.43 6.46 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.653 -0.703 . . . . 1.75 111.186 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . 0.631 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 27.6 t80 -75.7 -48.91 19.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.322 -0.399 . . . . 1.3 110.888 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.71 ' HH ' ' HG ' ' A' ' 90' ' ' LEU . 0.1 OUTLIER -97.92 177.65 5.37 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.211 0.529 . . . . 1.72 111.212 -175.212 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . 0.476 ' CE2' ' HG3' ' A' ' 34' ' ' ARG . 1.9 t-105 -77.92 -48.03 17.28 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.277 -0.874 . . . . 1.15 110.761 -179.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 17.3 t -142.42 168.47 19.66 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.862 0.363 . . . . 1.05 110.892 -173.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -78.23 -11.71 59.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.033 -0.53 . . . . 1.31 111.613 -175.21 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.98 -27.39 66.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.002 0.43 . . . . 1.12 110.581 178.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.98 -36.19 59.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.073 -0.512 . . . . 2.44 110.245 177.537 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -70.75 -19.81 62.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 1.24 110.897 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 11.3 mmt -55.95 -26.12 46.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.191 0.519 . . . . 1.66 110.144 173.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.16 -39.88 60.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.751 -0.659 . . . . 3.72 109.995 176.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.88 -53.98 51.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.817 -0.629 . . . . 1.87 110.345 178.548 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -57.26 -47.7 80.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.497 -0.774 . . . . 0.45 110.605 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -56.85 -44.01 81.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.787 -0.642 . . . . 1.23 110.256 177.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 90.5 m -64.3 -47.47 79.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.02 -0.537 . . . . 1.09 111.317 -179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.405 ' HG3' ' O ' ' A' ' 82' ' ' ASP . 0.3 OUTLIER -51.12 -44.4 61.34 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.734 0.302 . . . . 1.44 111.011 179.298 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -72.68 -47.55 46.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.02 -0.536 . . . . 0.29 110.953 -177.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.4 p -64.75 -37.5 87.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.46 -0.336 . . . . 1.33 110.91 -178.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . 0.468 ' OD1' HG13 ' A' ' 77' ' ' ILE . 0.4 OUTLIER -54.33 -45.43 72.67 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.803 -0.635 . . . . 2.36 110.32 178.1 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . 0.587 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 1.2 m -60.93 -40.58 93.78 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.948 -0.569 . . . . 1.09 110.813 176.328 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -74.6 -19.7 60.21 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.265 -0.425 . . . . 1.17 111.094 -176.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 68.0 mt -93.42 -61.41 2.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.49 -0.323 . . . . 1.18 111.557 -179.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 43.2 t80 -68.89 -49.62 56.68 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.062 0.458 . . . . 1.6 110.446 -175.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . 0.587 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 14.0 m120 -80.02 167.58 20.27 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.654 -0.703 . . . . 1.37 110.214 177.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.485 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 6.4 mttp -98.0 160.73 27.7 Favored Pre-proline 0 C--N 1.318 -0.769 0 N-CA-C 109.739 -0.467 . . . . 3.92 109.739 177.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -61.51 -13.63 30.56 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.474 2.116 . . . . 1.32 111.762 175.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.82 -4.11 44.39 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.251 -0.886 . . . . 1.71 111.284 178.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . 0.606 ' OD2' ' HA2' ' B' ' 313' ' ' GLY . 1.9 m-20 -74.06 148.3 42.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.987 0.422 . . . . 1.34 110.471 -176.724 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.77 -43.56 98.6 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.612 -0.722 . . . . 1.44 111.105 -175.537 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.445 HG21 ' N ' ' A' ' 123' ' ' VAL . 2.0 tp -66.4 -33.1 61.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.874 -0.603 . . . . 1.16 111.291 -178.359 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.445 ' N ' HG21 ' A' ' 122' ' ' ILE . 2.1 t -66.09 -42.06 90.69 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.109 0.48 . . . . 1.1 109.792 178.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.81 -32.14 70.37 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.549 -0.75 . . . . 1.22 110.05 178.242 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 11.2 mtt -79.24 -46.07 18.54 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.591 -0.731 . . . . 1.25 110.518 177.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -55.46 -41.69 73.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.361 -0.381 . . . . 1.1 111.711 -178.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.66 -31.79 73.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.801 0.334 . . . . 2.08 111.235 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -78.06 -38.88 43.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.094 0.473 . . . . 1.04 110.121 176.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.503 HD11 ' ND1' ' A' ' 53' ' ' HIS . 2.2 mp -59.47 -42.46 92.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.414 -0.812 . . . . 1.16 110.172 177.206 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -52.16 -29.36 21.79 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 114.953 -1.021 . . . . 1.47 112.867 -176.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.524 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.1 OUTLIER -60.64 -44.21 96.64 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 120.667 0.27 . . . . 2.7 110.757 -173.955 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -77.77 -23.61 14.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.159 -0.473 . . . . 1.79 111.105 -176.449 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.565 ' O ' HG23 ' A' ' 137' ' ' VAL . 34.1 t80 -65.92 -63.05 1.17 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.504 -0.316 . . . . 0.52 110.578 -179.597 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.97 -21.74 64.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.948 0.404 . . . . 1.26 110.657 -176.298 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.524 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -68.01 -45.47 73.94 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.697 -0.683 . . . . 2.07 110.185 178.089 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.25 -28.51 42.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.042 -0.526 . . . . 2.11 111.082 -179.216 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.565 HG23 ' O ' ' A' ' 133' ' ' PHE . 54.2 t -65.08 -34.47 70.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.135 0.493 . . . . 1.09 110.573 178.019 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.79 -12.61 61.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.308 0.575 . . . . 1.21 110.509 177.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -105.02 0.37 27.59 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.765 -0.652 . . . . 1.94 110.343 179.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' MET . . . . . 0.465 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 11.3 mtp -75.74 141.73 72.57 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.955 -0.566 . . . . 1.34 110.924 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -73.44 92.43 0.85 Allowed 'Trans proline' 0 N--CA 1.462 -0.355 0 C-N-CA 122.324 2.016 . . . . 0.67 110.964 177.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -74.24 -1.65 21.5 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.042 -0.526 . . . . 3.68 111.648 -173.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -82.1 -39.37 23.45 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.65 -0.5 . . . . 2.7 109.65 175.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 72.93 134.23 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 114.504 -1.226 . . . . 2.34 111.697 178.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 34.4 t -142.49 112.24 2.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.299 -0.864 . . . . 1.66 109.14 179.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.421 ' HA ' ' HA ' ' A' ' 36' ' ' THR . 31.1 tt0 -63.13 138.51 58.57 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.719 -0.392 . . . . 1.53 110.396 179.463 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 96.5 mt . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.528 -0.749 . . . . 1.57 110.618 -174.03 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.519 0 N-CA-C 112.09 -0.404 . . . . 2.47 112.09 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 313' ' ' GLY . . . . . 0.606 ' HA2' ' OD2' ' A' ' 120' ' ' ASP . . . 113.7 -66.42 0.26 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.928 -0.653 . . . . 1.97 112.862 176.303 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.59 149.22 31.76 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.81 0.338 . . . . 3.98 110.722 -175.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.924 0 CA-C-O 118.115 -0.945 . . . . 4.91 109.969 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo . . . . . 0 N--CA 1.479 0.646 0 N-CA-C 110.453 -0.634 . . . . 6.97 110.453 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -131.09 97.88 4.42 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.687 -0.486 . . . . 6.2 109.687 178.797 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 91.22 72.16 1.23 Allowed Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.731 -0.747 . . . . 3.98 111.849 -179.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.5 p -57.98 129.6 42.67 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-O 120.957 0.408 . . . . 2.49 111.225 179.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.575 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 19.9 mt-10 -75.68 130.26 38.43 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.591 -0.731 . . . . 2.07 112.627 -175.391 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.4 p -117.81 -7.1 11.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.107 -0.951 . . . . 1.5 109.235 172.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.4 m -162.97 135.38 5.4 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 114.979 -1.01 . . . . 1.85 109.375 175.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -126.94 125.86 24.3 Favored Pre-proline 0 C--N 1.321 -0.633 0 N-CA-C 109.742 -0.466 . . . . 1.62 109.742 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -66.06 -46.63 4.36 Favored 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 123.057 2.505 . . . . 2.05 113.017 -176.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.8 m -77.93 -22.02 50.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.987 0.422 . . . . 2.24 110.97 -176.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.6 ttmt -81.94 113.38 42.64 Favored Pre-proline 0 C--N 1.325 -0.484 0 N-CA-C 109.172 -0.677 . . . . 3.33 109.172 173.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.453 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 12.6 Cg_exo -65.34 147.17 87.28 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 121.778 1.652 . . . . 1.8 111.767 -179.234 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -127.81 130.27 6.66 Favored Glycine 0 N--CA 1.442 -0.913 0 CA-C-N 115.417 -0.811 . . . . 0.97 111.197 -176.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -140.3 -179.96 6.3 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 120.975 0.417 . . . . 2.37 110.167 -178.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.3 106.06 10.76 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.835 -0.62 . . . . 3.13 109.602 177.565 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.3 p -109.14 166.68 10.67 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 120.711 -0.396 . . . . 1.29 110.281 175.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.65 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 0.2 OUTLIER -66.83 -26.56 66.98 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.859 -0.609 . . . . 1.47 110.661 -178.211 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -75.38 -39.29 59.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.817 0.341 . . . . 1.04 110.3 177.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.52 -53.45 56.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.924 -0.58 . . . . 1.39 110.555 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.9 mm100 -70.85 -24.11 62.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.825 -0.625 . . . . 1.75 110.682 -178.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.65 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 35.7 t80 -61.14 -64.11 1.06 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 116.169 -0.468 . . . . 1.2 110.905 177.569 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 2.2 ttm -60.28 -31.71 70.5 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.813 -0.355 . . . . 1.76 110.506 -174.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -59.07 -57.27 13.81 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.734 -0.666 . . . . 1.47 110.997 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -86.28 -29.53 22.99 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.104 0.409 . . . . 0.53 112.104 -176.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 99.3 t -88.31 -57.82 3.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 112.161 0.43 . . . . 1.11 112.161 -175.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 60.2 t -82.14 -66.8 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 112.11 0.411 . . . . 1.07 112.11 -169.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 1.5 p -68.91 -32.9 56.49 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.326 0 C-N-CA 120.711 -0.395 . . . . 1.44 111.411 -174.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.11 -26.1 68.1 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 122.092 -0.38 . . . . 2.85 111.084 177.178 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 35.2 m -85.65 -38.1 18.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.77 0.319 . . . . 1.23 110.503 177.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.48 -39.94 89.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.039 0.447 . . . . 1.11 110.211 177.687 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 29.2 t-105 -60.37 -35.52 75.91 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.47 -0.787 . . . . 0.44 111.662 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.59 -4.1 52.83 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.064 0.394 . . . . 2.75 112.064 -174.036 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.573 ' ND1' ' HB2' ' A' ' 55' ' ' PHE . 10.0 t-80 -75.56 128.71 35.88 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.265 -0.643 . . . . 0.47 109.265 176.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -81.08 7.13 11.66 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.83 0.348 . . . . 1.91 111.46 -174.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.573 ' HB2' ' ND1' ' A' ' 53' ' ' HIS . 2.3 m-30 -103.36 -8.51 20.19 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.514 -0.55 . . . . 1.24 109.514 172.361 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -91.18 9.98 28.93 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.786 -0.643 . . . . 1.09 110.641 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.499 ' CG ' ' HD3' ' A' ' 58' ' ' PRO . 57.8 p-90 -61.9 -35.38 21.22 Favored Pre-proline 0 CA--C 1.547 0.842 0 N-CA-C 113.916 1.08 . . . . 0.65 113.916 -175.21 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.499 ' HD3' ' CG ' ' A' ' 57' ' ' TRP . 3.0 Cg_exo -76.98 -10.78 18.08 Favored 'Trans proline' 0 C--N 1.364 1.358 0 CA-C-N 121.016 1.399 . . . . 0.61 111.733 178.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -101.6 10.84 39.84 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.702 -0.681 . . . . 1.52 110.431 -177.028 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 2.9 m-30 -73.23 -31.67 64.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.794 -0.639 . . . . 1.01 111.001 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -114.59 144.7 32.35 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 115.77 -0.65 . . . . 2.11 110.564 -173.634 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.572 ' HA ' ' OD1' ' A' ' 82' ' ' ASP . 33.3 Cg_endo -66.35 151.46 83.24 Favored 'Trans proline' 0 C--O 1.237 0.474 0 C-N-CA 122.885 2.39 . . . . 1.1 112.905 -178.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 1.4 t -70.42 101.79 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 CA-C-O 122.258 1.028 . . . . 1.46 109.253 173.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -96.16 6.1 49.57 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.336 -1.302 . . . . 1.85 108.993 176.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 69.4 -71.68 0.12 Allowed 'General case' 0 C--O 1.226 -0.137 0 CA-C-N 114.525 -1.216 . . . . 1.43 110.555 -175.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 5.7 mt -65.0 -39.68 86.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 116.372 -0.376 . . . . 2.38 111.09 -176.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.41 -24.25 65.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.034 -0.53 . . . . 3.34 111.766 -179.593 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -117.06 5.74 12.83 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.636 0.255 . . . . 2.3 111.513 -178.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 65.24 35.37 7.76 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.826 -0.624 . . . . 1.89 111.576 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 2.6 mt -120.19 74.03 21.01 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 115.86 -0.609 . . . . 2.18 110.303 177.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.19 -29.85 25.88 Favored 'Trans proline' 0 C--O 1.233 0.25 0 C-N-CA 122.413 2.075 . . . . 1.42 113.216 -173.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -101.74 13.37 35.06 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.263 0.554 . . . . 1.97 111.057 -177.142 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -57.52 -41.25 80.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.68 -0.691 . . . . 1.53 110.442 177.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 18.7 m-70 -76.2 3.42 10.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.738 -0.665 . . . . 1.22 111.744 -176.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.0 mmpt? -97.28 -38.32 9.72 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.05 0.452 . . . . 3.34 109.972 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.9 mt -94.81 -47.7 13.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.962 -0.563 . . . . 1.5 110.037 177.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 41.9 mm -91.66 102.42 13.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.822 -0.626 . . . . 1.19 109.469 179.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.1 mtmt -72.35 -29.15 63.53 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.375 -0.83 . . . . 2.35 111.308 -174.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -116.22 80.17 9.36 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 115.719 -0.673 . . . . 2.05 110.315 178.109 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -69.16 97.69 0.6 Allowed 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.9 2.4 . . . . 1.24 111.865 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.6 mmt -133.36 155.02 50.21 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-O 121.363 0.601 . . . . 1.39 110.673 -177.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.572 ' OD1' ' HA ' ' A' ' 62' ' ' PRO . 5.0 p-10 -134.98 -129.85 0.16 Allowed 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 114.411 -1.268 . . . . 1.42 109.078 -172.029 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.25 -14.54 4.82 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.299 0.571 . . . . 1.14 110.266 178.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -90.62 -32.03 9.71 Favored Glycine 0 N--CA 1.441 -1.021 0 N-CA-C 109.921 -1.271 . . . . 0.33 109.921 -178.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.45 ' OG1' ' HB3' ' A' ' 62' ' ' PRO . 98.0 m -67.79 -37.32 81.88 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.004 -0.598 . . . . 1.6 110.5 173.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.454 HD13 ' O ' ' A' ' 82' ' ' ASP . 54.9 mt -63.22 -50.87 77.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.984 -0.553 . . . . 1.63 109.976 176.137 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.531 ' O ' ' HG2' ' A' ' 91' ' ' GLU . 0.0 OUTLIER -65.47 -29.9 70.62 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.691 -0.686 . . . . 1.71 110.9 -179.737 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 30.6 tttt -66.79 -37.82 85.31 Favored 'General case' 0 C--N 1.337 0.053 0 CA-C-O 120.986 0.422 . . . . 2.93 110.687 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 29.5 mtp180 -74.56 -29.97 61.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.072 -0.513 . . . . 1.49 110.594 178.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.555 ' HG ' ' OH ' ' A' ' 95' ' ' TYR . 2.8 mt -70.09 -57.54 4.85 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.791 -0.64 . . . . 1.14 111.084 179.031 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.531 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 9.0 pt-20 -72.25 -7.23 48.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.888 -0.596 . . . . 1.39 112.081 -173.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -106.58 -4.22 19.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.412 0.148 . . . . 1.66 111.168 178.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 57.69 63.8 1.72 Allowed 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.337 0.589 . . . . 1.75 110.854 -177.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . 0.575 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 18.1 t80 -78.23 -26.4 47.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.603 -0.726 . . . . 1.3 111.404 -179.066 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.555 ' OH ' ' HG ' ' A' ' 90' ' ' LEU . 0.1 OUTLIER -135.62 179.19 6.49 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.056 -0.52 . . . . 1.72 111.202 -172.21 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . 0.453 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 1.8 t-105 -66.55 -47.5 72.65 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.451 -0.795 . . . . 1.15 110.742 178.272 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 26.9 t -150.35 167.06 28.15 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.996 -0.547 . . . . 1.05 110.888 -174.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -76.1 -4.69 42.89 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.762 -0.653 . . . . 1.31 111.682 -175.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.36 -32.08 70.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.05 0.452 . . . . 1.12 110.476 178.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -66.42 -43.25 86.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.755 -0.657 . . . . 2.44 110.011 177.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . 0.443 ' HA ' ' OD1' ' A' ' 104' ' ' ASP . 0.0 OUTLIER -75.73 -20.28 58.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.925 -0.579 . . . . 1.24 111.381 -177.226 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -55.55 -29.17 58.5 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.199 0.523 . . . . 1.66 109.989 174.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -73.55 -41.18 63.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.679 -0.691 . . . . 3.72 110.281 175.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . 0.443 ' OD1' ' HA ' ' A' ' 101' ' ' CYS . 8.9 m-20 -68.04 -38.9 83.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.029 -0.532 . . . . 1.87 110.453 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.21 -46.88 87.28 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.871 -0.604 . . . . 0.45 110.466 177.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -62.55 -42.69 99.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.884 -0.598 . . . . 1.23 109.977 177.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 94.7 m -63.27 -40.21 96.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.487 -0.779 . . . . 1.09 111.687 -179.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.75 -42.68 62.51 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.057 0.456 . . . . 1.44 110.902 177.026 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -71.1 -40.33 71.57 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.93 -0.577 . . . . 0.29 110.988 -178.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -41.56 75.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.604 -0.271 . . . . 1.33 111.115 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -48.16 -53.26 17.42 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.619 -0.718 . . . . 2.36 111.062 178.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . 0.486 ' SG ' HG23 ' A' ' 123' ' ' VAL . 0.1 OUTLIER -63.62 -34.41 77.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.695 -0.684 . . . . 1.09 111.011 -179.636 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . 0.574 ' HH ' HE21 ' A' ' 127' ' ' GLN . 18.5 m-30 -77.22 -17.77 58.21 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.457 -0.338 . . . . 1.17 111.663 -177.374 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 67.5 mt -92.72 -53.63 8.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 120.668 0.27 . . . . 1.18 111.305 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -68.59 -37.75 80.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.322 -0.399 . . . . 1.6 110.53 -176.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -108.7 140.94 41.4 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.082 -0.508 . . . . 1.37 109.654 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.33 146.18 97.77 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 116.434 -0.348 . . . . 3.92 110.507 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -58.93 -12.12 14.25 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.215 2.61 . . . . 1.32 113.511 -177.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.93 -7.59 59.39 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.432 -0.349 . . . . 1.71 111.655 178.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . 0.443 ' OD2' ' HA2' ' B' ' 313' ' ' GLY . 2.0 t70 -81.88 171.03 14.96 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.506 0.669 . . . . 1.34 112.043 -174.209 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . 0.429 ' HB2' ' HA ' ' B' ' 314' ' ' LYS . 12.0 t0 -76.5 -41.58 46.44 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.497 -1.229 . . . . 1.44 110.791 -174.232 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.632 ' HA ' ' SD ' ' A' ' 125' ' ' MET . 2.6 tp -62.15 -35.55 69.47 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.11 0 CA-C-O 120.974 0.416 . . . . 1.16 110.043 179.313 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.486 HG23 ' SG ' ' A' ' 112' ' ' CYS . 12.5 t -69.74 -49.32 58.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.118 -0.492 . . . . 1.1 110.04 177.201 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.9 -40.09 72.52 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.305 -0.862 . . . . 1.22 110.892 -177.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' MET . . . . . 0.632 ' SD ' ' HA ' ' A' ' 122' ' ' ILE . 0.1 OUTLIER -75.58 -38.7 58.93 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.163 -0.472 . . . . 1.25 111.21 179.742 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . 0.424 ' HB1' ' O ' ' A' ' 122' ' ' ILE . . . -60.15 -28.82 68.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.394 -0.366 . . . . 1.1 111.099 177.305 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . 0.574 HE21 ' HH ' ' A' ' 113' ' ' TYR . 0.0 OUTLIER -62.88 -38.52 91.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.26 -0.427 . . . . 2.08 110.815 177.717 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -73.59 -37.63 65.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.094 -0.503 . . . . 1.04 110.151 177.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.526 HD11 ' O ' ' A' ' 125' ' ' MET . 7.1 mp -58.25 -44.75 88.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.532 -0.758 . . . . 1.16 110.213 177.011 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -59.54 -30.56 68.7 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.081 -0.963 . . . . 1.47 111.842 -176.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.485 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -65.38 -46.58 79.54 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.576 -0.284 . . . . 2.7 110.467 -175.023 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -74.0 -21.73 18.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.537 -0.301 . . . . 1.79 110.746 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.538 ' O ' HG22 ' A' ' 137' ' ' VAL . 30.0 t80 -65.12 -62.23 1.67 Allowed 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.334 -0.394 . . . . 0.52 110.299 177.037 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.5 pp -66.59 -26.96 67.35 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.035 0.445 . . . . 1.26 110.341 -177.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.485 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -57.93 -48.22 80.55 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.446 -0.797 . . . . 2.07 111.046 178.708 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.81 -24.41 33.38 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.14 -0.482 . . . . 2.11 110.948 -177.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.538 HG22 ' O ' ' A' ' 133' ' ' PHE . 59.2 t -70.97 -32.04 47.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.086 0.47 . . . . 1.09 110.362 178.273 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -69.53 -10.49 58.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.064 0.459 . . . . 1.21 110.471 177.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -103.34 -3.55 25.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.946 -0.57 . . . . 1.94 110.926 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' MET . . . . . 0.458 ' HG3' ' HA ' ' A' ' 137' ' ' VAL . 0.7 OUTLIER -67.91 143.9 96.76 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.094 -0.503 . . . . 1.34 111.337 -177.883 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -70.77 110.79 2.85 Favored 'Trans proline' 0 N--CA 1.462 -0.356 0 C-N-CA 122.52 2.147 . . . . 0.67 111.675 177.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.05 5.79 7.51 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.913 -0.585 . . . . 3.68 111.917 -175.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.403 ' O ' ' HB3' ' A' ' 144' ' ' GLU . 18.3 mt-10 -103.17 -41.18 6.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.436 -0.347 . . . . 2.7 111.244 -177.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.403 ' HB3' ' O ' ' A' ' 143' ' ' GLU . 2.7 tt0 70.95 101.57 0.06 Allowed 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.991 0.807 . . . . 2.34 110.866 -177.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 2.6 t -108.52 133.96 51.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.135 -0.691 . . . . 1.66 109.135 176.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -80.63 148.18 30.37 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.004 0.43 . . . . 1.53 111.13 -176.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 22.0 mt . . . . . 0 C--O 1.247 0.955 0 CA-C-O 118.896 -0.573 . . . . 1.57 110.142 178.134 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.663 0 N-CA-C 111.57 -0.612 . . . . 2.47 111.57 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 313' ' ' GLY . . . . . 0.591 ' O ' ' HB2' ' B' ' 314' ' ' LYS . . . 141.66 76.6 0.04 OUTLIER Glycine 0 N--CA 1.443 -0.861 0 N-CA-C 110.482 -1.047 . . . . 1.97 110.482 -175.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 314' ' ' LYS . . . . . 0.591 ' HB2' ' O ' ' B' ' 313' ' ' GLY . 11.8 mtmt 79.37 99.87 0.06 Allowed 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.442 0.697 . . . . 3.98 109.465 -174.524 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 52.7 mttt . . . . . 0 C--O 1.248 0.994 0 CA-C-N 115.541 -0.754 . . . . 4.91 109.796 179.008 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.441 ' HD2' ' OD1' ' A' ' 79' ' ' ASN . 8.2 Cg_endo . . . . . 0 N--CA 1.48 0.719 0 N-CA-C 110.384 -0.66 . . . . 6.97 110.384 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 33.0 tp -95.29 111.68 23.5 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.894 -0.41 . . . . 6.2 109.894 176.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.23 81.9 1.2 Allowed Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.59 -0.814 . . . . 3.98 111.152 -176.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 61.1 p -90.64 142.3 27.9 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 122.105 0.162 . . . . 2.49 111.056 -178.049 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.611 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 7.4 mt-10 -52.12 125.08 14.56 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 123.595 0.56 . . . . 2.07 111.812 175.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 7.2 p -106.71 -18.09 7.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 115.773 -0.649 . . . . 1.5 109.847 175.257 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -158.95 137.08 10.55 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.123 -0.944 . . . . 1.85 110.001 176.26 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.437 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 23.8 t-20 -136.8 122.92 13.47 Favored Pre-proline 0 C--N 1.32 -0.69 0 N-CA-C 109.357 -0.608 . . . . 1.62 109.357 173.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -60.4 -46.31 18.5 Favored 'Trans proline' 0 N--CA 1.474 0.338 0 C-N-CA 123.249 2.633 . . . . 2.05 113.008 -175.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.3 m -78.97 -30.04 44.25 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 116.037 -0.529 . . . . 2.24 110.957 -175.201 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.437 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 24.4 tttp -67.41 134.03 93.04 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.564 -0.744 . . . . 3.33 111.419 -177.378 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_exo -49.18 141.11 24.2 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 123.182 2.588 . . . . 1.8 112.993 173.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -158.91 117.07 0.75 Allowed Glycine 0 N--CA 1.443 -0.84 0 N-CA-C 110.218 -1.153 . . . . 0.97 110.218 177.282 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.409 ' HE ' ' CD ' ' A' ' 146' ' ' GLU . 7.2 mmm180 -131.55 158.82 39.94 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.013 0.435 . . . . 2.37 110.935 -175.377 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.5 mtpp -103.6 84.52 2.3 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.981 -0.554 . . . . 3.13 109.598 176.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.6 p -87.17 168.56 13.13 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.244 -0.434 . . . . 1.29 110.515 -179.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -59.12 -50.98 71.97 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-N 116.489 -0.323 . . . . 1.47 110.749 -178.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.504 ' HB2' ' OE2' ' A' ' 144' ' ' GLU . 1.7 mt-30 -59.21 -39.83 83.92 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.711 0.291 . . . . 1.04 111.222 -179.006 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -61.66 -55.17 33.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.109 -0.496 . . . . 1.39 110.72 -179.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 18.2 mm100 -68.53 -30.47 69.29 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.872 -0.603 . . . . 1.75 110.862 -179.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -61.6 -63.36 1.3 Allowed 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.825 -0.625 . . . . 1.2 110.488 176.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.478 ' SD ' ' HB3' ' A' ' 101' ' ' CYS . 0.1 OUTLIER -58.44 -33.62 69.9 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 110.175 -0.306 . . . . 1.76 110.175 -175.418 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -56.98 -56.62 19.34 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.569 -0.741 . . . . 1.47 111.121 178.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 61.3 m-80 -86.66 -28.16 23.34 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.285 -0.416 . . . . 0.53 112.039 -176.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 94.5 t -89.61 -56.89 4.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 N-CA-C 112.243 0.46 . . . . 1.11 112.243 -176.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 59.9 t -79.41 -65.82 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 121.012 -0.275 . . . . 1.07 111.521 -172.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.467 HG13 ' O ' ' A' ' 42' ' ' MET . 1.9 m -63.49 -33.58 62.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 N-CA-C 111.75 0.278 . . . . 1.44 111.75 -174.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.05 -39.35 86.92 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 121.102 -0.239 . . . . 2.85 111.53 -178.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 5.9 m -75.1 -33.26 61.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.728 0.299 . . . . 1.23 110.642 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -67.03 -41.06 87.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.324 0.583 . . . . 1.11 109.595 174.128 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 6.9 t-105 -63.03 -35.79 81.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.607 -0.724 . . . . 0.44 111.253 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.3 mmpt? -87.62 22.75 2.15 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.25 0.463 . . . . 2.75 112.25 -175.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.533 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 12.9 t-80 -96.24 139.99 31.59 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.42 -0.354 . . . . 0.47 110.07 175.232 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 40.6 mm-40 -81.44 7.03 12.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.777 0.323 . . . . 1.91 111.852 -176.126 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.533 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.7 OUTLIER -115.2 -7.29 12.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.022 0.439 . . . . 1.24 110.165 175.673 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -99.0 11.05 40.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.059 0.457 . . . . 1.09 110.939 -177.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.584 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 32.4 p-90 -63.24 -33.84 11.75 Favored Pre-proline 0 CA--C 1.547 0.855 0 N-CA-C 113.88 1.067 . . . . 0.65 113.88 -175.114 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.584 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 5.9 Cg_exo -78.97 -0.61 10.9 Favored 'Trans proline' 0 C--N 1.359 1.124 0 CA-C-N 121.2 1.464 . . . . 0.61 112.289 176.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -97.99 -2.01 41.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.121 -0.491 . . . . 1.52 110.614 -175.566 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.552 ' CZ ' ' HA ' ' A' ' 57' ' ' TRP . 13.1 m-30 -74.55 -11.7 60.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.02 -0.536 . . . . 1.01 110.603 179.24 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -106.96 119.71 50.42 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 115.902 -0.59 . . . . 2.11 111.23 -170.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.588 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 21.5 Cg_exo -63.44 145.45 92.36 Favored 'Trans proline' 0 C--O 1.237 0.438 0 C-N-CA 122.933 2.422 . . . . 1.1 113.103 -178.621 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 22.3 t -91.01 90.1 3.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 122.119 0.961 . . . . 1.46 108.847 177.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.442 ' O ' ' HB1' ' A' ' 65' ' ' ALA . 0.6 OUTLIER -108.14 5.12 25.61 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.783 -1.099 . . . . 1.85 110.677 -176.774 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.454 ' HB2' ' NE2' ' A' ' 74' ' ' HIS . . . 79.28 -29.73 0.14 Allowed 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.003 -0.999 . . . . 1.43 112.58 177.385 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -98.76 -49.54 11.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 120.855 0.359 . . . . 2.38 111.901 -174.423 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.01 -22.45 49.28 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.136 -0.484 . . . . 3.34 111.632 -173.109 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.2 tp -112.87 3.59 16.44 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.864 0.364 . . . . 2.3 110.767 177.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . 0.549 ' O ' HD12 ' A' ' 70' ' ' LEU . 15.4 t-20 53.68 69.41 0.71 Allowed 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.461 -0.791 . . . . 1.89 110.88 -178.378 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.549 HD12 ' O ' ' A' ' 69' ' ' ASN . 0.0 OUTLIER -133.31 64.18 68.46 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.584 -0.735 . . . . 2.18 110.596 178.218 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -78.54 -38.8 0.47 Allowed 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.417 2.078 . . . . 1.42 112.548 -178.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -77.97 -15.95 58.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.512 0.672 . . . . 1.97 109.896 -178.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.492 ' HA ' ' CE1' ' A' ' 115' ' ' TYR . 13.2 t80 -53.43 -41.6 66.23 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.845 -1.07 . . . . 1.53 111.007 177.102 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.454 ' NE2' ' HB2' ' A' ' 65' ' ' ALA . 1.8 m-70 -80.35 3.84 19.85 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.585 -0.734 . . . . 1.22 111.724 -173.053 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.9 mttp -88.14 -21.98 24.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.396 0.617 . . . . 3.34 109.589 178.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.8 mp -117.63 -46.42 3.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.143 -0.935 . . . . 1.5 110.339 -179.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.5 mm -86.84 111.56 21.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.009 -0.541 . . . . 1.19 110.476 -179.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.91 -29.5 58.43 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.072 -0.513 . . . . 2.35 110.87 -179.5 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . 0.441 ' OD1' ' HD2' ' A' ' 21' ' ' PRO . 57.1 m-20 -119.84 81.95 27.06 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 116.031 -0.531 . . . . 2.05 109.962 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -76.06 98.85 1.23 Allowed 'Trans proline' 0 N--CA 1.464 -0.235 0 C-N-CA 123.265 2.644 . . . . 1.24 112.091 -177.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -132.81 174.97 9.75 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.51 0.671 . . . . 1.39 111.087 -176.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.588 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 3.1 p-10 -152.38 -126.99 0.04 OUTLIER 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.555 -1.202 . . . . 1.42 109.135 -173.255 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -126.24 -14.28 5.98 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.185 0.517 . . . . 1.14 110.188 -179.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.457 ' O ' ' HG3' ' A' ' 88' ' ' LYS . . . -92.7 -33.19 7.59 Favored Glycine 0 N--CA 1.438 -1.191 0 N-CA-C 110.157 -1.177 . . . . 0.33 110.157 -179.066 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -65.56 -41.0 93.43 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.107 0.48 . . . . 1.6 110.435 176.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.428 HG12 ' HB3' ' A' ' 104' ' ' ASP . 79.0 mt -61.79 -47.95 90.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.365 -0.834 . . . . 1.63 109.935 175.074 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -32.28 73.39 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.692 -0.686 . . . . 1.71 111.136 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.457 ' HG3' ' O ' ' A' ' 84' ' ' GLY . 33.4 mttm -59.9 -52.9 63.43 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 120.951 0.405 . . . . 2.93 110.515 178.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -70.47 -30.42 67.23 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.633 -0.712 . . . . 1.49 111.233 -177.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.2 mt -66.14 -56.69 10.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.022 0.439 . . . . 1.14 111.119 178.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -68.42 -28.78 67.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.853 -0.612 . . . . 1.39 111.167 -177.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -80.69 -10.92 59.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.524 -0.307 . . . . 1.66 110.873 179.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 60.34 61.87 1.69 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.674 -0.694 . . . . 1.75 110.189 -178.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . 0.611 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 31.9 t80 -79.75 -52.73 7.56 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.79 -0.641 . . . . 1.3 111.434 -178.223 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -97.03 -178.71 4.29 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.071 0.462 . . . . 1.72 110.955 -175.32 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 -72.59 -54.08 10.12 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.589 -0.732 . . . . 1.15 111.216 -179.255 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 26.4 t -145.32 -178.82 6.26 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.054 0.454 . . . . 1.05 111.495 -172.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -76.81 -7.07 54.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.997 -0.547 . . . . 1.31 111.132 -177.028 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -34.86 73.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.323 0.583 . . . . 1.12 109.82 175.183 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.09 -30.79 62.52 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.418 -0.81 . . . . 2.44 110.14 177.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . 0.478 ' HB3' ' SD ' ' A' ' 42' ' ' MET . 0.1 OUTLIER -74.36 -28.56 61.18 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.485 -0.779 . . . . 1.24 111.242 -179.258 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.77 -36.07 73.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.148 0.499 . . . . 1.66 110.326 177.616 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -70.05 -40.24 75.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.572 -0.74 . . . . 3.72 110.417 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . 0.428 ' HB3' HG12 ' A' ' 86' ' ' ILE . 0.3 OUTLIER -70.06 -49.65 49.01 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.015 -0.539 . . . . 1.87 111.05 -176.55 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.66 -45.26 77.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.073 -0.512 . . . . 0.45 110.948 -179.496 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -60.56 -45.33 94.29 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.142 -0.481 . . . . 1.23 110.294 177.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 66.4 m -64.4 -37.15 86.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.79 -0.641 . . . . 1.09 111.462 -178.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -34.73 71.08 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.214 -0.448 . . . . 1.44 110.69 177.176 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -79.21 -36.93 39.36 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.37 -0.377 . . . . 0.29 110.515 -178.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.0 -37.23 86.96 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.764 0.316 . . . . 1.33 110.611 175.566 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -43.63 -55.06 4.56 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.271 -0.877 . . . . 2.36 110.925 177.58 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . 0.516 ' SG ' HG23 ' A' ' 123' ' ' VAL . 2.1 t -58.76 -47.73 83.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.196 -0.911 . . . . 1.09 111.906 -179.509 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 47.7 m-85 -74.85 -15.92 60.7 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.719 0.637 . . . . 1.17 112.719 -170.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 85.5 mt -91.77 -54.33 7.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.759 0.314 . . . . 1.18 111.271 -179.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . 0.492 ' CE1' ' HA ' ' A' ' 73' ' ' TYR . 41.7 t80 -78.24 -40.35 37.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.78 0.324 . . . . 1.6 111.194 -175.31 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 72.6 m-20 -86.12 -168.57 2.28 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.376 -0.375 . . . . 1.37 110.481 -177.252 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.26 154.07 43.78 Favored Pre-proline 0 C--N 1.32 -0.693 0 N-CA-C 110.526 -0.176 . . . . 3.92 110.526 -177.466 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -58.61 -25.97 77.08 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.409 2.072 . . . . 1.32 112.276 177.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.79 16.37 25.28 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.124 -0.489 . . . . 1.71 111.325 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -76.52 159.72 30.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.47 . . . . 1.34 110.976 -177.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -69.56 -47.88 62.17 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.362 -0.836 . . . . 1.44 110.02 -178.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.442 HG23 ' SG ' ' A' ' 112' ' ' CYS . 2.2 tp -68.28 -30.4 47.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.384 -0.825 . . . . 1.16 110.666 -177.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.516 HG23 ' SG ' ' A' ' 112' ' ' CYS . 1.4 t -71.75 -41.36 70.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.225 -0.443 . . . . 1.1 110.163 177.532 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.07 -32.24 71.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.955 -0.566 . . . . 1.22 110.045 179.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 25.8 mtt -75.39 -39.16 59.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.539 -0.755 . . . . 1.25 110.546 177.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.35 -28.0 66.44 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.201 -0.454 . . . . 1.1 111.837 -178.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.68 -44.79 89.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.849 0.357 . . . . 2.08 111.213 179.286 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -76.72 -36.87 56.88 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.127 0.489 . . . . 1.04 110.433 179.166 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.39 -43.51 92.92 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.357 -0.838 . . . . 1.16 111.047 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -65.93 -24.42 66.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.903 -0.589 . . . . 1.47 111.687 -175.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.518 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 19.1 ttmt -64.89 -41.62 95.46 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.768 -0.456 . . . . 2.7 109.768 -178.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . 0.447 ' H ' HG13 ' A' ' 132' ' ' ILE . 3.3 mt -69.39 -34.78 64.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.918 -0.583 . . . . 1.79 110.316 178.01 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.513 ' O ' HG21 ' A' ' 137' ' ' VAL . 29.9 t80 -58.35 -61.75 2.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.652 -0.703 . . . . 0.52 110.662 179.273 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 2.0 pp -63.94 -30.02 71.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.923 0.392 . . . . 1.26 110.406 -177.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.518 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.56 -50.73 72.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.549 -0.75 . . . . 2.07 111.13 178.894 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.53 -23.29 50.18 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.77 -0.65 . . . . 2.11 111.055 -176.611 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.513 HG21 ' O ' ' A' ' 133' ' ' PHE . 46.4 t -78.15 -33.74 18.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.011 -0.54 . . . . 1.09 110.56 -179.476 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.03 -13.35 61.83 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.116 0.484 . . . . 1.21 110.616 179.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -106.71 4.2 27.51 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.681 -0.691 . . . . 1.94 110.869 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' MET . . . . . 0.415 ' HG3' ' HA ' ' A' ' 137' ' ' VAL . 0.7 OUTLIER -66.36 143.03 98.09 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.296 -0.411 . . . . 1.34 110.505 176.908 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -63.82 114.13 2.45 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.27 1.98 . . . . 0.67 111.272 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 13.6 mm-40 -79.37 26.29 0.29 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.184 -0.462 . . . . 3.68 111.622 -173.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.06 -40.16 3.0 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 115.936 -0.574 . . . . 2.7 110.763 -178.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.504 ' OE2' ' HB2' ' A' ' 38' ' ' GLN . 0.0 OUTLIER 63.28 93.8 0.05 Allowed 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.063 -0.972 . . . . 2.34 110.313 -174.696 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 1.5 t -112.89 116.83 53.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 115.522 -0.763 . . . . 1.66 109.961 -178.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.409 ' CD ' ' HE ' ' A' ' 34' ' ' ARG . 7.5 tt0 -64.8 133.14 51.37 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.693 0.283 . . . . 1.53 110.392 178.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 14.9 mt . . . . . 0 C--O 1.246 0.897 0 CA-C-O 118.697 -0.668 . . . . 1.57 110.372 -177.808 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.627 0 N-CA-C 111.828 -0.509 . . . . 2.47 111.828 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 312' ' ' ALY . . . . . 0.423 ' HCA' ' OH ' ' B' ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 155.21 -47.17 0.52 Allowed Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.494 -0.86 . . . . 1.97 112.736 179.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -151.81 136.11 16.75 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 122.523 -0.398 . . . . 3.98 111.177 -178.436 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 315' ' ' ALY . . . . . 0.423 ' OH ' ' HCA' ' B' ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 11.1 tptp . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.487 -0.768 . . . . 4.91 110.23 -177.251 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo . . . . . 0 N--CA 1.476 0.499 0 N-CA-C 111.002 -0.422 . . . . 6.97 111.002 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.1 tp -96.61 115.02 26.74 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.509 -0.552 . . . . 6.2 109.509 177.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.49 43.91 5.7 Favored Glycine 0 N--CA 1.449 -0.456 0 N-CA-C 110.959 -0.857 . . . . 3.98 110.959 -173.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.5 p -75.2 146.98 40.78 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.239 -0.481 . . . . 2.49 111.768 -176.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -123.46 155.96 36.46 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.978 -0.555 . . . . 2.07 110.051 176.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.2 p -128.28 -0.98 3.43 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.027 0 CA-C-O 122.058 0.932 . . . . 1.5 108.57 174.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.2 m -149.17 141.35 23.99 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 114.159 -1.382 . . . . 1.85 108.192 176.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -145.11 136.67 12.77 Favored Pre-proline 0 C--N 1.315 -0.929 0 C-N-CA 121.112 -0.235 . . . . 1.62 110.579 -177.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -65.76 -48.13 3.27 Favored 'Trans proline' 0 N--CA 1.473 0.278 0 C-N-CA 123.061 2.507 . . . . 2.05 112.955 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.458 ' O ' ' HD3' ' A' ' 32' ' ' PRO . 5.4 m -75.74 -19.31 59.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.082 -0.508 . . . . 2.24 110.872 -176.175 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.452 ' HE3' ' CZ ' ' A' ' 94' ' ' TYR . 0.0 OUTLIER -102.33 100.63 16.14 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.55 -0.75 . . . . 3.33 110.598 178.409 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.465 ' HB2' ' CZ3' ' A' ' 96' ' ' TRP . 15.2 Cg_exo -66.63 152.57 80.41 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.096 1.864 . . . . 1.8 111.564 178.675 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -136.02 88.78 0.23 Allowed Glycine 0 N--CA 1.444 -0.778 0 N-CA-C 111.662 -0.575 . . . . 0.97 111.662 -177.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.464 ' HG3' ' CZ2' ' A' ' 96' ' ' TRP . 7.3 mtm180 -91.87 148.81 21.94 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.723 -0.473 . . . . 2.37 109.723 178.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.0 120.62 32.14 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.395 -0.366 . . . . 3.13 110.103 -178.157 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -111.36 160.58 16.92 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.827 -0.349 . . . . 1.29 110.722 177.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.464 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 8.1 t30 -60.69 -37.84 82.99 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-N 115.879 -0.6 . . . . 1.47 110.113 178.292 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.402 ' O ' ' HB3' ' A' ' 41' ' ' TYR . 23.4 tt0 -64.18 -42.37 96.71 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.303 -0.408 . . . . 1.04 110.433 178.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.32 -52.01 63.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.216 -0.447 . . . . 1.39 110.549 179.027 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.413 ' O ' ' HG3' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -67.5 -22.98 65.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.288 0.566 . . . . 1.75 110.789 -179.541 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.464 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 62.3 t80 -64.45 -59.73 3.99 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 115.523 -0.762 . . . . 1.2 110.769 176.624 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.99 -34.39 71.79 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.573 -0.285 . . . . 1.76 111.749 -172.587 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.566 ' HA ' ' CG1' ' A' ' 47' ' ' VAL . 0.0 OUTLIER -65.68 -45.21 83.72 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.426 -0.509 . . . . 1.47 110.851 -177.521 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 -85.68 -34.24 21.34 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.085 -0.507 . . . . 0.53 111.795 -177.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 85.6 t -88.73 -57.81 3.96 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 112.332 0.493 . . . . 1.11 112.332 -175.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 42.4 t -79.63 -66.63 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 111.855 0.317 . . . . 1.07 111.855 -170.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.566 ' CG1' ' HA ' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -68.94 -35.97 71.75 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.314 0 C-N-CA 120.677 -0.409 . . . . 1.44 111.624 -173.728 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.46 -38.64 87.95 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.678 -0.409 . . . . 2.85 111.376 179.066 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.2 m -73.64 -36.37 65.39 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 121.083 -0.247 . . . . 1.23 110.824 178.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.24 -39.63 89.65 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 109.588 -0.523 . . . . 1.11 109.588 174.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 11.6 t-105 -58.04 -36.38 72.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.641 -0.709 . . . . 0.44 110.98 177.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -84.78 10.59 11.04 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.198 0.444 . . . . 2.75 112.198 -175.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.442 ' CD2' HD11 ' A' ' 132' ' ' ILE . 19.1 t-80 -83.12 139.06 33.42 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.842 0.353 . . . . 0.47 110.465 177.15 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.9 mm-40 -72.26 1.79 7.11 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.005 -0.543 . . . . 1.91 112.308 -175.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -118.83 -7.84 10.4 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.771 0.32 . . . . 1.24 110.918 178.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -92.6 6.43 47.34 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.955 0.407 . . . . 1.09 111.217 -176.089 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.552 ' HA ' ' CZ ' ' A' ' 60' ' ' TYR . 40.4 p-90 -62.97 -35.14 16.38 Favored Pre-proline 0 CA--C 1.548 0.867 0 N-CA-C 114.099 1.148 . . . . 0.65 114.099 -174.397 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.517 ' HD3' ' CG ' ' A' ' 57' ' ' TRP . 15.3 Cg_exo -71.19 -17.9 30.93 Favored 'Trans proline' 0 C--N 1.357 0.987 0 CA-C-N 121.095 1.427 . . . . 0.61 112.435 177.478 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -85.36 -4.53 59.19 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.196 -0.456 . . . . 1.52 111.257 -175.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.552 ' CZ ' ' HA ' ' A' ' 57' ' ' TRP . 17.6 m-30 -60.54 -38.08 83.29 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.304 0.573 . . . . 1.01 110.883 -178.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -97.45 132.8 24.63 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-N 115.41 -0.814 . . . . 2.11 110.615 -177.049 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.73 145.09 25.42 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.334 2.023 . . . . 1.1 112.083 178.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 4.4 t -69.59 110.11 2.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-O 121.727 0.775 . . . . 1.46 110.794 177.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.496 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.5 OUTLIER -110.23 -0.74 17.67 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.897 -1.047 . . . . 1.85 109.559 179.474 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.496 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 74.69 -64.19 0.39 Allowed 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 114.627 -1.169 . . . . 1.43 111.055 -175.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 12.9 mt -68.56 -48.84 70.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.788 0.328 . . . . 2.38 111.115 -176.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 38.2 tttp -50.46 -51.92 42.67 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.73 -0.668 . . . . 3.34 112.331 -177.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -105.1 7.24 33.76 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.496 -0.32 . . . . 2.3 111.573 -171.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . 0.481 ' O ' HD13 ' A' ' 70' ' ' LEU . 17.7 t-20 59.11 67.28 0.93 Allowed 'General case' 0 N--CA 1.467 0.418 0 O-C-N 123.731 0.644 . . . . 1.89 111.207 -178.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.481 HD13 ' O ' ' A' ' 69' ' ' ASN . 0.1 OUTLIER -128.06 66.94 73.44 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.349 -0.841 . . . . 2.18 110.798 -179.699 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.96 -34.93 21.97 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 121.909 1.739 . . . . 1.42 111.972 -179.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -72.0 -30.8 65.6 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.98 -0.554 . . . . 1.97 110.678 -178.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.757 ' HH ' ' HB3' ' A' ' 111' ' ' ASN . 2.8 t80 -59.67 -45.9 90.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.65 -0.705 . . . . 1.53 110.577 -178.478 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -75.73 -7.8 55.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.128 -0.487 . . . . 1.22 110.977 -177.144 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt -95.72 -44.6 7.37 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 116.082 -0.508 . . . . 3.34 110.004 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.6 mt -82.78 -50.31 15.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.859 -0.609 . . . . 1.5 111.026 -178.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 43.7 mm -83.1 138.08 19.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.438 -0.346 . . . . 1.19 110.339 -177.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.62 -47.43 12.09 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.205 -0.452 . . . . 2.35 110.936 -179.721 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -115.22 96.43 45.44 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 116.476 -0.329 . . . . 2.05 110.822 -179.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -73.38 99.01 1.07 Allowed 'Trans proline' 0 CA--C 1.529 0.271 0 C-N-CA 122.381 2.054 . . . . 1.24 112.516 178.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.24 145.76 47.94 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 116.056 -0.52 . . . . 1.39 110.085 -178.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.465 ' O ' HD12 ' A' ' 86' ' ' ILE . 5.4 m-20 -145.35 -153.93 0.51 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 114.862 -1.063 . . . . 1.42 108.297 -172.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.53 -18.72 21.94 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.065 -0.717 . . . . 1.14 109.065 -172.55 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -80.37 -25.07 57.86 Favored Glycine 0 N--CA 1.44 -1.084 0 N-CA-C 109.539 -1.424 . . . . 0.33 109.539 175.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -84.47 -41.28 16.75 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 114.705 -0.747 . . . . 1.6 111.486 178.385 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.501 ' CD1' ' HB3' ' A' ' 104' ' ' ASP . 0.2 OUTLIER -56.41 -47.42 81.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 121.163 0.506 . . . . 1.63 109.727 178.398 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.6 ptmt -66.15 -27.54 68.1 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.765 -0.652 . . . . 1.71 111.506 -179.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.9 tttt -67.92 -43.02 80.15 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.935 0.398 . . . . 2.93 110.795 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.53 ' HD3' ' OD2' ' A' ' 104' ' ' ASP . 1.6 mtt180 -69.84 -32.0 70.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.309 -0.405 . . . . 1.49 110.558 178.578 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.419 ' HG ' ' SG ' ' A' ' 101' ' ' CYS . 7.7 mt -67.71 -54.41 19.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.656 -0.702 . . . . 1.14 111.22 178.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 25.0 pt-20 -64.92 -26.74 68.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.119 -0.491 . . . . 1.39 111.313 -175.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -95.29 10.67 35.31 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.081 -0.509 . . . . 1.66 111.276 -178.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.3 p30 37.25 54.9 1.33 Allowed 'General case' 0 N--CA 1.475 0.825 0 O-C-N 124.169 0.918 . . . . 1.75 111.711 -177.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . 0.452 ' CZ ' ' HE3' ' A' ' 31' ' ' LYS . 29.8 t80 -66.06 -73.5 0.13 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.057 -0.974 . . . . 1.3 112.06 -175.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -94.87 39.44 1.1 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.518 -0.765 . . . . 1.72 112.582 -172.651 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . 0.465 ' CZ3' ' HB2' ' A' ' 32' ' ' PRO . 1.2 t-105 71.25 -66.07 0.31 Allowed 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.24 0.83 . . . . 1.15 113.24 169.012 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -125.15 161.26 27.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.114 0.483 . . . . 1.05 111.912 -168.143 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.4 -12.71 60.91 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.973 -0.558 . . . . 1.31 111.071 -179.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 20.0 m -64.05 -26.32 68.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.293 0.568 . . . . 1.12 109.791 175.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -82.47 -26.68 32.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.522 -0.763 . . . . 2.44 110.35 176.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . 0.419 ' SG ' ' HG ' ' A' ' 90' ' ' LEU . 0.5 OUTLIER -74.64 -23.08 58.63 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.539 -0.755 . . . . 1.24 110.62 179.475 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 6.5 ttm -60.94 -31.65 71.19 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.053 -0.521 . . . . 1.66 110.134 176.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.4 -38.16 68.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.696 -0.683 . . . . 3.72 110.252 178.18 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . 0.53 ' OD2' ' HD3' ' A' ' 89' ' ' ARG . 1.5 m-20 -67.3 -50.41 60.37 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.994 -0.548 . . . . 1.87 110.502 -178.405 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.75 -43.92 77.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.692 -0.685 . . . . 0.45 110.272 177.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -60.41 -49.87 75.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.615 -0.72 . . . . 1.23 110.361 178.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 71.3 m -55.37 -51.14 67.76 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 123.584 0.552 . . . . 1.09 111.259 179.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 2.3 ttp -53.42 -40.88 65.5 Favored 'General case' 0 C--O 1.233 0.216 0 O-C-N 123.326 0.391 . . . . 1.44 111.151 178.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -67.8 -43.58 79.33 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.485 -0.325 . . . . 0.29 110.971 -178.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.37 -43.71 98.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.738 0.304 . . . . 1.33 110.888 177.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . 0.757 ' HB3' ' HH ' ' A' ' 73' ' ' TYR . 7.1 m-20 -47.24 -48.86 24.28 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.455 -0.793 . . . . 2.36 111.335 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . 0.421 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 14.0 t -57.24 -42.46 81.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.724 -0.671 . . . . 1.09 111.518 179.124 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . 0.782 ' HH ' HE21 ' A' ' 127' ' ' GLN . 56.6 m-85 -80.44 -21.06 42.52 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.857 0.36 . . . . 1.17 111.833 -173.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 55.5 mt -87.01 -50.86 13.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.935 0.398 . . . . 1.18 110.75 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -73.43 -42.83 61.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.054 -0.521 . . . . 1.6 110.739 -177.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . 0.421 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 67.0 m-80 -100.01 161.5 13.57 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.233 -0.439 . . . . 1.37 110.728 -174.541 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.1 mmtt -82.83 147.95 56.22 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.95 -0.568 . . . . 3.92 109.844 178.007 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_endo -62.26 -12.98 29.63 Favored 'Trans proline' 0 N--CA 1.473 0.271 0 C-N-CA 122.786 2.324 . . . . 1.32 112.386 178.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.41 9.35 39.77 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.82 -0.627 . . . . 1.71 111.338 179.686 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -85.92 164.0 17.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.081 0.467 . . . . 1.34 111.062 -177.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.76 -45.41 94.01 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.234 -0.894 . . . . 1.44 110.943 -177.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -69.33 -34.85 64.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.176 -0.92 . . . . 1.16 111.487 -174.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.476 ' O ' HG12 ' A' ' 123' ' ' VAL . 2.3 t -71.32 -35.04 56.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.881 0.372 . . . . 1.1 110.088 179.507 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.87 -32.06 65.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.5 0.667 . . . . 1.22 109.646 177.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' MET . . . . . 0.465 ' SD ' ' HG2' ' A' ' 58' ' ' PRO . 8.7 mtt -80.13 -43.95 20.78 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 114.992 -1.004 . . . . 1.25 110.787 179.739 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.86 -35.16 63.72 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.246 -0.434 . . . . 1.1 111.885 -177.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . 0.782 HE21 ' HH ' ' A' ' 113' ' ' TYR . 0.1 OUTLIER -63.63 -41.98 98.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.403 -0.362 . . . . 2.08 111.386 -179.542 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -78.06 -36.56 48.2 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.174 0.512 . . . . 1.04 110.466 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.403 HD13 ' ND1' ' A' ' 53' ' ' HIS . 4.0 mp -60.8 -42.06 96.86 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.445 -0.798 . . . . 1.16 111.042 -179.333 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -61.13 -28.63 69.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.883 -0.599 . . . . 1.47 111.967 -175.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.501 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 7.0 mttm -64.53 -34.35 78.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.839 0.352 . . . . 2.7 110.441 -177.119 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . 0.442 HD11 ' CD2' ' A' ' 53' ' ' HIS . 13.9 mt -75.54 -31.0 22.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.036 -0.529 . . . . 1.79 110.67 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.572 ' O ' HG23 ' A' ' 137' ' ' VAL . 29.4 t80 -58.66 -62.33 1.95 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.009 -0.541 . . . . 0.52 110.691 -179.426 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.28 -28.24 69.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.104 0.478 . . . . 1.26 110.488 -179.364 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.501 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.36 -39.8 88.48 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.469 -0.787 . . . . 2.07 111.481 179.231 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.76 -26.56 19.43 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.895 0.378 . . . . 2.11 110.745 -178.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.572 HG23 ' O ' ' A' ' 133' ' ' PHE . 55.8 t -67.8 -32.03 54.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.1 -0.5 . . . . 1.09 110.23 177.403 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -64.96 -18.69 65.48 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.029 -0.532 . . . . 1.21 110.849 179.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.3 mm100 -103.58 -0.28 29.91 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.599 -0.728 . . . . 1.94 110.958 -178.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' MET . . . . . 0.462 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 0.4 OUTLIER -66.43 142.32 97.65 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.155 -0.475 . . . . 1.34 111.371 -179.432 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -74.77 101.7 1.49 Allowed 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.472 2.114 . . . . 0.67 111.895 179.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 76.5 mm-40 -70.05 -2.24 12.21 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 112.192 0.441 . . . . 3.68 112.192 -175.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -81.83 -38.42 25.52 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.881 0.372 . . . . 2.7 110.384 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 67.09 86.33 0.13 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.842 -1.072 . . . . 2.34 110.347 -178.685 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 1.2 t -96.25 120.19 45.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.564 -0.744 . . . . 1.66 109.618 178.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.15 146.02 45.95 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.752 0.311 . . . . 1.53 110.625 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 69.1 mt . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.555 -0.736 . . . . 1.57 110.371 -177.432 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.676 0 N-CA-C 111.847 -0.501 . . . . 2.47 111.847 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 148.09 92.67 0.11 Allowed Glycine 0 N--CA 1.447 -0.62 0 CA-C-N 115.572 -0.74 . . . . 1.97 111.592 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 66.3 115.68 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.35 0.66 . . . . 3.98 111.554 -176.955 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.108 0 CA-C-O 117.965 -1.017 . . . . 4.91 109.659 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo . . . . . 0 N--CA 1.479 0.623 0 N-CA-C 110.023 -0.799 . . . . 6.97 110.023 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -117.27 123.13 45.83 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.722 0.296 . . . . 6.2 110.337 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 91.39 -50.21 2.98 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.782 -0.723 . . . . 3.98 113.062 175.256 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 87.5 p -105.19 135.9 45.7 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.209 0.528 . . . . 2.49 112.075 -177.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.584 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 8.8 mt-10 -65.01 137.37 57.68 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.343 -0.844 . . . . 2.07 111.151 172.514 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.3 p -119.52 -8.61 11.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.449 0.642 . . . . 1.5 110.059 173.012 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -148.92 132.68 16.95 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.645 -0.707 . . . . 1.85 110.027 177.21 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -140.77 131.01 13.39 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 116.366 -0.379 . . . . 1.62 110.319 178.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -67.35 -47.33 2.26 Favored 'Trans proline' 0 CA--C 1.53 0.316 0 C-N-CA 123.093 2.529 . . . . 2.05 113.093 -179.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 3.1 m -80.54 -22.48 40.79 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.083 -0.508 . . . . 2.24 111.331 -174.062 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.433 ' HA ' ' HD3' ' A' ' 32' ' ' PRO . 17.5 tttm -77.85 127.27 82.48 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 115.932 -0.577 . . . . 3.33 110.941 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 31' ' ' LYS . 3.8 Cg_exo -72.36 151.42 53.98 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.386 2.058 . . . . 1.8 111.952 177.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -151.84 113.36 0.58 Allowed Glycine 0 N--CA 1.443 -0.856 0 N-CA-C 110.681 -0.967 . . . . 0.97 110.681 179.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.6 mtm180 -124.7 159.74 30.16 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 110.099 -0.334 . . . . 2.37 110.099 -175.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.47 ' H ' ' HG3' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -99.2 84.2 2.99 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.118 0.485 . . . . 3.13 110.99 179.284 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.492 ' HA ' ' HA ' ' A' ' 146' ' ' GLU . 5.4 p -94.46 176.6 6.23 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 120.927 0.394 . . . . 1.29 111.401 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -63.31 -54.92 29.55 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.613 -0.721 . . . . 1.47 110.679 -179.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -56.74 -39.85 74.7 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.771 0.319 . . . . 1.04 111.105 -178.035 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.53 -58.99 6.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.057 -0.52 . . . . 1.39 111.282 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.4 mt-30 -69.54 -26.02 64.3 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.962 -0.563 . . . . 1.75 110.721 -177.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 47.8 t80 -60.85 -62.95 1.48 Allowed 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.739 -0.664 . . . . 1.2 110.669 177.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -61.06 -30.41 70.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.726 0.298 . . . . 1.76 110.529 -173.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -59.14 -56.24 24.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.866 -0.606 . . . . 1.47 110.836 178.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 -86.4 -30.42 22.14 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.99 0.424 . . . . 0.53 111.927 -176.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 91.7 t -88.48 -57.6 4.12 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 N-CA-C 112.423 0.527 . . . . 1.11 112.423 -174.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 50.1 t -80.46 -66.51 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 C-N-CA 120.716 -0.394 . . . . 1.07 111.712 -170.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 1.5 p -70.67 -34.11 55.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 C-N-CA 120.581 -0.448 . . . . 1.44 111.437 -173.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.02 -34.79 79.27 Favored 'General case' 0 C--N 1.329 -0.29 0 O-C-N 122.195 -0.316 . . . . 2.85 111.578 179.345 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.0 m -77.5 -39.1 47.46 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.909 -0.316 . . . . 1.23 110.54 177.086 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.53 -38.05 83.19 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.246 0.546 . . . . 1.11 109.875 175.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 17.6 t-105 -60.76 -28.73 68.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.461 -0.79 . . . . 0.44 111.499 178.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.7 mtmt -92.72 18.79 8.28 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.014 0.375 . . . . 2.75 112.014 -174.177 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.415 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 23.3 t-80 -89.48 139.12 30.85 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.963 -0.384 . . . . 0.47 109.963 175.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -70.76 -8.88 55.52 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.323 -0.399 . . . . 1.91 112.023 -175.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.415 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 1.8 m-30 -107.53 -1.49 21.27 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.96 0.409 . . . . 1.24 110.47 177.762 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -92.25 2.29 56.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.271 0.558 . . . . 1.09 110.972 -177.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.462 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 54.0 p-90 -63.87 -33.22 9.23 Favored Pre-proline 0 CA--C 1.547 0.855 0 N-CA-C 114.489 1.292 . . . . 0.65 114.489 -173.683 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.462 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 6.6 Cg_exo -74.59 -5.1 16.42 Favored 'Trans proline' 0 C--N 1.36 1.179 0 CA-C-N 121.296 1.499 . . . . 0.61 112.49 178.411 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -100.9 3.13 41.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.875 0.369 . . . . 1.52 110.269 -177.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.415 ' CZ ' ' HA ' ' A' ' 57' ' ' TRP . 16.0 m-30 -71.83 -26.15 62.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.048 -0.524 . . . . 1.01 111.159 -178.484 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.52 123.91 34.52 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.098 -0.501 . . . . 2.11 110.896 -174.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.563 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 39.1 Cg_exo -60.41 159.62 26.66 Favored 'Trans proline' 0 C--O 1.237 0.45 0 C-N-CA 122.968 2.445 . . . . 1.1 113.166 179.395 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.7 t -100.77 105.14 17.23 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 CA-C-O 121.705 0.764 . . . . 1.46 109.103 -178.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -114.12 2.9 15.05 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.919 -1.037 . . . . 1.85 110.885 -176.211 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 73.02 -9.03 1.18 Allowed 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 115.195 -0.911 . . . . 1.43 112.812 175.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 21.5 mm -113.96 -55.39 4.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.019 0.438 . . . . 2.38 110.666 -175.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.68 -40.3 88.51 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.756 -0.656 . . . . 3.34 110.611 -177.548 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.61 -5.08 57.49 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.91 -0.586 . . . . 2.3 110.564 178.221 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 58.9 t30 53.21 68.11 0.89 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.774 -0.648 . . . . 1.89 110.507 -174.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -130.04 65.59 75.75 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 115.603 -0.726 . . . . 2.18 110.667 -177.067 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -70.5 -30.36 18.95 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.166 1.91 . . . . 1.42 112.414 -177.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.23 -9.14 59.6 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.043 -0.526 . . . . 1.97 110.951 -177.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -63.55 -42.27 98.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.144 -0.48 . . . . 1.53 110.468 179.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -71.39 -7.82 49.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.0 -0.545 . . . . 1.22 111.637 -176.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 52.9 mmtt -92.5 -28.88 16.52 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.107 0.48 . . . . 3.34 110.095 -177.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.6 mt -101.72 -42.37 9.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.416 0.627 . . . . 1.5 110.184 178.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 47.8 mm -105.17 117.49 50.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 115.76 -0.655 . . . . 1.19 110.014 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.66 -15.68 34.31 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.289 -0.414 . . . . 2.35 110.697 -176.699 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -120.36 84.45 35.14 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.921 -0.582 . . . . 2.05 109.896 177.333 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.43 ' O ' ' HE3' ' A' ' 81' ' ' MET . 48.4 Cg_endo -70.7 91.24 0.61 Allowed 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.604 2.203 . . . . 1.24 112.318 -176.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.43 ' HE3' ' O ' ' A' ' 80' ' ' PRO . 1.6 mmt -129.39 162.51 27.87 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.03 -0.532 . . . . 1.39 110.436 -178.009 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.563 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 8.4 p-10 -146.92 -126.01 0.06 Allowed 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 114.79 -1.096 . . . . 1.42 109.082 -173.568 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' MET . . . . . 0.495 ' SD ' ' HE3' ' A' ' 108' ' ' MET . 0.2 OUTLIER -120.0 -22.01 6.87 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.139 0.495 . . . . 1.14 110.15 -178.918 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -84.64 -24.89 44.37 Favored Glycine 0 N--CA 1.442 -0.931 0 N-CA-C 110.759 -0.937 . . . . 0.33 110.759 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.68 -38.56 64.86 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 121.104 0.478 . . . . 1.6 110.252 177.371 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.515 HG23 ' SG ' ' A' ' 101' ' ' CYS . 75.9 mt -60.17 -49.27 84.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.404 -0.816 . . . . 1.63 110.046 175.255 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.89 -27.45 66.67 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.562 -0.745 . . . . 1.71 111.303 -178.623 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.411 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 1.0 OUTLIER -62.48 -44.63 95.93 Favored 'General case' 0 N--CA 1.456 -0.128 0 CA-C-O 120.521 0.2 . . . . 2.93 111.301 -178.837 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 24.0 mtp180 -75.97 -29.03 58.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.638 0.256 . . . . 1.49 110.698 -179.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.57 ' HG ' ' OH ' ' A' ' 95' ' ' TYR . 3.9 mt -63.67 -55.52 22.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.945 -0.57 . . . . 1.14 110.91 178.429 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -72.05 -22.53 61.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.229 -0.441 . . . . 1.39 111.249 -176.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.411 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 4.9 m-80 -83.72 -9.04 59.11 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.491 -0.322 . . . . 1.66 110.558 178.183 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 56.71 53.8 7.96 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.604 0.716 . . . . 1.75 110.142 -178.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . 0.584 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 61.7 t80 -81.35 -16.27 52.83 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.329 -0.85 . . . . 1.3 111.411 -175.503 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.57 ' OH ' ' HG ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -129.18 174.22 9.77 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.042 0.449 . . . . 1.72 110.936 -179.455 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 -73.64 -50.47 20.87 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.178 -0.919 . . . . 1.15 110.671 -178.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 29.1 t -143.55 176.74 8.97 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.033 -0.531 . . . . 1.05 110.228 -175.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.82 -7.35 54.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.475 -0.33 . . . . 1.31 111.741 -173.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.74 -32.23 71.52 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.937 0.398 . . . . 1.12 110.795 -179.515 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -73.26 -32.03 64.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.844 -0.617 . . . . 2.44 110.522 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . 0.616 ' HA ' ' OD2' ' A' ' 104' ' ' ASP . 0.5 OUTLIER -75.44 -20.65 58.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.737 -0.665 . . . . 1.24 111.539 -175.94 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.38 -27.39 62.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.006 0.432 . . . . 1.66 110.182 176.555 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -71.9 -40.52 68.8 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.851 -0.613 . . . . 3.72 110.511 177.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . 0.616 ' OD2' ' HA ' ' A' ' 101' ' ' CYS . 5.3 m-20 -66.47 -48.21 70.62 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.977 -0.556 . . . . 1.87 110.404 -179.565 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -56.82 -42.88 80.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.873 -0.603 . . . . 0.45 110.558 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -58.69 -50.47 73.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.169 -0.468 . . . . 1.23 110.054 175.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 30.9 m -57.88 -49.09 77.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.128 -0.487 . . . . 1.09 111.315 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.495 ' HE3' ' SD ' ' A' ' 83' ' ' MET . 0.0 OUTLIER -52.31 -38.05 57.43 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.878 0.471 . . . . 1.44 111.927 179.844 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -77.87 -49.12 14.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.972 0.415 . . . . 0.29 110.167 -175.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.81 -36.39 80.98 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.937 -0.574 . . . . 1.33 111.61 178.044 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -49.31 -52.83 25.28 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.013 0.435 . . . . 2.36 111.201 178.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . 0.419 ' SG ' ' HA ' ' A' ' 123' ' ' VAL . 1.0 OUTLIER -63.95 -41.71 97.52 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.536 -0.756 . . . . 1.09 110.998 -178.753 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -63.28 -37.92 89.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.399 -0.364 . . . . 1.17 111.411 -177.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 55.8 mt -80.04 -48.96 19.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.451 -0.341 . . . . 1.18 111.887 -176.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 92.2 t80 -69.8 -26.63 64.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.75 0.31 . . . . 1.6 111.55 -174.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -111.46 175.8 5.28 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.15 0.5 . . . . 1.37 111.375 -173.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -97.06 152.04 38.08 Favored Pre-proline 0 C--N 1.322 -0.625 0 CA-C-N 115.543 -0.753 . . . . 3.92 110.298 -177.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -60.18 -21.69 67.17 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.798 2.332 . . . . 1.32 112.697 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.52 18.39 16.76 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.131 -0.486 . . . . 1.71 111.347 -179.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . 0.487 ' OD2' ' HA2' ' B' ' 313' ' ' GLY . 2.8 t0 -96.7 155.71 16.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.236 -0.438 . . . . 1.34 110.361 178.648 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -71.7 -41.05 69.07 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.792 -0.64 . . . . 1.44 110.703 -175.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.2 tp -62.65 -34.02 62.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.99 -0.55 . . . . 1.16 110.853 -178.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.419 ' HA ' ' SG ' ' A' ' 112' ' ' CYS . 0.9 OUTLIER -68.99 -41.71 81.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.113 0.483 . . . . 1.1 109.861 177.102 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.37 -34.83 79.07 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.646 -0.707 . . . . 1.22 109.819 -179.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' MET . . . . . 0.628 ' O ' HD13 ' A' ' 129' ' ' LEU . 14.5 mtt -69.0 -47.09 66.37 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.257 -0.883 . . . . 1.25 110.677 179.568 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.59 -39.43 67.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.239 -0.437 . . . . 1.1 111.394 -179.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.76 -36.74 83.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.14 -0.482 . . . . 2.08 111.386 -178.42 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -74.95 -37.15 62.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.198 0.523 . . . . 1.04 110.319 178.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.628 HD13 ' O ' ' A' ' 125' ' ' MET . 7.6 mp -61.05 -39.85 91.4 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.264 -0.88 . . . . 1.16 110.323 178.085 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -55.0 -32.75 62.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.574 -0.739 . . . . 1.47 112.071 -176.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.617 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -62.59 -38.8 91.55 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 120.692 0.282 . . . . 2.7 110.676 -175.389 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . 0.509 HD11 HG21 ' A' ' 132' ' ' ILE . 25.0 mt -72.2 -34.19 48.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.17 -0.468 . . . . 1.79 110.5 179.493 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.539 ' O ' HG21 ' A' ' 137' ' ' VAL . 30.7 t80 -60.52 -62.72 1.66 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.947 -0.57 . . . . 0.52 110.845 -178.684 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.8 -28.41 69.55 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 120.917 0.389 . . . . 1.26 110.612 -177.022 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.617 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -58.9 -57.53 12.64 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.611 -0.722 . . . . 2.07 110.777 176.626 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.15 -26.48 63.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.786 -0.643 . . . . 2.11 111.081 -176.552 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.539 HG21 ' O ' ' A' ' 133' ' ' PHE . 75.8 t -68.93 -31.87 52.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.936 0.398 . . . . 1.09 110.245 177.003 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -70.52 -12.5 61.61 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.111 0.482 . . . . 1.21 110.718 177.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -104.26 -1.36 27.17 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.877 -0.601 . . . . 1.94 110.333 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' MET . . . . . 0.471 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 0.5 OUTLIER -68.29 144.94 97.15 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 115.907 -0.588 . . . . 1.34 111.193 -178.193 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.438 ' C ' ' H ' ' A' ' 143' ' ' GLU . 58.5 Cg_endo -73.95 91.14 0.93 Allowed 'Trans proline' 0 N--CA 1.459 -0.508 0 C-N-CA 122.4 2.067 . . . . 0.67 111.436 177.002 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -78.98 26.4 0.25 Allowed 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.633 0.73 . . . . 3.68 111.875 -176.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.438 ' H ' ' C ' ' A' ' 141' ' ' PRO . 4.5 mp0 -114.13 -43.13 3.26 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-N 115.14 -0.937 . . . . 2.7 108.49 174.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.42 ' C ' HG23 ' A' ' 145' ' ' VAL . 3.8 tp10 72.35 137.99 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 114.667 -1.151 . . . . 2.34 112.37 171.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . 0.42 HG23 ' C ' ' A' ' 144' ' ' GLU . 0.1 OUTLIER -155.58 150.63 10.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 114.845 -1.07 . . . . 1.66 108.5 177.683 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.492 ' HA ' ' HA ' ' A' ' 36' ' ' THR . 0.9 OUTLIER -81.74 148.31 29.0 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 119.793 -0.763 . . . . 1.53 109.602 174.387 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . 0.439 ' N ' ' HG3' ' A' ' 146' ' ' GLU . 14.1 mt . . . . . 0 C--O 1.247 0.923 0 CA-C-O 118.581 -0.723 . . . . 1.57 110.906 -178.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.791 0 N-CA-C 111.354 -0.698 . . . . 2.47 111.354 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 313' ' ' GLY . . . . . 0.487 ' HA2' ' OD2' ' A' ' 120' ' ' ASP . . . 102.1 82.87 1.68 Allowed Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.846 -0.692 . . . . 1.97 111.499 -176.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 73.47 123.37 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.604 0.762 . . . . 3.98 110.371 -175.072 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 2.8 tptt . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.277 -0.868 . . . . 4.91 109.89 178.695 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo . . . . . 0 N--CA 1.478 0.603 0 N-CA-C 109.926 -0.836 . . . . 6.97 109.926 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.48 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -148.58 135.57 20.03 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 110.023 -0.362 . . . . 6.2 110.023 176.188 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.36 -71.92 2.41 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.976 -0.631 . . . . 3.98 112.216 -179.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 10.4 p -122.5 140.21 53.02 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 110.247 -0.279 . . . . 2.49 110.247 178.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.699 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 7.3 mt-10 -61.32 134.75 57.29 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.184 0.516 . . . . 2.07 111.926 178.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.428 ' CG2' ' HG3' ' A' ' 88' ' ' LYS . 8.1 p -114.53 -12.83 11.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 115.405 -0.816 . . . . 1.5 109.596 174.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.481 ' HB3' ' ND2' ' A' ' 92' ' ' ASN . 66.9 p -163.7 141.8 7.57 Favored 'General case' 0 N--CA 1.439 -0.993 0 CA-C-N 114.893 -1.049 . . . . 1.85 109.21 179.179 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.454 ' HB3' ' CB ' ' A' ' 31' ' ' LYS . 39.1 t-20 -148.05 124.77 5.49 Favored Pre-proline 0 C--N 1.316 -0.86 0 CA-C-N 116.261 -0.427 . . . . 1.62 110.099 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.19 -40.13 9.19 Favored 'Trans proline' 0 N--CA 1.472 0.244 0 C-N-CA 123.093 2.529 . . . . 2.05 112.685 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.6 m -77.46 -22.68 51.0 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 116.054 -0.521 . . . . 2.24 110.363 -177.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.454 ' CB ' ' HB3' ' A' ' 28' ' ' ASN . 5.3 tttp -83.52 131.4 52.68 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.512 -0.767 . . . . 3.33 110.232 177.115 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.427 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 40.9 Cg_endo -68.3 140.5 48.87 Favored 'Trans proline' 0 N--CA 1.463 -0.3 0 C-N-CA 122.758 2.306 . . . . 1.8 112.702 177.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -142.45 121.58 1.8 Allowed Glycine 0 N--CA 1.446 -0.635 0 N-CA-C 110.491 -1.043 . . . . 0.97 110.491 177.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.418 ' HE ' ' CD ' ' A' ' 146' ' ' GLU . 0.3 OUTLIER -129.38 173.03 10.91 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 117.052 0.426 . . . . 2.37 110.877 -174.452 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -110.33 100.97 9.74 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.778 -0.646 . . . . 3.13 110.778 177.472 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.7 p -108.66 164.25 12.54 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.781 -0.368 . . . . 1.29 110.58 175.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.444 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 0.1 OUTLIER -65.72 -35.87 81.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.931 -0.577 . . . . 1.47 110.647 -179.666 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -67.43 -36.27 80.88 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 120.748 0.308 . . . . 1.04 110.505 178.162 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.1 -53.7 49.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.991 -0.55 . . . . 1.39 110.648 178.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -68.51 -30.36 69.16 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.985 -0.552 . . . . 1.75 110.617 -179.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.444 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 43.3 t80 -57.9 -63.2 1.33 Allowed 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 115.846 -0.616 . . . . 1.2 110.781 176.417 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.23 -31.87 70.59 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.749 0.309 . . . . 1.76 110.915 -172.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.416 ' HA ' ' CG1' ' A' ' 47' ' ' VAL . 11.1 tt0 -67.41 -48.2 68.01 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.88 -0.6 . . . . 1.47 110.978 -178.449 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 66.9 m-80 -85.81 -32.41 21.79 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 112.369 0.507 . . . . 0.53 112.369 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 72.6 t -88.23 -57.4 4.28 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 N-CA-C 112.214 0.45 . . . . 1.11 112.214 -174.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 78.6 t -82.6 -66.22 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 C-N-CA 120.695 -0.402 . . . . 1.07 111.864 -170.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.416 ' CG1' ' HA ' ' A' ' 43' ' ' GLN . 1.4 p -64.54 -36.79 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 C-N-CA 120.431 -0.508 . . . . 1.44 111.669 -174.026 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.38 -36.97 79.3 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.848 0.356 . . . . 2.85 111.037 177.416 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 56.3 m -77.88 -34.31 51.66 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.59 -0.277 . . . . 1.23 110.948 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.47 -42.63 92.05 Favored 'General case' 0 C--N 1.332 -0.196 0 N-CA-C 109.654 -0.499 . . . . 1.11 109.654 175.275 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 21.2 t-105 -61.9 -38.54 88.74 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.743 -0.662 . . . . 0.44 111.006 178.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -84.42 15.37 3.71 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.018 0.377 . . . . 2.75 112.018 -175.31 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -87.3 134.47 33.55 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.557 -0.535 . . . . 0.47 109.557 175.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -74.9 -4.54 38.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.896 0.379 . . . . 1.91 111.782 -175.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.457 ' CD2' ' HG2' ' A' ' 125' ' ' MET . 3.0 m-30 -105.38 1.64 28.03 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.118 0.485 . . . . 1.24 110.202 177.065 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -101.24 12.78 36.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.173 -0.467 . . . . 1.09 111.05 -178.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.49 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 55.6 p-90 -65.62 -34.62 9.61 Favored Pre-proline 0 CA--C 1.546 0.822 0 N-CA-C 113.507 0.929 . . . . 0.65 113.507 -175.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.49 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 4.7 Cg_exo -75.01 -1.84 11.76 Favored 'Trans proline' 0 C--N 1.364 1.357 0 CA-C-N 120.924 1.366 . . . . 0.61 112.136 178.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -106.9 10.59 30.53 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.019 -0.537 . . . . 1.52 110.405 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 11.7 m-30 -79.57 -13.25 59.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.894 -0.593 . . . . 1.01 111.317 -178.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -113.55 136.55 21.97 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 116.267 -0.424 . . . . 2.11 110.712 -174.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.564 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 37.1 Cg_endo -67.1 140.81 55.31 Favored 'Trans proline' 0 C--O 1.239 0.532 0 C-N-CA 122.765 2.31 . . . . 1.1 112.592 -179.474 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 47.4 t -83.97 86.03 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 CA-C-O 122.373 1.082 . . . . 1.46 109.408 178.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.521 ' OD1' ' HB2' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -103.18 17.1 24.87 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 114.259 -1.337 . . . . 1.85 108.612 177.26 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.422 ' HB3' ' NE2' ' A' ' 74' ' ' HIS . . . 78.21 -66.08 0.22 Allowed 'General case' 0 C--O 1.215 -0.719 0 CA-C-N 113.379 -1.737 . . . . 1.43 111.254 -176.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 55.7 mt -75.53 -37.5 37.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 112.173 0.435 . . . . 2.38 112.173 -171.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.521 ' HB2' ' OD1' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -57.67 -50.03 74.53 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.044 0.387 . . . . 3.34 112.044 -177.311 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 9.9 tp -95.37 -2.63 48.71 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.289 0.566 . . . . 2.3 110.151 178.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . 0.402 ' O ' HD12 ' A' ' 70' ' ' LEU . 1.2 t-20 63.57 56.98 1.51 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 114.95 -1.023 . . . . 1.89 112.168 178.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.402 HD12 ' O ' ' A' ' 69' ' ' ASN . 1.1 mm? -122.23 78.79 43.96 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.17 -0.923 . . . . 2.18 108.89 172.281 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.18 -32.85 26.23 Favored 'Trans proline' 0 C--O 1.233 0.269 0 C-N-CA 122.336 2.024 . . . . 1.42 113.198 -172.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.12 7.21 46.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.438 -0.346 . . . . 1.97 111.202 -174.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.47 ' OH ' ' HB3' ' A' ' 111' ' ' ASN . 1.0 OUTLIER -59.16 -42.81 91.65 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.321 -0.4 . . . . 1.53 110.25 179.437 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.422 ' NE2' ' HB3' ' A' ' 65' ' ' ALA . 4.9 m-70 -77.29 0.9 20.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.857 -0.61 . . . . 1.22 111.315 -175.401 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.9 mttp -97.99 -39.05 9.14 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.212 0.529 . . . . 3.34 110.327 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.6 mt -99.09 -39.73 8.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.941 -0.572 . . . . 1.5 110.766 -178.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 50.0 mm -97.3 124.89 50.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.893 -0.594 . . . . 1.19 110.171 -178.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.38 -17.24 30.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.342 -0.39 . . . . 2.35 111.262 -176.494 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -128.32 87.28 55.67 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-O 120.841 0.353 . . . . 2.05 110.343 177.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -71.36 90.51 0.68 Allowed 'Trans proline' 0 CA--C 1.528 0.203 0 C-N-CA 122.976 2.451 . . . . 1.24 111.938 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 4.0 mmt -122.33 150.49 42.31 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 121.471 0.653 . . . . 1.39 110.527 -178.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.564 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 1.0 OUTLIER -128.45 -119.69 0.24 Allowed 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.589 -1.187 . . . . 1.42 109.03 -177.255 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -134.03 -17.68 2.12 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.941 0.4 . . . . 1.14 110.628 174.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -86.99 -30.77 19.47 Favored Glycine 0 CA--C 1.502 -0.749 0 N-CA-C 109.72 -1.352 . . . . 0.33 109.72 -178.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.3 m -74.17 -26.87 60.54 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.662 -0.769 . . . . 1.6 110.159 172.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.6 mm -66.19 -57.41 10.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.856 -0.611 . . . . 1.63 109.766 175.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.16 -24.46 66.31 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.554 -0.748 . . . . 1.71 110.886 179.049 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.428 ' HG3' ' CG2' ' A' ' 26' ' ' VAL . 4.3 tppt? -63.17 -48.09 79.87 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 120.703 0.287 . . . . 2.93 110.565 178.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 11.7 mtp180 -67.77 -29.54 68.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.973 0.416 . . . . 1.49 110.818 -179.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 9.4 mt -72.07 -51.38 21.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.855 -0.611 . . . . 1.14 111.182 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -73.72 -19.86 60.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.819 0.342 . . . . 1.39 111.252 -176.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.481 ' ND2' ' HB3' ' A' ' 27' ' ' SER . 17.6 t30 -95.06 0.83 54.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.369 -0.378 . . . . 1.66 111.371 -179.087 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 56.25 65.7 1.37 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.394 0.616 . . . . 1.75 110.874 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . 0.699 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 26.6 t80 -80.41 -47.51 14.28 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 116.122 -0.49 . . . . 1.3 111.382 178.682 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.415 ' HB3' ' OE1' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -106.32 -173.95 2.42 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.664 0.745 . . . . 1.72 111.835 -174.311 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . 0.427 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 2.1 t90 -83.11 -45.29 14.14 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.298 -1.319 . . . . 1.15 110.159 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 46.1 t -149.49 173.67 13.34 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.47 -0.786 . . . . 1.05 110.002 -173.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -70.84 -8.55 53.43 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.398 -0.365 . . . . 1.31 111.264 -176.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -37.36 76.58 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.762 -0.654 . . . . 1.12 111.005 179.433 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.442 ' O ' ' HB3' ' A' ' 103' ' ' GLN . 3.1 tt0 -81.6 -30.7 32.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.05 -0.523 . . . . 2.44 110.718 -178.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 13.7 t -65.19 -22.74 66.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.205 0.526 . . . . 1.24 110.834 -178.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.26 -24.1 66.15 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.121 -0.49 . . . . 1.66 110.224 176.589 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.586 ' HG2' ' N ' ' A' ' 104' ' ' ASP . 0.0 OUTLIER -72.06 -51.38 21.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 3.72 110.445 179.158 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . 0.586 ' N ' ' HG2' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -70.63 -36.45 73.44 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.269 -0.423 . . . . 1.87 110.475 -177.491 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.58 -51.47 69.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.946 -0.57 . . . . 0.45 110.485 174.859 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -58.97 -41.27 87.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.891 -0.595 . . . . 1.23 110.766 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 71.1 m -56.41 -48.5 76.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.88 -0.6 . . . . 1.09 110.943 179.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.46 -42.9 61.92 Favored 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.439 0.462 . . . . 1.44 111.5 178.324 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -72.34 -45.04 61.62 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.43 -0.35 . . . . 0.29 111.159 -176.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.71 -36.16 82.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.132 0.492 . . . . 1.33 110.55 178.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . 0.47 ' HB3' ' OH ' ' A' ' 73' ' ' TYR . 25.1 m-20 -53.08 -51.91 60.31 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.314 -0.857 . . . . 2.36 111.05 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . 0.517 ' SG ' HG21 ' A' ' 123' ' ' VAL . 43.8 t -60.26 -40.65 91.07 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.829 -0.623 . . . . 1.09 111.379 179.426 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -71.18 -26.84 63.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.475 -0.329 . . . . 1.17 111.528 -176.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 56.0 mt -92.65 -53.67 8.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.875 0.369 . . . . 1.18 111.708 -177.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -71.03 -35.49 72.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.294 -0.412 . . . . 1.6 111.355 -174.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 50.3 m-20 -101.42 166.0 10.97 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.925 0.393 . . . . 1.37 110.705 -174.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 1.7 mmpt? -78.68 140.86 59.44 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 115.947 -0.569 . . . . 3.92 110.188 178.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -65.49 -8.63 19.64 Favored 'Trans proline' 0 CA--C 1.531 0.361 0 C-N-CA 122.357 2.038 . . . . 1.32 112.541 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -103.01 4.18 37.03 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.375 -0.375 . . . . 1.71 111.251 177.516 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -76.5 154.45 34.63 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.628 -0.508 . . . . 1.34 109.628 178.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . 0.414 ' HB3' ' HB2' ' B' ' 315' ' ' ALY . 2.5 t70 -67.97 -33.29 74.36 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.972 -0.558 . . . . 1.44 110.205 -178.159 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.9 tp -63.27 -36.52 76.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 116.339 -0.391 . . . . 1.16 110.519 177.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.517 HG21 ' SG ' ' A' ' 112' ' ' CYS . 2.6 t -73.18 -43.31 57.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 N-CA-C 109.778 -0.453 . . . . 1.1 109.778 178.139 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.509 ' HA ' ' OE1' ' A' ' 127' ' ' GLN . 0.2 OUTLIER -61.63 -29.77 70.27 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.001 -0.545 . . . . 1.22 110.008 -179.466 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' MET . . . . . 0.457 ' HG2' ' CD2' ' A' ' 55' ' ' PHE . 46.7 mtt -80.63 -35.43 33.99 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.565 -0.743 . . . . 1.25 110.565 176.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.33 -36.81 76.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.021 -0.536 . . . . 1.1 111.592 -179.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . 0.509 ' OE1' ' HA ' ' A' ' 124' ' ' LEU . 18.9 mt-30 -61.22 -45.96 92.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.687 0.28 . . . . 2.08 110.638 179.319 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.85 -41.34 83.06 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.102 -0.499 . . . . 1.04 110.598 178.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.407 HD11 ' C ' ' A' ' 55' ' ' PHE . 2.5 mp -58.78 -46.19 88.09 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.687 -0.688 . . . . 1.16 110.211 177.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -66.48 -30.05 70.29 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.672 -0.695 . . . . 1.47 111.061 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.416 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.1 OUTLIER -64.28 -43.33 95.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.221 -0.445 . . . . 2.7 110.285 -177.068 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 5.5 pt -79.93 -26.89 12.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.305 -0.407 . . . . 1.79 110.45 177.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.49 ' O ' HG21 ' A' ' 137' ' ' VAL . 37.7 t80 -59.57 -61.59 2.51 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.595 -0.275 . . . . 0.52 110.598 175.415 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 2.8 pp -65.03 -22.16 66.95 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.112 0.482 . . . . 1.26 110.442 -178.096 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.512 ' O ' ' HG3' ' A' ' 139' ' ' GLN . 0.8 OUTLIER -66.07 -54.09 30.17 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.596 -0.729 . . . . 2.07 109.979 177.572 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 4.7 mmtm -65.03 -33.71 76.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.61 -0.723 . . . . 2.11 110.692 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.49 HG21 ' O ' ' A' ' 133' ' ' PHE . 78.7 t -67.16 -31.66 54.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.037 -0.529 . . . . 1.09 110.566 178.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.29 -19.52 64.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.058 0.456 . . . . 1.21 110.565 178.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . 0.512 ' HG3' ' O ' ' A' ' 135' ' ' GLN . 6.9 mt-30 -100.52 0.08 38.84 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.675 -0.693 . . . . 1.94 110.703 -178.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' MET . . . . . 0.478 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 0.2 OUTLIER -66.14 147.62 98.77 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.965 -0.561 . . . . 1.34 111.115 -179.411 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.443 ' C ' ' H ' ' A' ' 143' ' ' GLU . 59.9 Cg_endo -71.35 107.01 2.05 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 C-N-CA 122.557 2.171 . . . . 0.67 112.01 -176.192 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.04 14.93 0.46 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.172 0.511 . . . . 3.68 111.372 -178.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.443 ' H ' ' C ' ' A' ' 141' ' ' PRO . 0.5 OUTLIER -95.2 -40.22 9.69 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 115.74 -0.664 . . . . 2.7 109.774 178.082 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 52.8 tt0 55.24 70.06 0.67 Allowed 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.025 -0.989 . . . . 2.34 110.776 -179.045 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 1.7 t -94.6 132.34 38.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.111 -0.495 . . . . 1.66 110.241 -177.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.418 ' CD ' ' HE ' ' A' ' 34' ' ' ARG . 26.8 tt0 -78.21 146.0 35.22 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.739 0.304 . . . . 1.53 110.191 178.236 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 82.5 mt . . . . . 0 C--O 1.247 0.934 0 CA-C-O 118.626 -0.702 . . . . 1.57 110.118 -179.315 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.783 0 N-CA-C 111.618 -0.593 . . . . 2.47 111.618 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 125.68 -60.94 0.62 Allowed Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.785 -0.721 . . . . 1.97 111.415 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 179.06 115.0 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.198 -0.667 . . . . 3.98 109.198 175.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 315' ' ' ALY . . . . . 0.414 ' HB2' ' HB3' ' A' ' 121' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 11.2 mtmt . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.42 -0.8 . . . . 4.91 110.245 -177.94 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.476 0.451 0 N-CA-C 110.371 -0.665 . . . . 6.97 110.371 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.79 -167.27 0.45 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.42 -0.355 . . . . 6.2 111.08 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -75.97 77.52 1.31 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 121.016 -0.611 . . . . 3.98 112.892 -177.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 78.2 p -93.59 131.35 38.95 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 110.2 -0.296 . . . . 2.49 110.2 175.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.657 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 6.9 mt-10 -63.78 125.43 24.32 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.255 0.55 . . . . 2.07 111.812 -179.375 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 9.8 p -108.61 -16.97 8.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.269 -0.878 . . . . 1.5 109.879 176.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 33.7 m -161.55 138.26 8.4 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.369 -0.832 . . . . 1.85 109.263 -178.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -134.43 121.07 15.06 Favored Pre-proline 0 C--N 1.322 -0.615 0 N-CA-C 110.113 -0.328 . . . . 1.62 110.113 178.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -74.86 -37.28 2.2 Favored 'Trans proline' 0 N--CA 1.473 0.305 0 C-N-CA 123.414 2.743 . . . . 2.05 112.843 -178.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 16.3 m -69.46 -25.14 63.95 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 121.795 0.807 . . . . 2.24 109.64 179.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.4 ttmm -82.85 134.16 47.46 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 114.685 -1.143 . . . . 3.33 109.496 174.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.478 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 11.4 Cg_endo -56.06 133.76 60.01 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.02 1.813 . . . . 1.8 111.115 175.484 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -124.57 69.35 0.48 Allowed Glycine 0 N--CA 1.444 -0.818 0 CA-C-N 115.644 -0.707 . . . . 0.97 111.887 -171.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -101.35 -179.13 3.94 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.307 -0.627 . . . . 2.37 109.307 178.37 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.511 ' O ' ' HG2' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -143.32 137.53 28.86 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.89 -0.411 . . . . 3.13 109.89 178.271 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.461 ' HA ' ' HA ' ' A' ' 146' ' ' GLU . 2.1 p -120.64 174.59 6.48 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.311 -0.404 . . . . 1.29 110.251 179.296 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 56.7 t-20 -50.34 -44.65 54.54 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.705 0.628 . . . . 1.47 110.158 175.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.425 ' HG2' ' SD ' ' A' ' 140' ' ' MET . 3.3 mt-30 -60.63 -43.1 97.9 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.227 -0.442 . . . . 1.04 110.836 179.204 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -55.02 -56.88 14.85 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.528 -0.76 . . . . 1.39 110.856 -178.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -70.88 -31.03 67.56 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.84 -0.618 . . . . 1.75 111.105 -178.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.455 ' OH ' ' HB2' ' A' ' 139' ' ' GLN . 58.9 t80 -58.34 -63.72 1.17 Allowed 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.814 -0.63 . . . . 1.2 111.42 -179.505 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.1 -30.69 69.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.618 0.247 . . . . 1.76 111.039 -172.427 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.417 ' O ' HG11 ' A' ' 47' ' ' VAL . 8.5 tt0 -62.29 -53.17 58.99 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.038 -0.528 . . . . 1.47 111.317 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.451 ' O ' ' HB2' ' A' ' 48' ' ' LYS . 50.3 m-80 -87.94 -29.49 20.77 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.932 0.396 . . . . 0.53 112.048 -177.579 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 92.7 t -89.26 -58.66 3.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 N-CA-C 112.559 0.578 . . . . 1.11 112.559 -175.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 61.3 t -77.54 -65.12 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 C-N-CA 120.977 -0.289 . . . . 1.07 111.579 -169.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.417 HG11 ' O ' ' A' ' 43' ' ' GLN . 1.6 p -66.51 -34.19 68.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 C-N-CA 120.512 -0.475 . . . . 1.44 111.546 -174.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.451 ' HB2' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -62.86 -35.46 80.05 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 120.559 -0.457 . . . . 2.85 111.457 177.826 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 22.8 m -77.35 -39.28 48.11 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.858 -0.337 . . . . 1.23 110.79 177.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -37.97 83.49 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.221 0.534 . . . . 1.11 109.699 176.24 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 16.6 t-105 -63.78 -30.18 71.31 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.231 -0.895 . . . . 0.44 111.626 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.9 mttm -83.16 -5.94 59.3 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.197 0.443 . . . . 2.75 112.197 -173.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.467 ' ND1' HD12 ' A' ' 129' ' ' LEU . 3.7 t-80 -74.73 131.72 41.06 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.546 -0.539 . . . . 0.47 109.546 176.19 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -76.79 -11.87 59.9 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.591 -0.277 . . . . 1.91 111.397 -175.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 1.5 m-30 -92.87 -2.54 55.78 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.11 0.481 . . . . 1.24 110.14 176.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -96.78 14.26 25.76 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.111 -0.495 . . . . 1.09 110.596 179.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.523 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 47.6 p-90 -66.37 -33.2 6.29 Favored Pre-proline 0 CA--C 1.546 0.811 0 N-CA-C 114.016 1.117 . . . . 0.65 114.016 -174.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.523 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 11.7 Cg_exo -71.94 -2.05 10.92 Favored 'Trans proline' 0 C--N 1.361 1.228 0 C-N-CA 121.443 1.429 . . . . 0.61 112.328 178.825 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.424 ' CE2' HD12 ' A' ' 122' ' ' ILE . 3.5 m-85 -111.19 15.73 21.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.272 -0.422 . . . . 1.52 110.632 -178.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.46 ' CE2' ' HA ' ' A' ' 57' ' ' TRP . 18.3 m-30 -83.21 -12.07 57.22 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.051 -0.522 . . . . 1.01 110.699 179.261 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.71 135.28 27.11 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.205 -0.452 . . . . 2.11 110.306 -177.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.426 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 54.5 Cg_endo -71.47 147.3 51.9 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 122.718 2.279 . . . . 1.1 112.599 -177.648 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.6 t -70.38 105.92 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.525 0 CA-C-O 121.931 0.872 . . . . 1.46 110.326 176.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.415 ' HB3' ' HB3' ' A' ' 67' ' ' LYS . 12.0 t70 -116.07 131.1 57.04 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 107.601 -1.259 . . . . 1.85 107.601 166.348 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.14 -16.11 61.18 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.317 -0.401 . . . . 1.43 111.462 -173.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.9 mt -97.42 -44.08 12.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.031 0.443 . . . . 2.38 110.663 177.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.415 ' HB3' ' HB3' ' A' ' 64' ' ' ASP . 14.8 tptm -66.0 -48.41 71.29 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.729 -0.669 . . . . 3.34 111.587 -177.019 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -101.8 1.74 37.53 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.502 -0.317 . . . . 2.3 110.701 -177.137 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 47.7 t30 58.23 55.06 5.32 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.868 -0.605 . . . . 1.89 111.332 178.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.0 mt -123.37 70.67 44.7 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 115.892 -0.595 . . . . 2.18 111.269 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.98 -19.78 22.77 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.158 1.905 . . . . 1.42 111.441 178.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -77.46 -16.44 58.76 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.322 -0.854 . . . . 1.97 110.557 -179.756 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -61.27 -38.17 85.77 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.371 -0.831 . . . . 1.53 111.732 -176.412 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 8.1 m-70 -83.43 -0.79 51.58 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.083 -0.508 . . . . 1.22 111.303 -169.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.5 mtpt -93.02 -21.51 19.7 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.141 0.496 . . . . 3.34 109.815 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mt -114.53 -49.28 5.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.51 -0.768 . . . . 1.5 111.001 -178.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 33.9 mm -99.87 123.12 52.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.058 0.456 . . . . 1.19 110.44 -178.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.37 -9.25 51.05 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.985 -0.552 . . . . 2.35 110.891 -177.463 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -134.6 80.31 51.04 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.9 -0.591 . . . . 2.05 110.743 -179.414 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -70.7 94.7 0.61 Allowed 'Trans proline' 0 CA--C 1.529 0.26 0 C-N-CA 122.478 2.119 . . . . 1.24 112.219 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -128.13 159.78 34.07 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.167 0.508 . . . . 1.39 110.981 -176.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.426 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 16.2 p-10 -135.93 -126.45 0.15 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.929 -1.032 . . . . 1.42 109.742 -175.021 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' MET . . . . . 0.423 ' H ' ' CG ' ' A' ' 82' ' ' ASP . 2.4 ttm -122.76 -18.1 6.64 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.43 -0.581 . . . . 1.14 109.43 177.116 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.422 ' HA2' ' HG2' ' A' ' 87' ' ' LYS . . . -82.13 -35.74 20.15 Favored Glycine 0 N--CA 1.44 -1.036 0 N-CA-C 109.808 -1.317 . . . . 0.33 109.808 179.484 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.8 m -72.36 -31.64 65.78 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.236 -0.482 . . . . 1.6 110.621 174.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.404 HD12 ' HB2' ' A' ' 104' ' ' ASP . 0.2 OUTLIER -64.67 -53.29 44.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 109.145 -0.687 . . . . 1.63 109.145 177.454 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.422 ' HG2' ' HA2' ' A' ' 84' ' ' GLY . 0.2 OUTLIER -65.39 -26.18 67.88 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.896 -0.593 . . . . 1.71 110.737 179.384 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.01 -47.21 81.19 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-O 120.81 0.338 . . . . 2.93 110.54 179.124 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 9.5 mtp180 -67.81 -31.59 71.55 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.23 -0.441 . . . . 1.49 110.619 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.3 mt -68.43 -52.27 34.57 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.061 -0.518 . . . . 1.14 111.254 178.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -75.66 -18.82 59.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.36 -0.382 . . . . 1.39 111.822 -175.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -95.27 0.05 53.44 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.749 0.309 . . . . 1.66 110.411 178.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 56.58 66.48 1.18 Allowed 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.614 -0.721 . . . . 1.75 110.921 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . 0.657 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 11.3 t80 -70.76 -57.76 4.32 Favored 'General case' 0 CA--C 1.512 -0.483 0 CA-C-O 121.765 0.793 . . . . 1.3 110.725 175.44 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -103.7 -177.88 3.5 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 114.268 -1.333 . . . . 1.72 112.074 -173.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . 0.478 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 2.3 t-105 -79.89 -44.61 20.12 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.444 -1.253 . . . . 1.15 110.647 -177.217 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 14.5 t -146.68 175.37 10.65 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.994 -0.548 . . . . 1.05 110.971 -173.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.15 -14.54 60.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.253 -0.43 . . . . 1.31 111.083 -176.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.12 -31.22 68.74 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.479 0.657 . . . . 1.12 109.869 174.469 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.64 -39.31 45.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.365 -0.834 . . . . 2.44 110.228 177.012 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 31.7 t -62.85 -22.62 66.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.595 -0.729 . . . . 1.24 110.586 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 5.4 mtt -58.97 -21.1 57.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.89 -0.595 . . . . 1.66 110.646 175.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -76.27 -55.94 5.1 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 116.38 -0.373 . . . . 3.72 110.328 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . 0.404 ' HB2' HD12 ' A' ' 86' ' ' ILE . 0.1 OUTLIER -67.07 -40.62 87.07 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.361 -0.381 . . . . 1.87 111.224 -176.21 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.24 -45.32 91.45 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.129 0.49 . . . . 0.45 110.548 176.623 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -64.72 -43.96 91.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.847 -0.615 . . . . 1.23 110.336 178.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' THR . . . . . 0.45 ' O ' ' HB3' ' A' ' 111' ' ' ASN . 57.3 m -53.98 -46.58 71.73 Favored 'General case' 0 C--N 1.332 -0.157 0 O-C-N 123.76 0.663 . . . . 1.09 111.31 -178.403 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -52.83 -40.29 63.21 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.12 -0.491 . . . . 1.44 111.07 178.195 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -74.85 -50.53 16.72 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.303 -0.408 . . . . 0.29 111.512 -177.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.28 -43.47 97.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.926 0.393 . . . . 1.33 111.058 -177.041 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . 0.45 ' HB3' ' O ' ' A' ' 107' ' ' THR . 0.1 OUTLIER -51.76 -44.31 63.31 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.386 -0.825 . . . . 2.36 111.252 179.229 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.83 -36.01 82.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.402 -0.363 . . . . 1.09 110.842 -178.535 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -71.85 -24.32 61.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.252 -0.431 . . . . 1.17 111.395 -178.006 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 25.2 mt -89.84 -49.11 14.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.361 -0.381 . . . . 1.18 111.226 -177.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 88.0 t80 -69.22 -32.11 71.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.442 . . . . 1.6 111.461 -175.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 54.1 m-80 -108.15 169.62 8.51 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.126 0.489 . . . . 1.37 111.531 -173.016 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 11.2 mmtt -82.53 149.45 61.02 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.672 -0.694 . . . . 3.92 109.969 177.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -66.23 -9.6 24.26 Favored 'Trans proline' 0 CA--C 1.53 0.319 0 C-N-CA 122.576 2.184 . . . . 1.32 112.848 -177.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -111.53 27.67 9.46 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.822 0.344 . . . . 1.71 111.269 179.605 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -99.85 164.58 11.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 1.34 110.705 178.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -64.26 -49.16 72.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.834 -0.621 . . . . 1.44 110.417 -178.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.424 HD12 ' CE2' ' A' ' 59' ' ' PHE . 3.4 tp -61.45 -35.95 70.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.12 -0.491 . . . . 1.16 111.054 -175.517 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 2.4 t -70.4 -47.1 67.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 121.001 0.429 . . . . 1.1 110.157 177.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.2 mt -60.91 -35.25 76.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.726 -0.67 . . . . 1.22 110.238 -179.052 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 29.6 mtt -73.2 -43.36 61.46 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.757 -0.656 . . . . 1.25 110.619 179.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.97 -35.22 68.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.239 -0.437 . . . . 1.1 111.491 -179.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -62.89 -42.65 99.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.275 -0.42 . . . . 2.08 111.007 179.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -77.06 -39.73 48.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 1.04 110.518 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.467 HD12 ' ND1' ' A' ' 53' ' ' HIS . 2.3 mp -57.49 -39.74 77.09 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.483 -0.78 . . . . 1.16 110.757 178.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.6 -26.63 68.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.706 -0.679 . . . . 1.47 111.527 -177.68 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.5 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 27.6 mttt -64.9 -35.97 82.87 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.887 -0.412 . . . . 2.7 109.887 -179.64 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . 0.445 HD12 ' CD2' ' A' ' 53' ' ' HIS . 2.5 mt -74.77 -30.51 24.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.735 -0.666 . . . . 1.79 110.393 178.629 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.562 ' O ' HG22 ' A' ' 137' ' ' VAL . 49.5 t80 -59.29 -61.84 2.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.88 -0.6 . . . . 0.52 110.153 177.434 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.02 -30.07 71.32 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.102 0.477 . . . . 1.26 110.534 -178.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.5 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -59.49 -31.6 69.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.469 -0.787 . . . . 2.07 112.173 -180.0 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.72 -22.32 15.43 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.072 0.463 . . . . 2.11 110.444 -179.504 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.639 ' O ' ' HB2' ' A' ' 140' ' ' MET . 56.1 t -77.92 -31.9 17.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.63 -0.714 . . . . 1.09 110.436 -179.329 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.24 -18.27 64.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.167 0.508 . . . . 1.21 110.419 178.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . 0.455 ' HB2' ' OH ' ' A' ' 41' ' ' TYR . 1.9 mt-30 -98.18 2.8 48.82 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.633 -0.712 . . . . 1.94 110.324 179.487 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' MET . . . . . 0.639 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 1.6 mtt -67.39 147.68 98.81 Favored Pre-proline 0 C--O 1.233 0.219 0 CA-C-N 115.874 -0.603 . . . . 1.34 110.667 177.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.31 105.7 2.09 Favored 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.222 1.948 . . . . 0.67 111.508 175.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.04 8.37 2.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.083 0.468 . . . . 3.68 111.487 -174.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -91.06 -38.82 12.55 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.846 -0.616 . . . . 2.7 109.864 178.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 61.8 91.31 0.06 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 114.647 -1.161 . . . . 2.34 110.641 -177.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 10.3 t -111.08 126.27 68.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 115.897 -0.592 . . . . 1.66 109.532 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.461 ' HA ' ' HA ' ' A' ' 36' ' ' THR . 4.1 tt0 -71.64 149.23 45.77 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.993 0.425 . . . . 1.53 111.135 -177.443 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 16.0 mt . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.881 -0.58 . . . . 1.57 110.555 -178.245 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.772 0 N-CA-C 111.725 -0.55 . . . . 2.47 111.725 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 118.41 -47.98 0.98 Allowed Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.806 -0.712 . . . . 1.97 111.735 178.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 1.8 tpmp? -157.23 123.73 4.96 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.845 0.355 . . . . 3.98 110.222 177.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 315' ' ' ALY . . . . . 0.403 ' NZ ' ' HB3' ' A' ' 58' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 8.2 mmtm . . . . . 0 C--O 1.244 0.766 0 CA-C-O 118.547 -0.74 . . . . 4.91 109.993 -179.082 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo . . . . . 0 N--CA 1.479 0.646 0 N-CA-C 110.202 -0.73 . . . . 6.97 110.202 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.439 ' H ' ' HG ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -106.83 111.99 24.75 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.002 0.43 . . . . 6.2 110.614 179.129 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.85 -88.58 1.06 Allowed Glycine 0 N--CA 1.452 -0.293 0 CA-C-N 115.77 -0.65 . . . . 3.98 112.16 179.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.8 p -137.69 141.74 41.09 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.516 -0.549 . . . . 2.49 109.516 176.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.642 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 5.2 mt-10 -49.31 116.28 1.65 Allowed 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.415 0.626 . . . . 2.07 112.144 178.157 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.3 p -101.94 -6.23 9.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 115.461 -0.79 . . . . 1.5 109.522 176.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 70.8 m -160.83 145.85 14.22 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 114.963 -1.017 . . . . 1.85 109.73 178.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.459 ' HB3' ' CB ' ' A' ' 31' ' ' LYS . 24.8 t-20 -146.57 126.85 6.93 Favored Pre-proline 0 C--N 1.316 -0.852 0 N-CA-C 108.765 -0.828 . . . . 1.62 108.765 175.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -61.81 -46.13 14.72 Favored 'Trans proline' 0 N--CA 1.474 0.374 0 C-N-CA 123.241 2.628 . . . . 2.05 113.305 -175.024 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 6.1 m -77.55 -22.74 50.56 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.212 0.529 . . . . 2.24 110.927 -177.045 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.459 ' CB ' ' HB3' ' A' ' 28' ' ' ASN . 9.3 tttm -77.22 124.77 87.12 Favored Pre-proline 0 C--N 1.321 -0.665 0 CA-C-N 115.393 -0.821 . . . . 3.33 111.231 -177.624 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -76.09 151.57 34.87 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.538 2.159 . . . . 1.8 111.975 175.754 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -136.85 136.06 8.09 Favored Glycine 0 N--CA 1.443 -0.86 0 N-CA-C 110.366 -1.094 . . . . 0.97 110.366 177.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.98 166.19 22.96 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.187 0.517 . . . . 2.37 111.361 -176.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -115.23 70.13 0.74 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.32 -0.854 . . . . 3.13 109.483 -179.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.6 p -89.0 170.02 11.02 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.84 -0.344 . . . . 1.29 110.726 -177.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.48 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 67.2 t30 -59.55 -47.34 85.95 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 115.939 -0.573 . . . . 1.47 110.406 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -56.0 -46.58 78.68 Favored 'General case' 0 C--O 1.233 0.231 0 O-C-N 123.296 0.373 . . . . 1.04 110.821 179.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.91 -59.61 5.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.103 -0.498 . . . . 1.39 111.355 -178.248 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -65.55 -28.26 69.03 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.088 -0.505 . . . . 1.75 110.613 -177.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.556 ' CE1' ' HG2' ' A' ' 140' ' ' MET . 36.3 t80 -60.89 -63.34 1.33 Allowed 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.172 -0.467 . . . . 1.2 110.974 176.736 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -63.82 -28.45 69.87 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.736 -0.385 . . . . 1.76 110.648 -172.436 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -66.08 -50.58 63.62 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.86 -0.609 . . . . 1.47 110.743 178.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.9 m-80 -86.53 -31.1 21.45 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 111.99 0.367 . . . . 0.53 111.99 -177.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 99.4 t -89.34 -58.47 3.47 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.924 0 N-CA-C 112.446 0.536 . . . . 1.11 112.446 -176.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 71.3 t -77.23 -66.14 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.337 -0.392 . . . . 1.07 111.685 -169.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.444 ' O ' HG21 ' A' ' 47' ' ' VAL . 1.8 p -65.83 -36.05 76.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 C-N-CA 120.531 -0.468 . . . . 1.44 111.588 -175.185 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 7.8 mttt -63.05 -39.61 95.25 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.343 -0.543 . . . . 2.85 111.496 178.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 90.2 m -69.75 -39.33 76.8 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.729 0.299 . . . . 1.23 110.801 177.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.28 -40.29 95.65 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 109.724 -0.473 . . . . 1.11 109.724 176.391 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . 0.43 ' CE3' ' HE3' ' A' ' 83' ' ' MET . 15.5 t-105 -62.87 -35.91 81.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.541 -0.754 . . . . 0.44 111.025 177.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -81.68 9.59 7.51 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.412 -0.358 . . . . 2.75 111.873 -177.21 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.405 ' ND1' HD12 ' A' ' 129' ' ' LEU . 10.8 t-80 -90.05 126.46 35.78 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.299 -0.63 . . . . 0.47 109.299 173.276 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -81.97 15.46 2.28 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 112.114 0.412 . . . . 1.91 112.114 -173.279 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -111.43 -5.3 14.62 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.205 -0.665 . . . . 1.24 109.205 171.524 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -95.57 16.93 15.83 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.579 -0.737 . . . . 1.09 110.613 179.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.526 ' CG ' ' HD3' ' A' ' 58' ' ' PRO . 57.9 p-90 -67.28 -35.16 8.07 Favored Pre-proline 0 CA--C 1.54 0.593 0 N-CA-C 113.527 0.936 . . . . 0.65 113.527 -175.366 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.526 ' HD3' ' CG ' ' A' ' 57' ' ' TRP . 2.9 Cg_exo -76.17 2.82 6.77 Favored 'Trans proline' 0 C--N 1.361 1.223 0 C-N-CA 121.445 1.43 . . . . 0.61 111.425 175.314 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -107.2 -4.85 18.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.396 -0.82 . . . . 1.52 110.687 -178.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.0 m-30 -71.15 -29.1 64.8 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.315 -0.402 . . . . 1.01 111.748 -176.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.75 123.39 45.88 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-N 116.269 -0.423 . . . . 2.11 111.203 -172.512 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.551 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 25.0 Cg_exo -61.56 144.65 97.88 Favored 'Trans proline' 0 C--O 1.238 0.481 0 C-N-CA 122.686 2.258 . . . . 1.1 112.314 178.164 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 4.0 t -80.69 111.49 17.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-O 121.661 0.743 . . . . 1.46 110.633 -179.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.503 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.0 OUTLIER -111.51 -0.09 16.31 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.043 -0.98 . . . . 1.85 109.478 177.488 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.503 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 78.38 -55.66 0.48 Allowed 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 114.762 -1.108 . . . . 1.43 111.5 -177.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.7 mp -80.41 -44.32 21.99 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 O-C-N 122.177 -0.327 . . . . 2.38 111.749 -173.142 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.423 ' HG2' ' HB3' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -64.03 -31.04 72.09 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.594 0.22 . . . . 3.34 111.594 -177.424 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 5.0 tp -109.81 3.61 20.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.643 0.258 . . . . 2.3 111.601 -176.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . 0.415 ' O ' HD12 ' A' ' 70' ' ' LEU . 13.6 t-20 58.85 59.52 2.81 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.361 0.6 . . . . 1.89 111.236 179.287 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.415 HD12 ' O ' ' A' ' 69' ' ' ASN . 0.0 OUTLIER -124.7 72.96 62.12 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 115.222 -0.899 . . . . 2.18 109.625 178.051 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -74.49 -58.83 0.05 OUTLIER 'Trans proline' 0 CA--C 1.531 0.34 0 C-N-CA 121.952 1.768 . . . . 1.42 112.928 -174.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -79.83 6.77 10.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.387 0.613 . . . . 1.97 111.019 -176.445 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -61.04 -38.42 86.08 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.233 -0.894 . . . . 1.53 110.613 177.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . 0.473 ' NE2' ' HB1' ' A' ' 65' ' ' ALA . 5.1 m-70 -80.25 -0.4 36.24 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.461 -0.79 . . . . 1.22 111.404 -175.764 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.2 mmtp -94.47 -44.24 7.98 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.658 -0.497 . . . . 3.34 109.658 -179.032 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 14.0 mt -82.99 -47.18 18.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.807 -0.633 . . . . 1.5 110.807 179.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.6 mm -93.53 133.64 33.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.167 -0.47 . . . . 1.19 110.056 -178.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.55 -36.28 24.12 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.136 -0.484 . . . . 2.35 110.54 -177.161 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -119.56 88.88 39.82 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 115.771 -0.65 . . . . 2.05 110.279 -179.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -74.46 80.57 2.24 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 122.857 2.371 . . . . 1.24 112.297 -178.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.63 176.52 5.14 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.358 0.599 . . . . 1.39 111.158 -178.442 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.551 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 4.4 p-10 -154.32 -129.08 0.03 OUTLIER 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 114.763 -1.108 . . . . 1.42 108.96 -172.254 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' MET . . . . . 0.43 ' HE3' ' CE3' ' A' ' 51' ' ' TRP . 6.7 ttp -124.69 -16.8 6.12 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.245 0.545 . . . . 1.14 110.242 -177.875 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -90.05 -29.47 15.09 Favored Glycine 0 N--CA 1.44 -1.044 0 N-CA-C 110.455 -1.058 . . . . 0.33 110.455 -178.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -70.06 -42.65 72.55 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 121.258 0.552 . . . . 1.6 110.373 177.185 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.447 HD12 ' O ' ' A' ' 82' ' ' ASP . 48.8 mt -61.95 -44.1 98.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.249 -0.887 . . . . 1.63 109.944 175.819 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.73 -34.56 76.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.838 -0.619 . . . . 1.71 111.44 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.0 mtpt -62.1 -49.09 77.31 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.393 0.616 . . . . 2.93 110.518 179.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 32.5 mtp180 -66.69 -29.38 69.36 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.382 -0.827 . . . . 1.49 111.314 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 6.3 mt -70.18 -51.67 29.35 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.297 -0.41 . . . . 1.14 110.883 177.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -73.68 -17.45 61.14 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.142 -0.481 . . . . 1.39 111.695 -175.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 14.4 t30 -100.94 1.32 39.69 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 121.028 -0.269 . . . . 1.66 110.825 178.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 54.77 58.92 4.41 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.937 -0.574 . . . . 1.75 111.184 178.149 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . 0.642 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 43.5 t80 -76.51 -28.56 56.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.167 -0.47 . . . . 1.3 111.283 -178.603 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.408 ' HA ' ' HZ2' ' A' ' 31' ' ' LYS . 0.1 OUTLIER -117.36 179.76 3.95 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.119 0.485 . . . . 1.72 111.217 -177.537 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 2.1 t-105 -81.34 -44.47 17.57 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.282 -0.872 . . . . 1.15 110.771 -177.071 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 36.5 t -148.12 -179.6 7.04 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.034 -0.53 . . . . 1.05 111.166 -172.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.45 -18.05 60.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.067 -0.515 . . . . 1.31 111.196 -176.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.38 -29.43 67.7 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.319 0.581 . . . . 1.12 110.195 177.322 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -82.34 -24.64 34.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.508 -0.769 . . . . 2.44 110.265 -179.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 9.6 t -83.42 -30.57 27.2 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.528 -0.76 . . . . 1.24 110.876 -178.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 8.8 ttm -59.01 -33.8 71.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.802 -0.635 . . . . 1.66 111.532 -177.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.48 -45.51 87.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.165 -0.471 . . . . 3.72 110.611 -179.54 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.26 -38.05 71.9 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.328 -0.396 . . . . 1.87 110.316 -179.422 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.97 -43.97 86.81 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.856 -0.611 . . . . 0.45 110.802 178.466 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 31.0 t30 -66.53 -46.29 76.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.973 -0.558 . . . . 1.23 110.08 176.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 94.2 m -57.14 -41.38 79.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.787 -0.642 . . . . 1.09 111.859 -179.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -54.25 -35.09 62.13 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 120.792 0.33 . . . . 1.44 111.141 177.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -78.97 -49.58 12.53 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.233 -0.439 . . . . 0.29 110.753 -177.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.77 -42.85 89.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.352 -0.385 . . . . 1.33 110.876 179.759 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -51.6 -47.1 63.73 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.589 -0.732 . . . . 2.36 111.002 178.017 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 4.4 t -62.32 -44.82 95.6 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 120.765 0.316 . . . . 1.09 110.938 177.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . 0.454 ' HH ' ' HA ' ' A' ' 127' ' ' GLN . 16.8 m-85 -65.41 -34.2 77.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.295 -0.411 . . . . 1.17 111.613 -177.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 54.4 mt -80.48 -52.77 13.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.468 -0.333 . . . . 1.18 111.701 -176.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 93.0 t80 -64.77 -35.49 81.25 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.865 0.364 . . . . 1.6 111.156 -175.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 -99.8 -175.98 3.13 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.084 -0.507 . . . . 1.37 110.552 -175.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.571 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 0.2 OUTLIER -93.33 150.73 39.5 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 109.469 -0.567 . . . . 3.92 109.469 176.161 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -62.9 -15.35 46.81 Favored 'Trans proline' 0 N--CA 1.471 0.174 0 C-N-CA 122.29 1.993 . . . . 1.32 112.141 177.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.88 16.63 24.89 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.6 -0.727 . . . . 1.71 110.927 177.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . 0.571 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 0.2 OUTLIER -80.04 159.01 26.34 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 120.884 0.373 . . . . 1.34 110.569 -178.752 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . 0.418 ' HB2' ' O ' ' B' ' 313' ' ' GLY . 4.9 m-20 -68.01 -46.72 70.47 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.726 -0.67 . . . . 1.44 110.666 -177.856 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -62.69 -37.83 80.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.123 -0.489 . . . . 1.16 110.634 179.232 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 2.3 t -66.12 -42.19 90.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.009 0.433 . . . . 1.1 110.252 178.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -33.38 72.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.843 -0.617 . . . . 1.22 109.878 179.909 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' MET . . . . . 0.447 ' O ' HD11 ' A' ' 129' ' ' LEU . 11.9 mtt -75.06 -47.47 28.73 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.403 -0.817 . . . . 1.25 110.515 177.001 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -55.9 -37.91 69.51 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.11 -0.495 . . . . 1.1 111.358 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . 0.454 ' HA ' ' HH ' ' A' ' 113' ' ' TYR . 0.9 OUTLIER -59.03 -41.4 87.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.979 -0.555 . . . . 2.08 111.043 178.268 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -76.17 -38.89 56.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.027 0.442 . . . . 1.04 110.602 178.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.447 HD11 ' O ' ' A' ' 125' ' ' MET . 2.3 mp -57.31 -41.76 80.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.566 -0.743 . . . . 1.16 110.399 177.787 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -61.27 -26.28 67.66 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.281 -0.872 . . . . 1.47 112.106 -176.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.534 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 49.4 mttm -62.64 -45.78 91.27 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 120.751 0.31 . . . . 2.7 110.38 -175.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -77.48 -21.89 14.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.185 -0.462 . . . . 1.79 110.903 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.576 ' O ' HG23 ' A' ' 137' ' ' VAL . 22.0 t80 -63.43 -61.98 1.98 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.652 -0.249 . . . . 0.52 110.516 177.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.0 -27.2 67.95 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.115 0.484 . . . . 1.26 110.219 -178.386 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.534 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -58.87 -56.74 18.34 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.173 -0.922 . . . . 2.07 110.865 174.384 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.67 -30.29 70.51 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.92 -0.582 . . . . 2.11 110.867 -177.761 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.576 HG23 ' O ' ' A' ' 133' ' ' PHE . 83.2 t -66.53 -34.8 72.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.146 -0.479 . . . . 1.09 110.229 176.311 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -70.84 -15.32 62.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.163 -0.472 . . . . 1.21 111.019 179.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . 0.46 ' HG3' ' O ' ' A' ' 135' ' ' GLN . 11.1 mt-30 -98.25 -6.38 31.24 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.398 -0.364 . . . . 1.94 110.596 177.816 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' MET . . . . . 0.556 ' HG2' ' CE1' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -66.12 159.21 72.7 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.086 -0.507 . . . . 1.34 110.453 -179.927 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -74.65 116.95 4.77 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 121.479 1.452 . . . . 0.67 110.366 174.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 -71.34 -2.78 17.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.514 0.673 . . . . 3.68 110.391 -178.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.6 -130.92 0.21 Allowed 'General case' 0 N--CA 1.432 -1.371 0 CA-C-N 114.768 -1.105 . . . . 2.7 108.861 179.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 178.8 132.5 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.08 -0.711 . . . . 2.34 109.08 169.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 2.4 t -131.66 114.45 25.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.305 -0.407 . . . . 1.66 110.118 -179.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -76.09 134.21 40.09 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 110.221 -0.288 . . . . 1.53 110.221 179.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 4.3 mt . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.647 -0.692 . . . . 1.57 110.346 -179.195 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.666 0 N-CA-C 111.076 -0.809 . . . . 2.47 111.076 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 313' ' ' GLY . . . . . 0.418 ' O ' ' HB2' ' A' ' 121' ' ' ASP . . . 102.9 -76.41 0.3 Allowed Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.517 -0.849 . . . . 1.97 112.425 178.564 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -94.6 120.56 35.02 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.812 0.339 . . . . 3.98 110.565 -174.559 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.961 0 N-CA-C 109.225 -0.658 . . . . 4.91 109.225 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo . . . . . 0 N--CA 1.481 0.736 0 N-CA-C 109.457 -1.017 . . . . 6.97 109.457 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.53 73.56 5.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.264 0.554 . . . . 6.2 109.976 176.708 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 167.04 79.71 0.04 OUTLIER Glycine 0 N--CA 1.444 -0.79 0 CA-C-N 115.554 -0.748 . . . . 3.98 111.353 -177.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 3.1 m -117.82 134.53 54.83 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.129 0.49 . . . . 2.49 110.783 179.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.441 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 2.7 mt-10 -64.5 152.79 40.83 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.288 -0.869 . . . . 2.07 112.319 -178.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.1 p -122.94 -2.69 7.2 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 114.911 -1.04 . . . . 1.5 109.329 174.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.2 m -169.87 143.37 2.58 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.706 -1.134 . . . . 1.85 108.514 178.441 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -151.91 140.21 13.33 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-O 120.555 0.216 . . . . 1.62 110.527 -178.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -70.76 -45.15 1.12 Allowed 'Trans proline' 0 N--CA 1.475 0.439 0 C-N-CA 123.193 2.595 . . . . 2.05 113.323 177.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.7 m -74.8 -28.34 60.68 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 121.206 0.527 . . . . 2.24 110.389 -176.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -86.31 114.84 59.61 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 115.488 -0.778 . . . . 3.33 109.015 174.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.48 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 5.9 Cg_exo -66.66 148.11 82.64 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 121.651 1.567 . . . . 1.8 111.812 -176.84 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -144.81 119.51 1.26 Allowed Glycine 0 N--CA 1.44 -1.045 0 N-CA-C 110.638 -0.985 . . . . 0.97 110.638 -179.194 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.3 mmm-85 -134.52 171.51 14.21 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.861 -0.422 . . . . 2.37 109.861 -176.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.7 ttpt -111.1 98.56 7.62 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.649 -0.5 . . . . 3.13 109.649 -179.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.429 ' HG1' ' CD ' ' A' ' 144' ' ' GLU . 2.8 p -106.15 167.25 9.94 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.748 0.309 . . . . 1.29 111.366 -178.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.569 ' HB3' ' O ' ' A' ' 145' ' ' VAL . 0.1 OUTLIER -66.78 -35.52 80.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.096 -0.502 . . . . 1.47 110.781 -179.582 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -70.32 -38.87 75.02 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.894 0.378 . . . . 1.04 110.34 176.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.537 ' O ' ' HG2' ' A' ' 43' ' ' GLN . 0.5 OUTLIER -62.88 -52.63 62.37 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.003 -0.544 . . . . 1.39 110.339 178.253 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.95 -20.88 65.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.008 -0.542 . . . . 1.75 111.134 -179.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.547 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 43.4 t80 -68.31 -63.47 1.05 Allowed 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.741 -0.663 . . . . 1.2 111.33 179.851 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.543 ' O ' HG21 ' A' ' 47' ' ' VAL . 1.5 ttm -60.37 -33.85 73.04 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 111.978 0.362 . . . . 1.76 111.978 -170.101 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.537 ' HG2' ' O ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -63.01 -48.91 76.75 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.154 0.502 . . . . 1.47 110.585 -175.423 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.533 ' O ' ' HB2' ' A' ' 48' ' ' LYS . 69.7 m-80 -85.79 -31.29 22.41 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.835 -0.621 . . . . 0.53 111.537 -178.312 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 88.3 t -89.01 -59.72 2.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 112.878 0.695 . . . . 1.11 112.878 -175.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.492 ' HB ' ' HG2' ' A' ' 42' ' ' MET . 21.9 t -79.14 -51.82 16.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 C-N-CA 120.992 -0.283 . . . . 1.07 110.669 -171.183 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.543 HG21 ' O ' ' A' ' 42' ' ' MET . 14.7 t -58.34 -47.61 87.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.912 -0.586 . . . . 1.44 111.083 -178.03 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.533 ' HB2' ' O ' ' A' ' 44' ' ' ASN . 3.6 mttt -63.34 -29.9 71.13 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.214 0.449 . . . . 2.85 112.214 -177.474 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.5 m -73.99 -42.05 60.99 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.77 -0.372 . . . . 1.23 110.129 177.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -42.18 98.71 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.609 0.719 . . . . 1.11 109.43 174.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 8.1 t-105 -58.48 -35.02 71.56 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.664 -1.153 . . . . 0.44 111.99 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 10.9 mtpp -91.36 12.99 18.68 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.301 0.482 . . . . 2.75 112.301 -173.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.4 ' ND1' ' HB2' ' A' ' 55' ' ' PHE . 15.3 t-80 -85.94 138.81 31.73 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.104 -0.332 . . . . 0.47 110.104 176.772 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.3 mm-40 -75.45 0.99 15.17 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.049 0.388 . . . . 1.91 112.049 -174.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.4 ' HB2' ' ND1' ' A' ' 53' ' ' HIS . 0.5 OUTLIER -111.56 -1.87 15.66 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.951 0.405 . . . . 1.24 110.638 178.238 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -100.95 16.31 25.7 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.014 0.435 . . . . 1.09 110.764 -178.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.532 ' CG ' ' HD3' ' A' ' 58' ' ' PRO . 63.7 p-90 -64.91 -36.34 16.12 Favored Pre-proline 0 CA--C 1.545 0.775 0 N-CA-C 113.742 1.016 . . . . 0.65 113.742 -174.204 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.532 ' HD3' ' CG ' ' A' ' 57' ' ' TRP . 60.5 Cg_endo -84.25 9.34 4.17 Favored 'Trans proline' 0 C--N 1.359 1.103 0 CA-C-N 120.873 1.347 . . . . 0.61 111.881 178.256 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -112.75 21.17 15.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.636 -0.711 . . . . 1.52 110.777 -177.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 18.2 m-30 -91.64 -16.68 26.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.481 -0.327 . . . . 1.01 111.482 -176.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -114.96 133.25 22.67 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 116.559 -0.291 . . . . 2.11 110.897 -173.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.59 ' HA ' ' OD1' ' A' ' 82' ' ' ASP . 27.3 Cg_endo -63.28 142.73 87.27 Favored 'Trans proline' 0 C--O 1.237 0.474 0 C-N-CA 122.539 2.16 . . . . 1.1 112.191 179.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 40.0 t -71.64 93.09 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 122.137 0.97 . . . . 1.46 110.466 178.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.492 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.0 OUTLIER -98.65 -3.08 36.87 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.653 -1.158 . . . . 1.85 108.978 175.272 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.492 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 81.38 -35.52 0.11 Allowed 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 114.155 -1.384 . . . . 1.43 111.703 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 42.9 mt -95.04 -48.52 12.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 120.676 0.274 . . . . 2.38 110.355 179.346 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.41 -38.04 58.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.736 -0.666 . . . . 3.34 112.074 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.8 tp -109.96 6.69 23.37 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.555 -0.293 . . . . 2.3 111.394 -175.459 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 59.24 51.45 6.87 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.265 0.555 . . . . 1.89 111.374 178.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 17.6 mt -126.97 71.7 75.59 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.83 -0.623 . . . . 2.18 110.402 179.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -72.47 -40.99 1.89 Allowed 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.338 2.025 . . . . 1.42 113.051 -174.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -92.41 26.29 2.66 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.31 0.576 . . . . 1.97 111.085 -176.016 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.573 ' HH ' HH33 ' B' ' 312' ' ' ALY . 0.5 OUTLIER -70.04 -53.87 15.67 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.584 -0.734 . . . . 1.53 111.814 -178.855 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -73.96 4.99 4.6 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.796 -0.638 . . . . 1.22 112.252 -171.089 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.0 mttp -88.26 -21.82 24.27 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.591 -0.522 . . . . 3.34 109.591 179.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.7 mp -122.82 -48.33 2.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.692 -0.685 . . . . 1.5 110.443 -179.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 41.5 mm -83.26 124.42 39.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 120.898 0.38 . . . . 1.19 110.209 -179.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 10.9 mmtt -77.49 -44.88 27.36 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.88 -0.6 . . . . 2.35 110.903 -176.519 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 41.4 m-20 -113.39 97.76 44.34 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 116.197 -0.456 . . . . 2.05 110.284 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -75.12 79.4 2.7 Favored 'Trans proline' 0 CA--C 1.528 0.213 0 C-N-CA 122.9 2.4 . . . . 1.24 112.197 -178.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 4.0 mmt -119.25 151.57 38.17 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.281 0.562 . . . . 1.39 110.755 -177.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.59 ' OD1' ' HA ' ' A' ' 62' ' ' PRO . 3.2 p-10 -132.64 -112.84 0.23 Allowed 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 114.885 -1.052 . . . . 1.42 109.485 -174.094 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.6 ttm -131.66 -21.89 2.45 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 122.141 -0.349 . . . . 1.14 110.639 175.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -81.95 -33.08 27.74 Favored Glycine 0 N--CA 1.442 -0.902 0 N-CA-C 110.322 -1.111 . . . . 0.33 110.322 179.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -70.02 -35.08 74.07 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-O 121.134 0.492 . . . . 1.6 110.113 175.358 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.4 mm -56.28 -61.37 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.257 -0.883 . . . . 1.63 110.044 175.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.55 ' O ' ' HG3' ' A' ' 91' ' ' GLU . 0.3 OUTLIER -62.09 -28.68 69.79 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.428 -0.806 . . . . 1.71 111.609 -179.292 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 65.1 tttt -63.76 -42.65 97.78 Favored 'General case' 0 C--O 1.226 -0.154 0 C-N-CA 120.675 -0.41 . . . . 2.93 110.411 -179.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 6.5 mtm-85 -74.45 -24.27 59.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.93 0.395 . . . . 1.49 110.755 -177.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.418 HD11 ' SD ' ' A' ' 42' ' ' MET . 3.2 mt -75.32 -53.46 8.72 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.787 -0.642 . . . . 1.14 110.645 177.286 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.55 ' HG3' ' O ' ' A' ' 87' ' ' LYS . 13.2 mt-10 -69.56 -37.1 76.87 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.957 -0.565 . . . . 1.39 110.948 -176.876 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -78.55 -11.03 59.94 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.393 -0.367 . . . . 1.66 110.824 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 63.01 69.06 0.6 Allowed 'General case' 0 N--CA 1.462 0.172 0 O-C-N 123.844 0.715 . . . . 1.75 111.427 176.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . 0.441 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 11.4 t80 -80.1 -47.32 14.99 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.818 -0.628 . . . . 1.3 111.145 179.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -117.42 -174.23 2.57 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.958 0.408 . . . . 1.72 110.999 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . 0.48 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 1.9 t-105 -67.07 -68.4 0.38 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.368 -0.833 . . . . 1.15 112.005 -175.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 75.3 m -121.2 168.18 11.88 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.002 -0.545 . . . . 1.05 111.582 -171.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . 0.436 ' CB ' ' HA ' ' A' ' 39' ' ' LEU . . . -68.32 -16.87 64.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.763 -0.653 . . . . 1.31 111.352 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' SER . . . . . 0.456 ' O ' ' HB2' ' A' ' 102' ' ' MET . 0.3 OUTLIER -61.15 -26.37 67.64 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.265 -0.425 . . . . 1.12 110.993 179.409 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -38.65 64.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.208 0.528 . . . . 2.44 110.147 176.595 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -21.52 63.7 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.488 -0.778 . . . . 1.24 110.367 179.679 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.456 ' HB2' ' O ' ' A' ' 99' ' ' SER . 8.5 mmt -57.23 -33.26 67.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.021 -0.536 . . . . 1.66 110.131 175.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.42 HE21 ' HB3' ' A' ' 103' ' ' GLN . 0.3 OUTLIER -72.52 -39.66 67.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.494 -0.776 . . . . 3.72 110.039 178.945 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -70.68 -38.06 73.71 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.856 -0.611 . . . . 1.87 110.323 -178.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -57.47 -48.53 78.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.661 -0.699 . . . . 0.45 109.919 174.26 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -59.69 -41.15 90.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.716 -0.674 . . . . 1.23 110.106 176.126 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 86.5 m -58.33 -45.97 87.11 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.672 -0.695 . . . . 1.09 111.455 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -54.47 -47.18 73.26 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.001 0.429 . . . . 1.44 110.738 176.092 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -66.19 -40.95 90.79 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.813 -0.631 . . . . 0.29 111.23 -177.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.82 -43.07 80.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.742 0.306 . . . . 1.33 110.247 178.457 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -49.85 -48.56 51.04 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.651 -0.704 . . . . 2.36 110.669 176.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . 0.43 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 1.5 t -62.48 -41.05 98.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.186 -0.461 . . . . 1.09 110.859 178.351 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -70.79 -27.11 63.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.413 -0.358 . . . . 1.17 111.625 -177.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 59.4 mt -85.22 -50.15 14.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 120.779 0.323 . . . . 1.18 111.395 -177.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -86.25 36.25 0.68 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.416 0.627 . . . . 1.6 111.738 -174.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . 0.43 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 51.6 m-80 -157.59 -172.85 4.13 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.142 -0.936 . . . . 1.37 109.703 -179.078 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.411 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 2.5 mttp -96.39 150.06 36.64 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 109.539 -0.541 . . . . 3.92 109.539 174.276 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -59.68 -19.97 55.96 Favored 'Trans proline' 0 N--CA 1.475 0.389 0 C-N-CA 122.564 2.176 . . . . 1.32 112.798 -179.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -118.67 30.7 7.05 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.913 -0.585 . . . . 1.71 110.618 177.866 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . 0.411 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 1.5 t0 -84.24 173.36 11.06 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.055 0.455 . . . . 1.34 111.886 -175.425 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -67.23 -56.66 8.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.267 -0.879 . . . . 1.44 111.736 -173.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.436 ' O ' HG13 ' A' ' 122' ' ' ILE . 1.0 OUTLIER -69.17 -29.37 42.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.978 0.418 . . . . 1.16 110.542 -179.546 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 2.1 t -64.44 -43.62 96.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.268 -0.424 . . . . 1.1 110.178 177.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.0 mt -56.28 -35.69 67.76 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 115.628 -0.715 . . . . 1.22 109.817 176.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' MET . . . . . 0.457 ' O ' HD11 ' A' ' 129' ' ' LEU . 30.7 mtt -73.38 -43.81 59.85 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.015 -0.993 . . . . 1.25 110.654 -178.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -55.1 -36.57 65.83 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.831 0.348 . . . . 1.1 111.048 178.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.53 -44.36 97.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.865 -0.607 . . . . 2.08 111.211 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.44 -35.29 60.96 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.082 0.468 . . . . 1.04 110.474 178.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.457 HD11 ' O ' ' A' ' 125' ' ' MET . 1.8 mp -62.27 -44.98 95.3 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.532 -0.758 . . . . 1.16 110.914 179.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -70.8 -22.28 62.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.48 -0.327 . . . . 1.47 111.727 -176.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 37.2 mttm -70.34 -41.73 72.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.812 0.339 . . . . 2.7 110.126 -177.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . 0.451 ' HA ' ' HB2' ' A' ' 135' ' ' GLN . 1.6 pt -79.88 -21.24 12.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.401 -0.363 . . . . 1.79 110.332 176.221 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.511 ' O ' HG23 ' A' ' 137' ' ' VAL . 25.1 t80 -61.58 -61.79 2.27 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.224 -0.444 . . . . 0.52 110.258 173.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.4 pp -64.38 -25.29 67.96 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 121.028 0.442 . . . . 1.26 110.462 -177.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.451 ' HB2' ' HA ' ' A' ' 132' ' ' ILE . 0.0 OUTLIER -55.75 -47.71 76.5 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.395 -0.82 . . . . 2.07 111.117 176.373 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.44 -24.27 34.38 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.939 -0.573 . . . . 2.11 110.786 -178.112 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' ' 133' ' ' PHE . 95.6 t -66.61 -35.87 75.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 121.299 0.571 . . . . 1.09 110.066 176.46 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.97 -17.58 64.48 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.808 -0.633 . . . . 1.21 110.606 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -101.82 3.82 39.73 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.969 -0.559 . . . . 1.94 110.811 178.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' MET . . . . . 0.471 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 24.0 mtp -72.84 146.07 87.45 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.343 -0.39 . . . . 1.34 109.973 175.876 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.427 ' C ' ' H ' ' A' ' 143' ' ' GLU . 42.0 Cg_endo -68.1 116.29 4.25 Favored 'Trans proline' 0 N--CA 1.464 -0.255 0 C-N-CA 122.409 2.073 . . . . 0.67 112.291 -178.461 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -78.01 15.05 0.96 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.273 0.559 . . . . 3.68 110.615 177.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.427 ' H ' ' C ' ' A' ' 141' ' ' PRO . 12.2 mt-10 -99.74 -47.82 4.93 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-N 115.731 -0.668 . . . . 2.7 110.186 -178.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.429 ' CD ' ' HG1' ' A' ' 36' ' ' THR . 4.6 tp10 61.99 89.13 0.08 Allowed 'General case' 0 C--O 1.237 0.395 0 CA-C-N 115.015 -0.993 . . . . 2.34 110.41 -174.743 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . 0.569 ' O ' ' HB3' ' A' ' 37' ' ' ASN . 2.8 t -104.4 115.3 46.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.461 -0.791 . . . . 1.66 109.654 178.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -68.4 147.15 52.48 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.546 -0.297 . . . . 1.53 110.887 -177.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 12.1 mt . . . . . 0 C--O 1.248 0.989 0 CA-C-O 118.186 -0.912 . . . . 1.57 110.922 -177.705 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.705 0 N-CA-C 111.551 -0.619 . . . . 2.47 111.551 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 312' ' ' ALY . . . . . 0.573 HH33 ' HH ' ' A' ' 73' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 83.06 -138.41 17.92 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.849 -0.691 . . . . 1.97 111.994 -179.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.97 138.33 31.5 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.968 0.413 . . . . 3.98 110.337 178.72 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.87 -0.586 . . . . 4.91 109.471 178.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo . . . . . 0 N--CA 1.479 0.64 0 N-CA-C 110.7 -0.539 . . . . 6.97 110.7 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -121.61 136.69 54.94 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.505 -0.554 . . . . 6.2 109.505 178.46 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.22 59.46 6.31 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.879 -0.677 . . . . 3.98 112.485 -178.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 26.6 p -69.61 172.92 6.65 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 110.495 -0.187 . . . . 2.49 110.495 177.453 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.569 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 5.2 mt-10 -49.75 116.36 1.75 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.357 0.598 . . . . 2.07 112.449 -178.687 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.2 p -103.7 -13.6 8.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.263 -0.88 . . . . 1.5 109.956 178.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.6 m -165.78 147.59 7.21 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.31 -0.859 . . . . 1.85 109.415 179.288 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.498 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 23.0 t-20 -148.83 125.99 5.53 Favored Pre-proline 0 C--N 1.317 -0.824 0 CA-C-N 115.972 -0.558 . . . . 1.62 109.605 177.789 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -66.44 -43.32 8.23 Favored 'Trans proline' 0 N--CA 1.474 0.374 0 C-N-CA 123.375 2.717 . . . . 2.05 113.282 -175.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.0 m -75.4 -26.53 58.5 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-O 121.451 0.643 . . . . 2.24 110.468 -176.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.498 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 11.1 tttm -82.77 121.93 77.99 Favored Pre-proline 0 C--N 1.318 -0.775 0 CA-C-N 115.179 -0.918 . . . . 3.33 109.985 178.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.444 ' HB2' ' CZ3' ' A' ' 96' ' ' TRP . 23.1 Cg_endo -64.96 132.33 31.86 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.027 1.818 . . . . 1.8 112.116 -179.898 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -138.38 77.7 0.33 Allowed Glycine 0 N--CA 1.445 -0.707 0 CA-C-N 115.119 -0.946 . . . . 0.97 110.947 -178.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -85.98 148.96 25.51 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.02 0.438 . . . . 2.37 111.08 -173.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.79 102.56 14.78 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.955 -0.566 . . . . 3.13 110.045 176.274 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.3 p -110.51 167.23 10.37 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.911 0.386 . . . . 1.29 111.004 176.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -63.12 -39.92 96.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.806 -0.634 . . . . 1.47 111.264 -179.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -64.6 -42.86 95.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.559 -0.291 . . . . 1.04 110.521 178.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.465 ' O ' ' HG2' ' A' ' 43' ' ' GLN . 0.5 OUTLIER -59.01 -52.31 66.3 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.272 -0.422 . . . . 1.39 110.641 -179.754 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.424 ' O ' ' HG3' ' A' ' 43' ' ' GLN . 1.4 mt-30 -70.1 -19.98 63.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.04 -0.527 . . . . 1.75 111.186 -179.586 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -64.83 -63.34 1.14 Allowed 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.966 -0.561 . . . . 1.2 111.307 178.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.495 ' O ' HG12 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -58.84 -34.84 72.02 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 111.879 0.326 . . . . 1.76 111.879 -170.922 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.465 ' HG2' ' O ' ' A' ' 39' ' ' LEU . 0.5 OUTLIER -63.81 -49.59 72.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.208 0.528 . . . . 1.47 110.398 -176.192 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -85.46 -29.89 23.95 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.894 -0.594 . . . . 0.53 111.943 -177.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 87.8 t -89.37 -58.54 3.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 112.491 0.552 . . . . 1.11 112.491 -177.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 43.8 t -78.4 -66.06 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 120.645 0.26 . . . . 1.07 111.305 -172.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.495 HG12 ' O ' ' A' ' 42' ' ' MET . 2.0 m -64.17 -33.75 64.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.366 -0.379 . . . . 1.44 111.8 -173.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.44 ' N ' HG21 ' A' ' 47' ' ' VAL . 2.5 mttp -69.5 -31.98 70.57 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.848 -0.341 . . . . 2.85 111.467 -178.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.1 m -77.22 -38.57 51.0 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.785 -0.366 . . . . 1.23 110.386 177.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -35.72 81.84 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 109.409 -0.589 . . . . 1.11 109.409 175.132 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 13.7 t-105 -62.79 -34.2 76.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.635 -0.711 . . . . 0.44 111.209 178.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.5 mttt -84.28 5.68 25.79 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.944 -0.302 . . . . 2.75 111.763 -175.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.464 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 14.3 t-80 -84.96 134.17 34.25 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.57 -0.53 . . . . 0.47 109.57 175.379 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -85.19 12.41 7.99 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.827 0.346 . . . . 1.91 111.829 -173.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.464 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.6 OUTLIER -111.97 -1.08 15.54 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.338 0.59 . . . . 1.24 109.42 172.364 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -100.9 20.21 15.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.647 -0.706 . . . . 1.09 110.534 179.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.566 ' CG ' ' HD3' ' A' ' 58' ' ' PRO . 40.5 p-90 -73.13 -35.41 2.76 Favored Pre-proline 0 CA--C 1.541 0.623 0 N-CA-C 113.025 0.75 . . . . 0.65 113.025 -175.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.566 ' HD3' ' CG ' ' A' ' 57' ' ' TRP . 2.9 Cg_exo -75.82 -1.13 11.01 Favored 'Trans proline' 0 C--N 1.361 1.208 0 C-N-CA 121.475 1.45 . . . . 0.61 110.703 174.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -102.98 -7.95 21.03 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 114.778 -1.101 . . . . 1.52 110.537 -178.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 9.0 m-30 -65.35 -50.67 64.71 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.947 -0.57 . . . . 1.01 111.365 -176.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.15 127.33 64.61 Favored Pre-proline 0 C--N 1.32 -0.686 0 CA-C-N 115.425 -0.807 . . . . 2.11 110.549 -174.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.598 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 37.8 Cg_endo -67.94 150.07 77.93 Favored 'Trans proline' 0 C--O 1.237 0.469 0 C-N-CA 122.766 2.311 . . . . 1.1 112.799 -177.355 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 4.0 t -72.02 97.97 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 122.19 0.995 . . . . 1.46 109.958 175.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -109.44 13.47 24.08 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.524 -1.217 . . . . 1.85 109.385 176.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 65.71 -73.77 0.06 Allowed 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 114.791 -1.095 . . . . 1.43 111.453 -175.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.5 mt -65.5 -39.91 86.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 120.8 0.333 . . . . 2.38 111.282 -174.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.1 -29.1 68.37 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.021 -0.536 . . . . 3.34 112.176 -177.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -120.18 7.11 10.75 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.941 -0.304 . . . . 2.3 111.785 -176.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 66.1 t30 61.84 48.82 5.14 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.292 0.568 . . . . 1.89 111.04 -179.428 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 5.3 mt -126.04 71.4 69.18 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.047 -0.524 . . . . 2.18 111.673 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -75.7 -27.62 8.76 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 121.928 1.752 . . . . 1.42 111.83 176.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.0 -4.97 59.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.257 -0.429 . . . . 1.97 110.882 -179.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -59.53 -49.6 77.16 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.805 -0.634 . . . . 1.53 110.494 179.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 72.1 m-70 -77.98 8.28 4.93 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.51 -0.768 . . . . 1.22 111.457 -175.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 24.3 mttt -99.3 -19.96 16.79 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.453 0.644 . . . . 3.34 109.595 177.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.0 mt -114.93 -50.31 4.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.731 -0.668 . . . . 1.5 109.99 177.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 24.0 mm -95.48 103.38 14.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.826 -0.625 . . . . 1.19 109.767 179.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.0 mttt -83.08 -11.78 57.7 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.954 -0.567 . . . . 2.35 110.48 -178.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 16.1 m-80 -123.93 73.05 55.0 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.67 -0.696 . . . . 2.05 109.756 174.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -80.76 102.15 1.36 Allowed 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.534 2.156 . . . . 1.24 112.759 -175.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.5 mmt -130.64 152.93 49.47 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.953 -0.567 . . . . 1.39 110.292 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.598 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 1.1 p30 -139.36 -116.23 0.14 Allowed 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.061 -0.972 . . . . 1.42 109.607 -174.603 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -125.22 -27.09 3.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.053 0.454 . . . . 1.14 110.189 177.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.505 ' O ' ' HG3' ' A' ' 88' ' ' LYS . . . -84.28 -31.75 24.55 Favored Glycine 0 N--CA 1.441 -0.999 0 N-CA-C 110.799 -0.92 . . . . 0.33 110.799 -177.712 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -70.51 -40.85 73.29 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.928 0.394 . . . . 1.6 110.503 177.264 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.534 HD12 ' O ' ' A' ' 82' ' ' ASP . 34.7 mt -63.81 -42.51 96.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.657 -0.701 . . . . 1.63 109.938 176.047 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.87 -33.14 72.62 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.034 -0.53 . . . . 1.71 111.147 178.081 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' A' ' 84' ' ' GLY . 35.8 mttt -62.09 -50.48 71.76 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-O 121.115 0.483 . . . . 2.93 110.628 179.766 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 16.3 mtp180 -69.69 -32.93 71.81 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.676 -0.693 . . . . 1.49 111.415 -176.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 8.7 mt -66.53 -54.34 24.89 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.175 -0.466 . . . . 1.14 111.316 -179.556 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -69.59 -23.33 63.52 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.258 -0.428 . . . . 1.39 111.642 -175.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.414 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 0.5 OUTLIER -89.37 -2.46 58.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.653 -0.249 . . . . 1.66 110.895 -179.01 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 59.73 54.41 4.43 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.242 0.544 . . . . 1.75 111.164 -179.345 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . 0.569 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 78.0 t80 -80.35 -27.33 38.32 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.056 -0.52 . . . . 1.3 110.54 178.402 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.647 ' CD1' ' HB3' ' A' ' 100' ' ' GLU . 8.2 m-85 -96.88 178.32 5.33 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-O 121.844 0.831 . . . . 1.72 111.432 -178.496 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . 0.444 ' CZ3' ' HB2' ' A' ' 32' ' ' PRO . 2.2 t-105 -94.19 -56.12 2.95 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 113.703 -1.589 . . . . 1.15 108.872 170.372 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 67.3 m -129.19 167.98 16.83 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 114.919 -1.037 . . . . 1.05 109.597 -177.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -70.79 -12.29 61.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.774 0.321 . . . . 1.31 111.647 -177.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -21.49 66.31 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.068 -0.515 . . . . 1.12 110.591 177.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.647 ' HB3' ' CD1' ' A' ' 95' ' ' TYR . 2.0 tt0 -77.03 -33.22 57.41 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.054 -0.521 . . . . 2.44 109.922 179.445 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -75.81 -22.08 56.7 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.383 -0.826 . . . . 1.24 110.724 -177.446 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 5.0 ttm -59.01 -30.95 68.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.084 -0.507 . . . . 1.66 110.454 178.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.07 -43.26 74.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.674 -0.694 . . . . 3.72 110.115 178.071 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -67.87 -43.39 79.51 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.756 -0.656 . . . . 1.87 110.82 -177.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -60.42 -44.4 95.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.101 -0.5 . . . . 0.45 110.445 178.055 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 39.4 t30 -60.7 -39.64 89.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.048 -0.524 . . . . 1.23 110.301 177.438 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 85.3 m -68.53 -44.16 75.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.563 -0.744 . . . . 1.09 111.463 179.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.09 -44.09 70.91 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.174 -0.466 . . . . 1.44 111.08 178.29 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -70.3 -43.83 69.57 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.12 -0.491 . . . . 0.29 111.026 -177.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -66.33 -37.26 84.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.813 0.34 . . . . 1.33 110.665 -178.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -50.27 -51.58 43.59 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.481 -0.781 . . . . 2.36 110.901 176.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 2.0 t -60.86 -36.43 79.13 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.548 -0.296 . . . . 1.09 111.194 178.121 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -69.79 -27.65 65.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.434 -0.348 . . . . 1.17 111.536 -177.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 29.0 mt -92.13 -51.05 12.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.923 0.392 . . . . 1.18 111.618 -176.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -67.39 -38.25 84.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.28 0.562 . . . . 1.6 110.726 -177.152 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 38.8 m-20 -101.7 -172.12 2.1 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.88 -0.6 . . . . 1.37 109.669 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.31 147.28 51.82 Favored Pre-proline 0 C--N 1.32 -0.681 0 N-CA-C 110.213 -0.292 . . . . 3.92 110.213 -179.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . 0.424 ' HA ' ' CG1' ' A' ' 123' ' ' VAL . 52.0 Cg_exo -57.7 -20.13 41.29 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 123.013 2.475 . . . . 1.32 112.86 -179.452 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.0 21.11 2.83 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.802 -0.635 . . . . 1.71 111.687 -179.711 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . 0.569 ' OD1' ' HA ' ' B' ' 314' ' ' LYS . 4.4 t70 -118.5 165.73 13.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.166 0.508 . . . . 1.34 111.763 177.658 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . 0.406 ' HB2' ' O ' ' B' ' 315' ' ' ALY . 0.1 OUTLIER -67.49 -36.25 80.74 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.052 -0.976 . . . . 1.44 110.588 -179.683 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.1 tp -61.03 -40.56 86.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 CA-C-N 116.491 -0.322 . . . . 1.16 111.312 -177.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.442 ' O ' HG12 ' A' ' 123' ' ' VAL . 2.2 t -70.18 -39.6 77.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 C-N-CA 120.57 -0.452 . . . . 1.1 110.011 177.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.0 -35.34 74.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.857 -0.61 . . . . 1.22 109.409 178.818 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 38.0 mtt -68.67 -50.46 50.91 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.038 -0.983 . . . . 1.25 110.613 176.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -55.05 -38.57 68.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.361 -0.381 . . . . 1.1 111.106 179.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -60.35 -41.05 92.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.895 -0.593 . . . . 2.08 111.193 178.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -77.93 -39.17 43.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.997 0.427 . . . . 1.04 110.505 179.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.445 HD13 ' ND1' ' A' ' 53' ' ' HIS . 1.9 mp -58.99 -40.56 85.21 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.605 -0.725 . . . . 1.16 110.444 179.02 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -57.64 -29.71 64.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.294 -0.866 . . . . 1.47 111.996 -178.033 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.515 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -63.29 -39.34 94.32 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.829 0.347 . . . . 2.7 110.328 -176.778 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 11.1 mt -70.07 -28.31 35.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.981 -0.554 . . . . 1.79 110.851 -178.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.514 ' O ' HG22 ' A' ' 137' ' ' VAL . 26.9 t80 -62.48 -63.06 1.34 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.118 -0.492 . . . . 0.52 110.779 -179.374 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.46 -26.53 67.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.172 0.511 . . . . 1.26 110.422 -179.102 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.515 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.94 -41.96 97.28 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.538 -0.756 . . . . 2.07 111.281 179.353 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.82 -24.91 18.35 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.246 -0.434 . . . . 2.11 110.897 -177.41 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.514 HG22 ' O ' ' A' ' 133' ' ' PHE . 37.1 t -70.73 -33.64 53.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.316 -0.402 . . . . 1.09 110.833 -179.749 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -69.3 -12.55 61.76 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.13 0.491 . . . . 1.21 110.759 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -103.98 0.0 29.43 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.999 -0.546 . . . . 1.94 110.695 178.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' MET . . . . . 0.416 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 0.0 OUTLIER -59.89 146.84 80.88 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.109 -0.496 . . . . 1.34 110.812 178.465 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -74.47 94.61 0.92 Allowed 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 121.985 1.79 . . . . 0.67 111.034 178.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 8.9 mm-40 -84.77 31.86 0.53 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.456 0.646 . . . . 3.68 111.26 -175.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -116.41 -35.67 4.22 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 114.901 -1.045 . . . . 2.7 108.508 173.445 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . 0.416 ' C ' HG23 ' A' ' 145' ' ' VAL . 0.0 OUTLIER 74.18 138.37 0.06 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 113.882 -1.508 . . . . 2.34 111.468 177.724 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . 0.416 HG23 ' C ' ' A' ' 144' ' ' GLU . 45.3 t -144.32 102.27 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.185 -0.916 . . . . 1.66 109.831 -177.705 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.15 138.29 56.92 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.665 -0.495 . . . . 1.53 109.665 176.576 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 6.5 mt . . . . . 0 C--O 1.251 1.135 0 CA-C-O 118.524 -0.75 . . . . 1.57 110.745 -176.786 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.777 0 N-CA-C 112.254 -0.338 . . . . 2.47 112.254 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 128.13 -22.02 5.42 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 120.669 -0.776 . . . . 1.97 111.578 -178.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 314' ' ' LYS . . . . . 0.569 ' HA ' ' OD1' ' A' ' 120' ' ' ASP . 0.1 OUTLIER -146.67 94.5 2.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.97 0.414 . . . . 3.98 109.967 176.949 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 315' ' ' ALY . . . . . 0.406 ' O ' ' HB2' ' A' ' 121' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 3.5 ptmt . . . . . 0 C--O 1.246 0.896 0 CA-C-O 118.667 -0.682 . . . . 4.91 109.493 177.707 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo . . . . . 0 N--CA 1.477 0.523 0 N-CA-C 110.285 -0.698 . . . . 6.97 110.285 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -125.66 141.14 52.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.599 -0.273 . . . . 6.2 110.353 179.153 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.69 -80.83 1.79 Allowed Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.916 -0.659 . . . . 3.98 112.378 177.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -145.41 155.12 42.95 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 110.034 -0.358 . . . . 2.49 110.034 -178.108 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.627 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 4.9 mt-10 -50.44 118.81 3.25 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 123.548 0.53 . . . . 2.07 111.533 176.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.2 p -98.36 -17.4 6.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-O 121.671 0.748 . . . . 1.5 108.991 177.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 54.0 m -167.42 146.55 5.02 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.425 -1.261 . . . . 1.85 108.745 178.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.505 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 18.4 t-20 -135.49 129.72 18.69 Favored Pre-proline 0 C--N 1.317 -0.82 0 N-CA-C 108.879 -0.785 . . . . 1.62 108.879 176.709 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -59.79 -48.5 12.55 Favored 'Trans proline' 0 N--CA 1.472 0.264 0 C-N-CA 123.368 2.712 . . . . 2.05 113.361 -174.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.7 m -81.83 -28.31 33.16 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.854 0.359 . . . . 2.24 111.337 -174.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.505 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 0.4 OUTLIER -77.38 116.58 58.95 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.106 -0.497 . . . . 3.33 110.387 178.708 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.466 ' HB2' ' CZ3' ' A' ' 96' ' ' TRP . 6.8 Cg_exo -71.53 151.51 58.97 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.224 1.949 . . . . 1.8 112.18 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -148.66 77.69 0.23 Allowed Glycine 0 N--CA 1.444 -0.793 0 CA-C-N 115.345 -0.843 . . . . 0.97 111.111 178.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.3 mtm-85 -80.32 132.77 35.86 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.699 0.285 . . . . 2.37 110.247 -177.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -72.1 109.97 6.25 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.211 -0.449 . . . . 3.13 110.285 -177.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.49 ' CG2' ' HG3' ' A' ' 146' ' ' GLU . 5.3 p -107.81 166.86 10.38 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.661 -0.416 . . . . 1.29 110.513 177.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -60.26 -43.92 95.73 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 116.22 -0.446 . . . . 1.47 110.739 -179.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -58.53 -40.19 82.27 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.658 0.266 . . . . 1.04 110.973 -179.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.412 ' HB2' ' HA ' ' A' ' 97' ' ' SER . 0.6 OUTLIER -62.62 -57.57 10.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.081 -0.509 . . . . 1.39 110.956 -179.164 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -65.85 -29.61 70.1 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 115.986 -0.552 . . . . 1.75 110.848 -179.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 53.0 t80 -59.04 -63.89 1.14 Allowed 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.904 -0.589 . . . . 1.2 110.48 177.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.473 ' O ' HG11 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -58.73 -33.77 70.6 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 121.124 -0.23 . . . . 1.76 110.755 -174.896 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -57.57 -55.38 35.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.006 0.431 . . . . 1.47 110.885 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 51.3 m-80 -85.99 -29.93 23.12 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.067 -0.515 . . . . 0.53 111.805 -176.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 99.1 t -88.4 -56.89 4.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 N-CA-C 112.284 0.476 . . . . 1.11 112.284 -174.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 41.5 t -82.22 -66.57 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 111.814 0.301 . . . . 1.07 111.814 -172.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.473 HG11 ' O ' ' A' ' 42' ' ' MET . 1.3 m -63.37 -34.62 68.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 N-CA-C 111.604 0.224 . . . . 1.44 111.604 -173.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.35 -36.26 81.04 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.752 -0.379 . . . . 2.85 111.496 -179.301 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.4 m -76.06 -36.77 58.89 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.782 -0.367 . . . . 1.23 110.467 177.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.13 -42.48 99.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.29 0.566 . . . . 1.11 109.547 174.451 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 22.1 t-105 -55.91 -36.14 67.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.984 -1.007 . . . . 0.44 111.292 178.215 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 9.8 mmtp -90.57 22.02 3.68 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 112.445 0.535 . . . . 2.75 112.445 -172.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.457 ' ND1' HD12 ' A' ' 129' ' ' LEU . 34.3 t-80 -88.57 148.25 24.19 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 110.077 -0.342 . . . . 0.47 110.077 174.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -73.25 -16.15 61.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.315 -0.402 . . . . 1.91 111.931 -175.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 19.1 m-30 -106.72 3.24 26.44 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.924 0.392 . . . . 1.24 110.764 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -92.43 5.45 50.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.136 0.493 . . . . 1.09 111.003 -178.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.521 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 56.3 p-90 -63.84 -36.0 18.94 Favored Pre-proline 0 CA--C 1.548 0.897 0 N-CA-C 114.214 1.19 . . . . 0.65 114.214 -173.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.521 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 19.4 Cg_endo -79.99 -9.6 14.18 Favored 'Trans proline' 0 C--N 1.359 1.097 0 CA-C-N 121.407 1.538 . . . . 0.61 112.289 -178.609 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -98.19 9.09 43.77 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.058 -0.519 . . . . 1.52 110.347 -179.349 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 5.3 m-30 -70.96 -37.37 72.78 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.751 -0.659 . . . . 1.01 111.36 -178.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -101.95 134.36 20.15 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.898 -0.592 . . . . 2.11 110.846 -172.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.639 ' HA ' ' OD1' ' A' ' 82' ' ' ASP . 34.8 Cg_exo -57.62 147.73 77.7 Favored 'Trans proline' 0 C--O 1.239 0.54 0 C-N-CA 122.674 2.249 . . . . 1.1 112.099 176.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 3.8 t -68.19 106.67 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 121.785 0.802 . . . . 1.46 111.307 -178.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -114.92 130.19 56.86 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.716 -1.129 . . . . 1.85 108.071 168.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.17 -2.17 14.97 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 112.265 0.468 . . . . 1.43 112.265 -171.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 12.1 mt -113.74 -52.0 5.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.495 0.188 . . . . 2.38 111.012 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.6 tttp -59.37 -51.06 71.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.929 0.395 . . . . 3.34 111.211 -179.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.25 -7.83 50.12 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.25 -0.432 . . . . 2.3 110.298 179.252 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 56.51 63.26 2.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.267 -0.879 . . . . 1.89 110.667 -176.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -114.62 72.02 2.56 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 115.542 -0.754 . . . . 2.18 109.804 178.315 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -77.85 -51.09 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.467 2.111 . . . . 1.42 112.979 -173.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -72.87 -13.07 61.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.369 0.604 . . . . 1.97 110.538 -178.244 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -58.98 -39.99 83.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.084 -0.962 . . . . 1.53 110.899 178.529 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -75.27 -2.42 28.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.691 -0.686 . . . . 1.22 111.755 -175.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -104.59 -53.59 2.67 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.072 0.463 . . . . 3.34 110.443 -177.265 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.1 mp -76.55 -38.82 32.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.733 -0.667 . . . . 1.5 110.752 -177.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 47.8 mm -94.51 125.77 47.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 109.941 -0.392 . . . . 1.19 109.941 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.68 -28.24 33.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.278 -0.419 . . . . 2.35 111.128 -175.39 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 18.9 m-80 -132.83 81.07 59.38 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.433 -0.349 . . . . 2.05 110.431 178.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -68.65 95.34 0.46 Allowed 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 123.028 2.485 . . . . 1.24 111.863 179.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 5.8 mmt -127.46 160.82 30.31 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-O 121.39 0.614 . . . . 1.39 110.313 -178.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.639 ' OD1' ' HA ' ' A' ' 62' ' ' PRO . 2.5 p-10 -136.62 -134.27 0.14 Allowed 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 114.65 -1.159 . . . . 1.42 109.61 -170.472 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -123.36 -14.75 7.35 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.172 0.511 . . . . 1.14 109.849 -177.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -89.54 -32.39 10.34 Favored Glycine 0 N--CA 1.442 -0.916 0 N-CA-C 109.65 -1.38 . . . . 0.33 109.65 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 94.5 m -67.19 -42.33 84.36 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 114.916 -0.642 . . . . 1.6 110.823 174.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 43.4 mt -62.22 -45.79 97.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.031 0.443 . . . . 1.63 110.116 177.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.487 ' HG3' ' N ' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -64.81 -31.66 72.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.133 -0.485 . . . . 1.71 110.712 178.316 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.487 ' N ' ' HG3' ' A' ' 87' ' ' LYS . 16.5 tttp -63.62 -43.31 97.21 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 121.278 0.561 . . . . 2.93 110.755 179.232 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 10.2 mtp180 -76.22 -31.03 58.17 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.812 -0.631 . . . . 1.49 111.1 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 4.5 mt -64.8 -51.46 62.05 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.028 -0.533 . . . . 1.14 111.011 177.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -66.83 -31.25 71.74 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.873 -0.603 . . . . 1.39 111.597 -177.109 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -92.68 5.08 52.35 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.923 -0.311 . . . . 1.66 111.455 -177.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 60.41 55.13 3.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.906 -0.588 . . . . 1.75 111.8 175.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . 0.627 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 63.4 t80 -82.08 -22.39 36.32 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.338 0.59 . . . . 1.3 110.133 175.509 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . 0.591 ' CD1' ' HB3' ' A' ' 100' ' ' GLU . 46.5 m-85 -99.02 169.52 9.36 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.723 0.773 . . . . 1.72 112.151 -174.62 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . 0.466 ' CZ3' ' HB2' ' A' ' 32' ' ' PRO . 2.0 t90 -96.72 -38.1 10.04 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-N 113.994 -1.457 . . . . 1.15 108.688 169.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.412 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 8.6 t -155.88 168.54 26.88 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 115.544 -0.753 . . . . 1.05 110.166 -175.711 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -72.67 -9.4 58.58 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.481 -0.327 . . . . 1.31 111.634 -175.322 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.15 -21.76 65.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.1 0.476 . . . . 1.12 109.89 175.094 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.591 ' HB3' ' CD1' ' A' ' 95' ' ' TYR . 1.0 OUTLIER -78.16 -42.57 31.27 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.757 -0.831 . . . . 2.44 108.757 175.341 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 29.9 m -61.91 -34.84 76.79 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.054 -0.975 . . . . 1.24 110.627 177.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 3.2 ttm -58.35 -35.27 71.68 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.604 -0.725 . . . . 1.66 110.582 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -70.73 -41.21 72.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.884 -0.598 . . . . 3.72 110.123 179.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -68.83 -43.73 74.91 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.753 -0.658 . . . . 1.87 110.47 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -58.31 -46.04 86.89 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.026 -0.534 . . . . 0.45 110.058 176.421 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 14.6 t30 -56.71 -45.25 81.98 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.682 -0.69 . . . . 1.23 110.018 176.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 91.4 m -64.77 -45.99 84.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.974 -0.557 . . . . 1.09 111.504 179.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.06 -42.68 77.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.85 0.357 . . . . 1.44 110.66 178.233 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -72.89 -50.31 24.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.021 -0.536 . . . . 0.29 110.526 -178.013 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' THR . . . . . 0.417 ' O ' HG13 ' A' ' 114' ' ' ILE . 5.0 p -59.86 -35.98 75.91 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 116.373 -0.376 . . . . 1.33 111.047 -178.175 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -52.65 -42.9 65.1 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.136 -0.484 . . . . 2.36 110.679 178.571 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . 0.612 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 0.0 OUTLIER -73.81 -26.9 60.85 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.869 -0.605 . . . . 1.09 110.875 -179.207 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -85.47 -15.87 41.49 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.862 0.363 . . . . 1.17 111.194 -179.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 110' ' ' THR . 70.0 mt -89.19 -57.66 4.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.211 -0.45 . . . . 1.18 110.744 178.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 45.4 t80 -67.55 -51.59 48.87 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.853 -0.612 . . . . 1.6 110.563 -176.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . 0.612 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 28.6 m120 -79.59 176.3 9.83 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.592 -0.731 . . . . 1.37 110.707 -178.194 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 0.0 OUTLIER -101.1 153.24 37.87 Favored Pre-proline 0 C--N 1.321 -0.654 0 N-CA-C 109.329 -0.619 . . . . 3.92 109.329 177.786 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -64.44 2.74 1.06 Allowed 'Trans proline' 0 CA--C 1.535 0.548 0 C-N-CA 122.584 2.189 . . . . 1.32 112.686 178.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.31 5.03 13.51 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.165 -0.47 . . . . 1.71 110.609 177.299 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . 0.403 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 0.9 OUTLIER -75.5 164.08 26.73 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.215 0.531 . . . . 1.34 111.923 -173.407 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.7 -55.52 22.74 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.994 -1.003 . . . . 1.44 110.603 -178.134 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -62.78 -34.48 65.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.569 -0.741 . . . . 1.16 111.114 -179.627 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 1.5 t -64.75 -40.07 87.8 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-O 121.004 0.431 . . . . 1.1 110.312 178.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.1 -29.39 68.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.292 0.567 . . . . 1.22 110.055 176.736 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' MET . . . . . 0.545 ' O ' HD11 ' A' ' 129' ' ' LEU . 10.4 mtt -80.4 -48.04 13.5 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.591 -0.731 . . . . 1.25 110.438 178.563 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -53.91 -39.08 65.5 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.151 -0.477 . . . . 1.1 111.387 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -56.72 -42.87 79.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.31 -0.405 . . . . 2.08 111.301 178.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.99 -41.79 50.17 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.023 -0.535 . . . . 1.04 110.95 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.545 HD11 ' O ' ' A' ' 125' ' ' MET . 8.5 mp -57.88 -44.51 86.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.649 -0.705 . . . . 1.16 110.41 177.636 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -57.78 -26.96 62.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.116 -0.947 . . . . 1.47 111.902 -177.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.464 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -68.24 -41.46 81.16 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.648 -0.251 . . . . 2.7 110.479 -176.878 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 15.5 mt -69.24 -31.99 51.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.884 0.373 . . . . 1.79 110.17 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.498 ' O ' HG21 ' A' ' 137' ' ' VAL . 39.4 t80 -60.28 -61.94 2.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.776 -0.647 . . . . 0.52 110.599 178.347 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.8 pp -64.87 -28.12 69.33 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.907 0.384 . . . . 1.26 110.638 -177.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.464 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.7 OUTLIER -59.73 -56.58 20.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.688 -0.687 . . . . 2.07 110.778 178.726 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 1.2 mptp? -76.75 -20.46 56.46 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.768 -0.651 . . . . 2.11 111.138 -176.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.498 HG21 ' O ' ' A' ' 133' ' ' PHE . 23.1 t -73.97 -32.27 32.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.848 0.356 . . . . 1.09 110.289 178.445 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -65.13 -20.28 66.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.093 0.473 . . . . 1.21 110.14 176.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -97.24 -0.64 46.37 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.767 -0.651 . . . . 1.94 110.954 -178.323 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' MET . . . . . 0.477 ' HG3' ' HA ' ' A' ' 137' ' ' VAL . 0.6 OUTLIER -68.54 151.31 97.31 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.258 -0.428 . . . . 1.34 111.397 -178.967 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -72.87 106.56 2.16 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.583 2.189 . . . . 0.67 111.207 177.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.45 27.52 1.08 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.196 0.522 . . . . 3.68 111.726 -173.331 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -115.2 -38.93 3.72 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 115.383 -0.826 . . . . 2.7 109.536 176.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 71.78 95.76 0.07 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 114.986 -1.007 . . . . 2.34 111.106 176.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 1.7 t -112.4 139.09 38.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.847 -0.615 . . . . 1.66 109.959 178.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.49 ' HG3' ' CG2' ' A' ' 36' ' ' THR . 1.2 mt-10 -80.06 146.45 31.93 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.791 0.329 . . . . 1.53 110.825 179.192 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 51.3 mt . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.575 -0.726 . . . . 1.57 110.689 -178.736 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.681 0 N-CA-C 111.394 -0.682 . . . . 2.47 111.394 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 79.33 -114.82 3.97 Favored Glycine 0 N--CA 1.445 -0.718 0 C-N-CA 120.849 -0.691 . . . . 1.97 112.52 175.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.05 138.78 31.34 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.943 0.401 . . . . 3.98 110.839 -175.595 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.93 0 CA-C-O 118.241 -0.885 . . . . 4.91 109.823 179.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . 0.404 ' HB2' ' O ' ' A' ' 24' ' ' SER . 6.1 Cg_endo . . . . . 0 N--CA 1.477 0.545 0 N-CA-C 110.378 -0.662 . . . . 6.97 110.378 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -76.98 89.64 3.54 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.999 0.428 . . . . 6.2 110.514 179.699 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.62 -78.59 2.0 Allowed Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.889 -0.596 . . . . 3.98 112.182 179.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.404 ' O ' ' HB2' ' A' ' 21' ' ' PRO . 27.8 p -119.24 -177.4 3.34 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 110.449 -0.204 . . . . 2.49 110.449 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.402 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 4.2 mt-10 -51.93 144.55 11.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.275 -0.42 . . . . 2.07 110.818 172.598 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -119.81 -15.48 7.82 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-O 121.093 0.473 . . . . 1.5 110.165 174.732 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.3 m -166.3 135.61 3.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.624 -0.717 . . . . 1.85 110.086 -179.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -140.69 123.7 9.98 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 115.782 -0.645 . . . . 1.62 110.019 -179.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -79.91 -30.05 2.44 Favored 'Trans proline' 0 N--CA 1.475 0.41 0 C-N-CA 123.354 2.703 . . . . 2.05 112.8 177.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.4 t -76.43 -20.69 56.82 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.465 0.65 . . . . 2.24 109.571 -178.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.4 tttm -105.26 136.17 19.23 Favored Pre-proline 0 C--N 1.316 -0.865 0 CA-C-N 115.165 -0.925 . . . . 3.33 109.345 177.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.457 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 19.7 Cg_endo -60.21 137.87 77.78 Favored 'Trans proline' 0 C--O 1.239 0.53 0 C-N-CA 122.417 2.078 . . . . 1.8 112.274 178.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -141.12 78.04 0.29 Allowed Glycine 0 N--CA 1.446 -0.685 0 CA-C-N 115.089 -0.959 . . . . 0.97 110.869 -179.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.495 ' HG3' ' CE2' ' A' ' 96' ' ' TRP . 0.3 OUTLIER -93.86 174.26 7.26 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 110.291 -0.263 . . . . 2.37 110.291 -177.04 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.4 ttpp -120.53 107.02 12.35 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.821 0.344 . . . . 3.13 110.507 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.447 ' HB ' ' O ' ' A' ' 145' ' ' VAL . 7.3 p -107.5 165.39 11.44 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.689 -0.404 . . . . 1.29 110.232 177.188 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.448 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 62.5 t30 -58.15 -38.93 77.54 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.917 -0.583 . . . . 1.47 110.684 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -65.14 -39.53 93.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.03 -0.532 . . . . 1.04 110.996 -178.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.442 ' HB2' ' HA ' ' A' ' 97' ' ' SER . 0.9 OUTLIER -60.19 -58.84 6.78 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.216 -0.447 . . . . 1.39 110.809 -178.89 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 20.8 mt-30 -66.82 -26.51 66.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.961 -0.563 . . . . 1.75 110.981 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.448 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 56.6 t80 -60.25 -63.69 1.21 Allowed 'General case' 0 C--O 1.22 -0.498 0 CA-C-N 116.182 -0.463 . . . . 1.2 110.378 176.216 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.421 ' SD ' ' HB3' ' A' ' 101' ' ' CYS . 0.0 OUTLIER -60.24 -28.56 68.13 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 116.593 -0.276 . . . . 1.76 111.0 -174.47 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.485 ' O ' HG13 ' A' ' 47' ' ' VAL . 6.0 tt0 -62.71 -55.9 22.51 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.034 0.445 . . . . 1.47 111.288 177.687 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -86.56 -26.44 24.5 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.857 0.361 . . . . 0.53 111.963 -176.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 94.7 t -88.8 -57.59 4.12 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 N-CA-C 111.928 0.344 . . . . 1.11 111.928 -177.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 58.5 t -81.97 -64.45 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 112.33 0.493 . . . . 1.07 112.33 -169.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . 0.485 HG13 ' O ' ' A' ' 43' ' ' GLN . 0.7 OUTLIER -66.81 -30.81 50.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 C-N-CA 120.21 -0.596 . . . . 1.44 110.967 -175.162 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -62.37 -42.25 99.27 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 120.919 -0.312 . . . . 2.85 111.304 177.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 2.8 p -69.42 -33.57 73.17 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 120.807 0.337 . . . . 1.23 110.876 179.513 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.8 -41.48 83.11 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.997 -0.547 . . . . 1.11 109.698 176.439 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 15.0 t-105 -59.02 -36.78 75.54 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.153 -0.931 . . . . 0.44 111.538 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.8 mttm -82.98 7.69 14.86 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.025 0.38 . . . . 2.75 112.025 -174.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.426 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 13.1 t-80 -89.12 131.53 35.22 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.927 -0.397 . . . . 0.47 109.927 176.386 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -80.1 21.58 0.57 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.289 -0.414 . . . . 1.91 111.702 -175.257 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.426 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.2 OUTLIER -126.07 -6.43 6.64 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.3 0.571 . . . . 1.24 109.629 174.432 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -97.61 10.63 39.42 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.456 0.646 . . . . 1.09 110.264 179.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.468 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 57.4 p-90 -68.67 -31.68 3.14 Favored Pre-proline 0 CA--C 1.545 0.78 0 N-CA-C 113.954 1.094 . . . . 0.65 113.954 -175.608 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' PRO . . . . . 0.468 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 16.7 Cg_exo -68.52 -13.19 36.8 Favored 'Trans proline' 0 C--N 1.363 1.335 0 CA-C-N 121.193 1.462 . . . . 0.61 112.103 178.246 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -104.19 11.64 34.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.272 -0.422 . . . . 1.52 110.964 -178.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 2.6 m-30 -66.08 -43.91 85.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.089 -0.505 . . . . 1.01 111.433 -178.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -95.7 133.49 25.51 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.873 -0.603 . . . . 2.11 110.432 -175.611 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.439 ' HA ' ' OD2' ' A' ' 82' ' ' ASP . 18.3 Cg_endo -61.11 133.33 46.38 Favored 'Trans proline' 0 C--O 1.237 0.448 0 C-N-CA 122.783 2.322 . . . . 1.1 112.232 -179.755 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 1.7 t -68.65 113.16 4.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.868 0.842 . . . . 1.46 110.784 179.34 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -109.97 -0.88 17.97 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.803 -1.09 . . . . 1.85 109.39 177.216 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 78.03 -72.99 0.08 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 114.631 -1.168 . . . . 1.43 110.054 -171.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 31.1 mm -68.22 -44.64 83.93 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 116.577 -0.283 . . . . 2.38 111.585 -173.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 3.2 tptp -63.51 -19.9 65.16 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.307 0.484 . . . . 3.34 112.307 -176.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -114.02 10.16 17.47 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 122.19 -0.318 . . . . 2.3 111.173 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 61.23 42.53 11.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.611 0.72 . . . . 1.89 110.637 179.241 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.434 ' HB3' ' HB2' ' A' ' 73' ' ' TYR . 0.2 OUTLIER -119.51 73.93 16.27 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 114.943 -1.026 . . . . 2.18 110.555 -175.618 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -79.51 -34.48 1.03 Allowed 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 121.731 1.621 . . . . 1.42 112.967 -176.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -89.71 1.86 55.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.345 0.593 . . . . 1.97 110.785 -176.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.434 ' HB2' ' HB3' ' A' ' 70' ' ' LEU . 8.7 t80 -61.85 -50.47 72.12 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.473 -0.785 . . . . 1.53 111.029 -178.803 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -75.75 2.9 10.91 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.536 -0.757 . . . . 1.22 111.529 -174.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.7 mttt -89.91 -25.23 21.06 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.317 0.58 . . . . 3.34 110.015 178.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.5 mt -111.91 -45.86 5.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.574 -0.739 . . . . 1.5 110.292 -178.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 35.1 mm -94.66 121.84 45.6 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-N 116.005 -0.543 . . . . 1.19 110.257 -178.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.496 ' O ' ' HD3' ' A' ' 80' ' ' PRO . 0.0 OUTLIER -88.87 -26.12 21.79 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.956 -0.565 . . . . 2.35 110.553 -177.654 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -113.18 84.72 7.54 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 115.953 -0.567 . . . . 2.05 109.922 177.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.496 ' HD3' ' O ' ' A' ' 78' ' ' LYS . 6.4 Cg_exo -73.32 94.17 0.83 Allowed 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.98 2.453 . . . . 1.24 112.137 -177.188 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' MET . . . . . 0.432 ' HE2' ' O ' ' A' ' 80' ' ' PRO . 0.0 OUTLIER -130.62 155.79 45.97 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.274 0.559 . . . . 1.39 110.739 -178.655 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.48 ' O ' HD12 ' A' ' 86' ' ' ILE . 1.7 p-10 -140.61 -119.78 0.12 Allowed 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.876 -1.057 . . . . 1.42 109.098 -175.793 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 5.2 ttp -130.21 -20.0 3.09 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.912 0.387 . . . . 1.14 110.547 177.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -85.63 -30.25 24.64 Favored Glycine 0 N--CA 1.44 -1.068 0 N-CA-C 110.442 -1.063 . . . . 0.33 110.442 -179.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.77 -47.44 62.93 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.504 -0.348 . . . . 1.6 110.363 175.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.48 HD12 ' O ' ' A' ' 82' ' ' ASP . 58.4 mt -56.3 -46.97 81.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.61 -0.723 . . . . 1.63 110.126 176.652 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.445 ' O ' ' HG2' ' A' ' 91' ' ' GLU . 0.0 OUTLIER -67.74 -34.89 77.73 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 115.772 -0.649 . . . . 1.71 110.614 -178.508 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.426 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 21.3 tptt -67.05 -34.77 78.39 Favored 'General case' 0 C--N 1.339 0.124 0 CA-C-O 120.828 0.347 . . . . 2.93 110.544 -178.567 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 7.4 mtp180 -73.25 -33.5 65.31 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.032 0.444 . . . . 1.49 110.468 177.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 9.3 mt -68.0 -51.34 48.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.901 -0.591 . . . . 1.14 111.239 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.445 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 0.5 OUTLIER -66.13 -26.03 67.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.934 0.397 . . . . 1.39 111.101 -178.089 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 1.7 m-80 -90.95 5.98 46.54 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.261 -0.427 . . . . 1.66 111.012 -179.022 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 49.7 51.67 16.05 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 121.381 0.61 . . . . 1.75 111.351 -178.843 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . 0.402 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 69.5 t80 -74.32 -21.96 59.47 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.429 0.633 . . . . 1.3 110.657 177.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -102.7 170.24 8.13 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.862 0.839 . . . . 1.72 112.017 -174.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . 0.495 ' CE2' ' HG3' ' A' ' 34' ' ' ARG . 2.1 t90 -85.73 -42.11 14.52 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 113.538 -1.664 . . . . 1.15 108.805 168.411 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.442 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 23.2 t -155.79 176.3 12.81 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.754 -1.112 . . . . 1.05 109.944 -171.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.26 -15.37 61.42 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.869 0.366 . . . . 1.31 110.793 -177.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.48 -30.91 69.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.131 0.491 . . . . 1.12 110.508 176.12 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -75.88 -30.83 58.98 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.541 -0.754 . . . . 2.44 109.883 -179.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . 0.431 ' SG ' HG21 ' A' ' 86' ' ' ILE . 0.5 OUTLIER -81.81 -22.11 37.28 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.596 -0.729 . . . . 1.24 110.43 -177.994 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 7.5 mmt -53.33 -35.29 60.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.655 -0.702 . . . . 1.66 110.617 177.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.13 -50.32 48.99 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.552 -0.749 . . . . 3.72 110.072 -178.738 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -64.53 -40.44 95.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.946 -0.57 . . . . 1.87 110.809 -176.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.8 -44.93 95.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.464 . . . . 0.45 110.629 177.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.13 -41.32 99.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.129 -0.487 . . . . 1.23 110.202 177.709 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 54.9 m -63.38 -47.68 81.04 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.722 -0.672 . . . . 1.09 111.71 -178.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.43 ' HG3' ' N ' ' A' ' 109' ' ' PHE . 0.0 OUTLIER -58.85 -35.72 73.39 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.601 0.239 . . . . 1.44 111.206 -177.907 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' PHE . . . . . 0.43 ' N ' ' HG3' ' A' ' 108' ' ' MET . 6.1 m-85 -72.3 -49.22 36.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.022 0.439 . . . . 0.29 110.802 -178.094 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -67.93 -33.36 74.53 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.099 -0.501 . . . . 1.33 110.792 -177.748 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -53.01 -42.79 65.97 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.382 -0.826 . . . . 2.36 111.023 177.582 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -67.61 -40.06 84.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.08 0.466 . . . . 1.09 110.419 179.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -69.38 -19.06 63.83 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.239 -0.437 . . . . 1.17 111.269 -178.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 69.5 mt -92.18 -49.64 12.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.26 -0.427 . . . . 1.18 110.847 179.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -68.55 -38.44 80.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.922 -0.581 . . . . 1.6 110.831 -176.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -99.99 177.9 4.96 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.033 -0.531 . . . . 1.37 110.812 -176.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -104.37 158.33 32.18 Favored Pre-proline 0 C--N 1.322 -0.623 0 N-CA-C 109.252 -0.647 . . . . 3.92 109.252 175.527 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 22.7 Cg_exo -63.11 -7.54 12.03 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.365 2.043 . . . . 1.32 112.681 178.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.56 5.37 47.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.048 -0.523 . . . . 1.71 111.284 177.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -91.54 146.99 23.34 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.088 0.47 . . . . 1.34 111.367 -174.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -57.34 -46.72 83.0 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.075 -0.966 . . . . 1.44 111.282 -176.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ILE . . . . . 0.408 ' O ' HG13 ' A' ' 122' ' ' ILE . 0.9 OUTLIER -65.67 -32.16 56.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.132 -0.485 . . . . 1.16 111.075 -177.473 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -66.1 -44.07 92.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.194 0.521 . . . . 1.1 109.686 176.192 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.81 -32.04 71.41 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.519 -0.764 . . . . 1.22 109.91 178.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 23.3 mtt -73.13 -45.32 57.53 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.471 -0.786 . . . . 1.25 110.57 179.171 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.04 -36.1 67.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.894 0.378 . . . . 1.1 111.236 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.21 -49.17 78.69 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.063 -0.517 . . . . 2.08 111.099 178.618 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -70.57 -37.1 73.91 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.08 0.467 . . . . 1.04 110.516 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 1.8 mp -59.55 -45.49 91.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.352 -0.84 . . . . 1.16 111.247 -179.138 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -65.95 -22.05 66.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.287 -0.415 . . . . 1.47 111.917 -174.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' LYS . . . . . 0.516 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.6 OUTLIER -64.67 -39.81 94.32 Favored 'General case' 0 CA--C 1.518 -0.255 0 N-CA-C 109.789 -0.449 . . . . 2.7 109.789 179.858 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' ILE . . . . . 0.41 HD11 ' CD2' ' A' ' 53' ' ' HIS . 2.7 mt -73.74 -34.0 39.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.701 -0.682 . . . . 1.79 110.023 177.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' PHE . . . . . 0.587 ' O ' HG22 ' A' ' 137' ' ' VAL . 37.0 t80 -57.92 -62.19 1.99 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.627 -0.715 . . . . 0.52 110.556 178.619 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.36 -28.19 69.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.8 0.334 . . . . 1.26 110.755 -177.554 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.516 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.65 -51.24 70.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.793 -0.639 . . . . 2.07 111.337 178.055 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.16 -29.01 57.59 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.912 -0.586 . . . . 2.11 110.786 -178.417 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.587 HG22 ' O ' ' A' ' 133' ' ' PHE . 53.9 t -70.8 -29.38 37.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.118 -0.492 . . . . 1.09 110.753 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -69.25 -17.57 63.77 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.095 0.474 . . . . 1.21 110.549 177.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -106.18 6.47 30.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.118 -0.492 . . . . 1.94 110.949 179.683 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' MET . . . . . 0.482 ' HG3' ' HA ' ' A' ' 137' ' ' VAL . 0.4 OUTLIER -70.15 149.33 96.11 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.082 -0.508 . . . . 1.34 110.322 177.214 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' PRO . . . . . 0.49 ' C ' ' H ' ' A' ' 143' ' ' GLU . 71.8 Cg_endo -75.9 102.96 1.66 Allowed 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 121.959 1.772 . . . . 0.67 111.753 -178.375 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -78.12 25.33 0.22 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.389 0.614 . . . . 3.68 110.39 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.49 ' H ' ' C ' ' A' ' 141' ' ' PRO . 3.4 mm-40 -101.4 -34.17 9.7 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 115.085 -0.961 . . . . 2.7 108.822 176.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 60.15 74.81 0.43 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 114.275 -1.329 . . . . 2.34 110.029 -178.682 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' VAL . . . . . 0.447 ' O ' ' HB ' ' A' ' 36' ' ' THR . 21.9 t -97.14 139.48 19.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.364 -0.834 . . . . 1.66 109.055 -176.221 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . 0.42 ' HA ' ' HA ' ' A' ' 36' ' ' THR . 11.8 tt0 -86.1 153.15 22.3 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 120.593 -0.443 . . . . 1.53 110.253 179.038 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' LEU . . . . . 0.437 ' HG ' ' N ' ' A' ' 37' ' ' ASN . 89.5 mt . . . . . 0 C--O 1.251 1.168 0 CA-C-O 118.474 -0.774 . . . . 1.57 110.86 -176.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.745 0 N-CA-C 111.902 -0.479 . . . . 2.47 111.902 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 153.49 -33.5 0.76 Allowed Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 111.036 -0.826 . . . . 1.97 111.036 -178.133 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.28 107.1 5.65 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.651 -0.5 . . . . 3.98 109.651 176.765 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 1.6 mttm . . . . . 0 C--O 1.246 0.913 0 CA-C-O 118.531 -0.747 . . . . 4.91 110.338 -178.09 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 9.2 p . . . . . 0 N--CA 1.453 -0.315 0 CA-C-O 121.808 0.813 . . . . 0.93 108.853 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -147.8 132.7 18.08 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 114.504 -1.225 . . . . 1.61 109.06 177.218 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.415 ' O ' ' HE3' ' A' ' 31' ' ' LYS . 23.8 t-20 -153.05 125.85 4.05 Favored Pre-proline 0 C--N 1.316 -0.876 0 CA-C-N 116.037 -0.529 . . . . 1.6 109.933 -178.252 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -65.85 -46.44 4.92 Favored 'Trans proline' 0 N--CA 1.474 0.378 0 C-N-CA 123.421 2.747 . . . . 1.87 113.271 -176.187 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.8 m -66.11 -32.53 74.04 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.293 0.568 . . . . 2.18 110.535 -177.427 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.415 ' HE3' ' O ' ' A' ' 28' ' ' ASN . 0.8 OUTLIER -78.52 123.66 85.55 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 115.379 -0.828 . . . . 2.75 109.73 178.215 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -48.16 136.25 24.38 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.811 2.341 . . . . 1.38 112.97 178.258 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.449 ' HA2' ' O ' ' A' ' 95' ' ' TYR . . . -162.64 62.32 0.27 Allowed Glycine 0 N--CA 1.444 -0.809 0 N-CA-C 110.816 -0.914 . . . . 0.97 110.816 179.624 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -80.09 167.9 19.81 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.006 0.431 . . . . 1.93 110.488 -177.468 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.514 ' HB3' HD12 ' A' ' 147' ' ' LEU . 4.8 mmtm -102.95 108.44 19.63 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 116.332 -0.395 . . . . 2.64 110.048 178.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.673 HG22 ' HG3' ' A' ' 146' ' ' GLU . 5.7 p -109.0 171.65 7.31 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 120.774 -0.37 . . . . 0.68 110.826 174.883 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -61.69 -50.51 72.19 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.801 -0.636 . . . . 1.47 110.937 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.584 ' HG2' ' SD ' ' A' ' 140' ' ' MET . 1.3 mt-30 -56.68 -44.37 81.38 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.714 0.292 . . . . 1.04 110.983 179.115 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.445 ' HB2' ' HA ' ' A' ' 97' ' ' SER . 0.8 OUTLIER -59.42 -56.0 27.52 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.088 -0.505 . . . . 0.8 111.13 -178.53 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -65.54 -33.48 76.02 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.013 -0.539 . . . . 1.75 110.48 -179.034 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.658 ' CE1' ' HG2' ' A' ' 140' ' ' MET . 61.2 t80 -58.17 -63.89 1.1 Allowed 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.758 -0.656 . . . . 0.64 110.858 178.841 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.473 ' O ' HG12 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -62.65 -29.61 70.75 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.721 -0.392 . . . . 1.13 110.932 -171.961 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.484 ' HA ' HD13 ' A' ' 90' ' ' LEU . 4.5 tt0 -62.16 -55.83 24.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.778 -0.646 . . . . 1.3 110.874 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -87.2 -29.63 21.6 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.928 0.394 . . . . 0.5 111.91 -177.148 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.419 HG11 ' CZ ' ' A' ' 41' ' ' TYR . 93.7 t -88.39 -57.66 4.07 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 N-CA-C 112.443 0.534 . . . . 0.3 112.443 -174.699 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.483 HG22 ' HB3' ' A' ' 136' ' ' LYS . 81.7 t -79.24 -66.27 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 C-N-CA 120.782 -0.367 . . . . 0.26 111.953 -170.212 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.473 HG12 ' O ' ' A' ' 42' ' ' MET . 2.2 p -67.72 -35.43 72.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 C-N-CA 120.518 -0.473 . . . . 0.83 111.498 -174.375 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.8 mttt -67.31 -31.31 71.52 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 122.013 -0.43 . . . . 2.4 111.619 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 48.1 m -81.34 -36.88 29.16 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.84 -0.344 . . . . 0.55 110.634 176.319 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.633 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -55.45 -40.46 71.6 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 108.703 -0.851 . . . . 0.33 108.703 171.326 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 10.5 t-105 -60.14 -37.69 80.84 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.441 -1.254 . . . . 0.39 111.912 178.064 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -77.23 -5.15 48.21 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.212 0.449 . . . . 2.24 112.212 -172.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -72.62 130.41 40.51 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.672 -0.492 . . . . 0.39 109.672 176.329 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -75.55 -4.76 41.73 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.284 -0.416 . . . . 1.91 111.214 -174.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -100.06 -3.71 31.4 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.203 0.525 . . . . 0.93 109.866 175.01 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.792 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -93.81 10.06 34.67 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.856 -0.611 . . . . 0.28 110.913 -178.815 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.551 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 48.9 p-90 -65.46 -33.01 6.89 Favored Pre-proline 0 CA--C 1.548 0.889 0 N-CA-C 113.57 0.952 . . . . 0.58 113.57 -175.471 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.551 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 12.7 Cg_exo -71.54 -6.93 20.2 Favored 'Trans proline' 0 C--N 1.365 1.44 0 CA-C-N 121.088 1.424 . . . . 0.47 112.104 177.669 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -105.97 14.2 28.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.125 0.488 . . . . 1.11 110.137 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 10.4 m-30 -82.0 -11.21 58.95 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.839 -0.618 . . . . 0.63 110.714 179.154 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -122.19 125.09 26.7 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 116.281 -0.418 . . . . 1.63 111.06 -175.231 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.609 ' HA ' ' OD1' ' A' ' 82' ' ' ASP . 50.3 Cg_endo -71.07 150.93 61.06 Favored 'Trans proline' 0 C--O 1.236 0.422 0 C-N-CA 122.795 2.33 . . . . 0.87 112.49 -179.116 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 38.3 t -73.34 92.24 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 122.061 0.934 . . . . 0.88 110.395 176.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -87.11 -10.18 53.5 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.683 -1.144 . . . . 1.85 109.229 175.5 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 76.18 -45.26 0.51 Allowed 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 114.573 -1.194 . . . . 1.29 111.745 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 41.5 mm -80.04 -53.01 13.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 120.751 0.31 . . . . 1.89 110.639 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -53.28 -52.86 57.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.742 -0.663 . . . . 2.99 112.328 -177.627 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.524 HD23 HD11 ' A' ' 70' ' ' LEU . 2.2 tp -90.66 0.24 57.46 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.26 -0.427 . . . . 1.66 111.108 -177.332 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 57.23 56.6 5.05 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.688 -0.687 . . . . 1.74 112.083 178.606 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.524 HD11 HD23 ' A' ' 68' ' ' LEU . 7.5 mt -121.21 79.05 34.87 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 115.664 -0.698 . . . . 1.61 110.357 178.075 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -78.63 -37.52 0.65 Allowed 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.575 2.183 . . . . 1.3 113.131 -175.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.3 p-10 -86.62 -3.96 59.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.284 0.564 . . . . 1.97 110.604 -178.539 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -58.83 -39.34 80.94 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.328 -0.851 . . . . 1.13 110.496 175.765 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' HIS . . . . . 0.413 ' ND1' ' HG2' ' A' ' 80' ' ' PRO . 3.2 m-70 -76.94 0.77 19.82 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.228 -0.896 . . . . 0.91 111.417 -176.584 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.9 mttt -109.81 -41.38 4.53 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.448 -0.342 . . . . 2.86 111.099 -178.525 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.2 mt -86.43 -49.85 14.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 120.901 0.381 . . . . 1.0 111.082 -178.556 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.482 HD11 ' HB2' ' A' ' 115' ' ' TYR . 20.0 mm -80.57 131.8 33.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.329 -0.396 . . . . 0.75 110.324 -177.879 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.4 -56.68 8.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.029 -0.532 . . . . 1.99 111.214 -175.152 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.776 ' HB2' HG21 ' A' ' 107' ' ' THR . 0.3 OUTLIER -122.27 89.75 49.05 Favored Pre-proline 0 C--N 1.324 -0.538 0 N-CA-C 110.067 -0.345 . . . . 2.05 110.067 178.432 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.413 ' HG2' ' ND1' ' A' ' 74' ' ' HIS . 32.4 Cg_exo -60.99 91.97 0.1 OUTLIER 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 123.038 2.492 . . . . 0.89 112.345 177.617 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 1.7 mmt -134.05 167.29 20.9 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.736 -0.665 . . . . 0.82 109.763 -179.525 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.609 ' OD1' ' HA ' ' A' ' 62' ' ' PRO . 5.6 p-10 -143.05 -116.71 0.1 Allowed 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.289 -0.869 . . . . 1.42 109.696 -173.386 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -128.33 -22.95 3.31 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.954 0.407 . . . . 0.8 110.337 177.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -82.75 -23.12 56.77 Favored Glycine 0 N--CA 1.441 -1.026 0 N-CA-C 110.738 -0.945 . . . . 0.32 110.738 -178.458 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.85 -41.66 22.82 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.304 -0.448 . . . . 0.95 110.552 177.305 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.425 HD12 ' O ' ' A' ' 82' ' ' ASP . 47.0 mt -58.42 -51.0 76.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.827 -0.624 . . . . 0.97 110.153 175.807 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.53 -24.68 66.42 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.903 -0.59 . . . . 1.15 111.185 -178.69 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.35 -45.42 76.41 Favored 'General case' 0 C--O 1.23 0.045 0 CA-C-O 120.772 0.32 . . . . 2.46 110.752 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.588 ' HD2' ' CD2' ' A' ' 94' ' ' TYR . 6.3 mtm180 -69.31 -30.54 68.62 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.345 -0.388 . . . . 1.16 110.757 177.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.484 HD13 ' HA ' ' A' ' 43' ' ' GLN . 12.6 mt -70.54 -49.62 46.24 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.441 -0.345 . . . . 0.49 111.284 179.798 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -70.04 -21.53 63.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.812 0.339 . . . . 1.39 111.174 -177.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -96.53 5.66 50.33 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.181 -0.463 . . . . 1.3 110.618 179.206 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 53.36 54.25 10.46 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.84 -0.618 . . . . 1.75 111.478 178.295 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' TYR . . . . . 0.588 ' CD2' ' HD2' ' A' ' 89' ' ' ARG . 8.5 t80 -70.67 -44.19 67.56 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.292 -0.413 . . . . 0.96 111.786 -178.448 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.458 ' CD1' ' HB3' ' A' ' 100' ' ' GLU . 0.3 OUTLIER -91.7 -172.35 3.19 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.67 0.748 . . . . 1.28 111.39 -179.272 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -94.59 -42.81 8.61 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 114.132 -1.395 . . . . 1.05 108.898 175.322 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.445 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 9.4 t -145.95 170.66 16.16 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.014 -0.994 . . . . 1.0 109.619 -176.776 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -69.16 -12.12 61.4 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.978 0.362 . . . . 0.66 111.978 -174.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.27 -26.76 68.93 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.845 0.355 . . . . 0.85 111.094 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.458 ' HB3' ' CD1' ' A' ' 95' ' ' TYR . 4.4 tp10 -82.13 -22.92 35.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.014 0.435 . . . . 2.44 110.37 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.407 ' SG ' HG23 ' A' ' 86' ' ' ILE . 1.6 t -76.65 -21.76 55.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.75 -0.659 . . . . 0.95 110.112 178.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -21.18 59.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.798 -0.637 . . . . 1.13 110.778 178.402 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -73.64 -57.18 4.17 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 116.022 -0.536 . . . . 2.96 110.602 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.99 -36.98 80.94 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.042 -0.526 . . . . 1.87 111.005 -176.007 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.633 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -61.19 -39.59 90.74 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.062 0.458 . . . . 0.38 110.847 177.021 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -67.46 -39.37 85.31 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.921 -0.581 . . . . 0.97 110.709 -178.882 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' THR . . . . . 0.776 HG21 ' HB2' ' A' ' 79' ' ' ASN . 47.5 m -70.69 -39.74 73.3 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.236 -0.438 . . . . 0.43 111.675 -177.444 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.511 ' HG3' ' N ' ' A' ' 109' ' ' PHE . 0.0 OUTLIER -54.05 -37.86 64.59 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.745 0.307 . . . . 0.88 111.278 -178.913 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 109' ' ' PHE . . . . . 0.511 ' N ' ' HG3' ' A' ' 108' ' ' MET . 7.3 m-85 -76.95 -43.73 34.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.362 -0.381 . . . . 0.29 110.98 -178.218 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -67.19 -39.96 86.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.042 0.449 . . . . 0.66 110.716 -177.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -49.85 -46.53 51.45 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.246 -0.888 . . . . 1.84 111.139 177.953 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.76 -39.98 91.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.325 -0.398 . . . . 0.63 110.773 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -67.14 -29.85 69.69 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.339 -0.391 . . . . 0.81 111.25 -177.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 37.0 mt -84.64 -54.95 7.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.174 -0.466 . . . . 0.55 111.739 -176.415 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' TYR . . . . . 0.482 ' HB2' HD11 ' A' ' 77' ' ' ILE . 45.0 t80 -67.4 -40.04 85.58 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.763 0.316 . . . . 1.22 110.849 -176.099 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -97.56 152.74 18.72 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.132 -0.486 . . . . 1.04 110.592 -176.554 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.52 151.71 85.22 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 116.228 -0.442 . . . . 3.47 110.264 179.282 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' PRO . . . . . 0.568 ' HA ' HG11 ' A' ' 123' ' ' VAL . 29.7 Cg_endo -64.49 -7.15 13.52 Favored 'Trans proline' 0 CA--C 1.533 0.435 0 C-N-CA 122.978 2.452 . . . . 0.96 113.068 -177.719 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -102.46 5.51 39.58 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.793 0.33 . . . . 1.23 111.281 178.822 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -82.93 155.4 24.06 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.098 0.475 . . . . 1.34 110.851 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.82 -40.54 88.05 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.458 -0.792 . . . . 1.44 110.423 -177.342 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.3 tp -62.04 -36.95 77.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.99 -0.55 . . . . 0.42 110.67 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.568 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.3 t -67.72 -46.38 82.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 109.877 -0.416 . . . . 0.35 109.877 177.607 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.37 -38.38 74.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.541 -0.754 . . . . 0.52 110.031 178.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' MET . . . . . 0.488 ' O ' HD13 ' A' ' 129' ' ' LEU . 25.9 mtt -69.78 -48.81 57.81 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.309 -0.86 . . . . 0.62 110.785 178.775 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.27 -40.46 67.85 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.274 -0.421 . . . . 0.31 111.372 -179.303 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -58.23 -42.54 86.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.021 -0.536 . . . . 1.94 111.039 179.395 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -77.58 -38.26 48.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.985 0.422 . . . . 0.32 110.66 -179.548 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.792 HD21 ' HA ' ' A' ' 56' ' ' ALA . 4.6 mp -56.48 -38.1 71.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.52 -0.764 . . . . 0.33 110.676 177.759 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -62.23 -23.78 66.86 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.423 -0.808 . . . . 1.47 111.953 -178.165 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.42 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 1.3 mptt -68.18 -47.57 67.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.69 0.281 . . . . 2.24 110.46 -176.102 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.5 HD12 ' HA ' ' A' ' 50' ' ' LEU . 0.1 OUTLIER -71.98 -23.2 21.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.308 -0.405 . . . . 1.23 110.467 179.601 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.423 ' O ' HG23 ' A' ' 137' ' ' VAL . 24.7 t80 -61.56 -62.02 2.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.091 -0.504 . . . . 0.46 110.213 175.136 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 2.2 pp -65.98 -28.41 68.88 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.928 0.394 . . . . 0.64 110.818 -178.413 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.445 ' HB2' ' HA ' ' A' ' 132' ' ' ILE . 0.1 OUTLIER -54.62 -50.93 66.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.571 -0.741 . . . . 1.61 111.383 178.997 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 136' ' ' LYS . . . . . 0.483 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.2 OUTLIER -82.28 -24.42 34.71 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.47 -0.786 . . . . 1.52 110.981 -176.236 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.478 ' O ' ' HB2' ' A' ' 140' ' ' MET . 41.1 t -74.01 -36.4 44.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.809 -0.632 . . . . 0.35 110.852 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.19 -19.29 65.54 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.081 0.467 . . . . 0.5 110.238 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -100.42 6.04 44.36 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.55 -0.75 . . . . 1.76 110.447 -178.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' MET . . . . . 0.658 ' HG2' ' CE1' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -61.18 150.38 79.43 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 115.865 -0.607 . . . . 0.86 110.898 177.218 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -61.23 103.22 0.24 Allowed 'Trans proline' 0 N--CA 1.461 -0.426 0 C-N-CA 122.161 1.907 . . . . 0.67 110.88 173.001 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -73.4 3.2 6.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.899 -0.591 . . . . 2.91 112.122 -173.308 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 143' ' ' GLU . . . . . 0.408 ' O ' ' HB3' ' A' ' 144' ' ' GLU . 0.9 OUTLIER -112.44 -36.72 5.18 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 116.049 -0.523 . . . . 2.7 110.949 -176.148 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.57 ' OE2' ' HB2' ' A' ' 38' ' ' GLN . 5.9 tp10 74.28 135.37 0.05 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 114.991 -1.004 . . . . 2.34 110.845 -178.931 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 39.5 t -139.39 108.6 3.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.23 -0.896 . . . . 0.99 109.268 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.673 ' HG3' HG22 ' A' ' 36' ' ' THR . 3.4 tt0 -67.27 130.92 44.64 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.464 -0.569 . . . . 1.53 109.464 177.206 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.514 HD12 ' HB3' ' A' ' 35' ' ' LYS . 11.1 mt . . . . . 0 C--O 1.252 1.216 0 CA-C-O 118.493 -0.765 . . . . 1.57 110.27 -175.145 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 7.9 p . . . . . 0 C--O 1.236 0.343 0 CA-C-O 121.784 0.802 . . . . 0.93 108.994 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -151.47 145.31 25.12 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 114.713 -1.131 . . . . 1.61 108.997 178.574 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.439 ' HB3' ' CB ' ' A' ' 31' ' ' LYS . 11.9 t-20 -156.15 125.52 3.13 Favored Pre-proline 0 C--N 1.314 -0.935 0 CA-C-N 116.568 -0.287 . . . . 1.6 110.41 176.759 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -73.94 -39.96 1.55 Allowed 'Trans proline' 0 N--CA 1.473 0.308 0 C-N-CA 123.23 2.62 . . . . 1.87 113.231 -178.227 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.5 m -80.25 -21.03 43.23 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.208 0.528 . . . . 2.18 110.529 -175.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.439 ' CB ' ' HB3' ' A' ' 28' ' ' ASN . 9.2 tttp -74.46 135.45 75.56 Favored Pre-proline 0 C--N 1.319 -0.734 0 CA-C-N 114.917 -1.038 . . . . 2.75 111.027 179.34 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -57.97 137.21 79.74 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.142 1.895 . . . . 1.38 111.49 169.419 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -173.17 90.93 0.09 OUTLIER Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 111.221 -0.752 . . . . 0.97 111.221 -176.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -110.35 177.9 4.55 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.923 0.392 . . . . 1.93 110.434 -177.883 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.439 ' HA ' HD22 ' A' ' 39' ' ' LEU . 7.4 mtpp -108.1 104.38 13.79 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.219 -0.446 . . . . 2.64 110.276 179.117 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.6 p -99.11 168.52 10.02 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.821 0.343 . . . . 0.68 110.466 177.107 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.496 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 3.6 t-20 -62.08 -40.0 94.32 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 115.932 -0.576 . . . . 1.47 110.35 178.868 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -67.71 -40.6 84.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.764 0.316 . . . . 1.04 110.883 -178.796 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.551 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.5 OUTLIER -62.34 -49.83 74.01 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.117 0.484 . . . . 0.8 110.541 179.461 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 21.7 mm100 -70.38 -28.84 65.41 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.739 -0.664 . . . . 1.75 110.587 179.494 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.496 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 52.7 t80 -59.83 -63.9 1.14 Allowed 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.754 -0.657 . . . . 0.64 110.762 176.807 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.544 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -59.33 -31.9 69.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.579 0.228 . . . . 1.13 110.462 -174.901 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.468 ' O ' HG13 ' A' ' 47' ' ' VAL . 9.9 tt0 -56.12 -58.7 6.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.604 -0.726 . . . . 1.3 111.087 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -87.11 -27.19 23.25 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.105 -0.498 . . . . 0.5 112.323 -177.376 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 97.0 t -89.12 -57.59 4.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 112.347 0.499 . . . . 0.3 112.347 -175.423 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.544 HG23 ' HA ' ' A' ' 42' ' ' MET . 60.7 t -80.12 -65.93 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 C-N-CA 120.931 -0.308 . . . . 0.26 111.637 -170.597 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.468 HG13 ' O ' ' A' ' 43' ' ' GLN . 0.2 OUTLIER -66.1 -37.09 79.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.284 0 C-N-CA 120.7 -0.4 . . . . 0.83 111.266 -174.535 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -36.34 82.94 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.751 0.278 . . . . 2.4 111.751 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.442 HG21 ' HE2' ' A' ' 136' ' ' LYS . 9.9 m -79.05 -33.44 44.69 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.835 -0.346 . . . . 0.55 110.87 178.756 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.655 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -64.59 -36.17 83.36 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 121.486 0.66 . . . . 0.33 109.371 174.046 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 12.4 t-105 -61.96 -28.12 69.33 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.127 -0.942 . . . . 0.39 111.272 177.29 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 37.5 mtpt -92.41 28.81 1.85 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.104 0.478 . . . . 2.24 111.439 -176.139 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.517 ' HD2' HD11 ' A' ' 132' ' ' ILE . 14.5 t-80 -103.11 133.87 47.49 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.212 -0.449 . . . . 0.39 110.054 176.1 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -70.69 -11.4 60.92 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.306 -0.406 . . . . 1.91 111.789 -176.085 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.492 ' CG ' ' HG2' ' A' ' 125' ' ' MET . 0.2 OUTLIER -101.97 -4.46 26.08 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.912 0.387 . . . . 0.93 110.407 178.799 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.57 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -94.58 16.39 15.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.201 0.524 . . . . 0.28 110.802 -179.257 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.591 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 42.1 p-90 -70.44 -30.89 1.99 Allowed Pre-proline 0 CA--C 1.545 0.766 0 N-CA-C 113.706 1.002 . . . . 0.58 113.706 -174.801 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.591 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 6.4 Cg_exo -76.17 -4.92 15.71 Favored 'Trans proline' 0 C--N 1.359 1.108 0 C-N-CA 121.273 1.315 . . . . 0.47 111.252 172.578 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -109.15 45.81 1.03 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.246 -0.888 . . . . 1.11 109.893 -176.633 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.47 ' CE2' ' HA ' ' A' ' 57' ' ' TRP . 11.2 m-30 -120.99 -12.48 8.74 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.502 -0.772 . . . . 0.63 110.987 -176.799 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.424 ' HA ' ' HD2' ' A' ' 62' ' ' PRO . 1.1 mt-30 -123.28 113.37 29.48 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 116.252 -0.431 . . . . 1.63 110.816 -169.805 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.424 ' HD2' ' HA ' ' A' ' 61' ' ' GLN . 12.0 Cg_endo -56.45 129.81 36.72 Favored 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.418 2.079 . . . . 0.87 111.608 -178.698 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 20.5 t -65.02 103.39 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.708 0.766 . . . . 0.88 111.188 -176.822 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -110.21 30.54 6.66 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.029 -0.987 . . . . 1.85 109.283 174.16 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 55.68 -88.29 0.02 OUTLIER 'General case' 0 C--O 1.226 -0.18 0 CA-C-N 114.687 -1.142 . . . . 1.29 111.716 -178.584 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 40.7 mm -62.78 -34.47 65.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.475 -0.33 . . . . 1.89 111.397 -173.265 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -57.81 -29.83 65.23 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.952 -0.567 . . . . 2.99 112.025 -177.138 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.7 tp -128.06 14.91 6.81 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.864 0.364 . . . . 1.66 110.825 -177.279 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 61.26 56.08 2.78 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.474 -0.785 . . . . 1.74 111.351 179.161 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -120.15 71.4 16.68 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 115.959 -0.564 . . . . 1.61 110.564 174.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -84.43 -39.87 0.1 Allowed 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.638 2.225 . . . . 1.3 112.218 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -81.25 -14.69 57.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.337 0.589 . . . . 1.97 109.962 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.423 ' HE2' ' HA ' ' A' ' 80' ' ' PRO . 44.7 t80 -58.74 -40.51 84.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.139 -0.937 . . . . 1.13 110.593 177.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -77.72 1.9 18.53 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.49 -0.777 . . . . 0.91 111.557 -175.881 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -91.13 -47.42 7.54 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.397 0.618 . . . . 2.86 109.415 178.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.5 mp -88.92 -43.87 15.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.14 -0.936 . . . . 1.0 110.608 -177.88 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 35.2 mm -87.46 126.78 41.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.027 -0.533 . . . . 0.75 110.449 -178.562 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.9 mtmt -89.97 -23.34 21.57 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.725 -0.67 . . . . 1.99 110.948 -177.582 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -123.24 90.47 50.42 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 116.14 -0.482 . . . . 2.05 109.975 179.09 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.423 ' HA ' ' HE2' ' A' ' 73' ' ' TYR . 36.0 Cg_endo -67.19 93.44 0.34 Allowed 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.614 2.21 . . . . 0.89 112.5 -177.475 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 22.4 mmt -125.96 169.59 12.54 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.392 0.615 . . . . 0.82 111.036 -177.52 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.517 ' CG ' ' H ' ' A' ' 83' ' ' MET . 23.0 t70 -151.06 -142.15 0.12 Allowed 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.18 -1.373 . . . . 1.42 107.349 -177.16 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' MET . . . . . 0.517 ' H ' ' CG ' ' A' ' 82' ' ' ASP . 0.1 OUTLIER -115.64 -15.17 11.42 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 108.3 -1.0 . . . . 0.8 108.3 176.177 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -80.04 -24.49 59.58 Favored Glycine 0 N--CA 1.441 -0.967 0 N-CA-C 109.653 -1.379 . . . . 0.32 109.653 178.472 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.99 -34.82 43.8 Favored 'General case' 0 N--CA 1.44 -0.953 0 CA-C-N 114.81 -0.695 . . . . 0.95 110.421 176.306 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 36.4 mm -58.3 -56.76 14.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.325 -0.852 . . . . 0.97 109.996 175.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.25 -34.49 66.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.247 -0.888 . . . . 1.15 110.891 177.797 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.608 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 0.1 OUTLIER -63.19 -52.98 60.16 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-O 120.599 0.238 . . . . 2.46 111.121 -176.868 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 8.0 mmm-85 -64.4 -32.98 74.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.516 -0.311 . . . . 1.16 111.135 -178.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 10.1 mt -69.81 -52.27 26.53 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.275 -0.42 . . . . 0.49 111.162 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -71.78 -26.23 62.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.911 0.386 . . . . 1.39 110.711 -177.542 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.608 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 1.2 t30 -76.14 -15.6 60.04 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.375 -0.375 . . . . 1.3 110.509 176.905 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 59.31 54.79 4.56 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 115.544 -0.753 . . . . 1.75 109.712 -176.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 25.1 t80 -74.72 -46.58 36.65 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.194 -0.912 . . . . 0.96 111.486 -176.138 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -107.17 -176.89 3.2 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.212 0.53 . . . . 1.28 111.208 -179.65 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -77.66 -43.34 31.63 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.228 -0.896 . . . . 1.05 111.307 -176.458 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -147.05 170.12 17.8 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-O 121.154 0.502 . . . . 1.0 111.825 -168.958 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.551 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -74.54 -10.55 59.66 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.788 -0.642 . . . . 0.66 111.527 -178.193 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 48.9 m -64.75 -24.09 67.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.273 0.559 . . . . 0.85 110.045 177.139 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -80.77 -38.56 28.35 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.785 -0.643 . . . . 2.44 110.195 175.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.424 ' HB3' ' HE3' ' A' ' 42' ' ' MET . 0.5 OUTLIER -69.11 -23.4 63.99 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.623 -0.717 . . . . 0.95 111.029 -178.05 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.4 ttm -61.29 -29.9 70.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.195 -0.457 . . . . 1.13 110.282 177.132 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -73.96 -34.69 64.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.868 -0.605 . . . . 2.96 109.935 178.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -71.78 -47.05 56.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.806 -0.634 . . . . 1.87 110.317 -179.509 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.655 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -55.3 -46.73 76.22 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.808 -0.633 . . . . 0.38 110.634 177.573 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -59.21 -44.95 92.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.747 -0.661 . . . . 0.97 110.611 178.321 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 80.9 m -62.2 -46.76 87.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.941 -0.572 . . . . 0.43 111.112 179.279 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.63 -41.09 69.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.19 -0.459 . . . . 0.88 111.108 178.573 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -73.06 -45.42 57.52 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.357 -0.383 . . . . 0.29 111.219 -177.579 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.1 p -67.45 -33.25 74.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.351 -0.386 . . . . 0.66 111.067 -177.395 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 -49.31 -47.41 47.09 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.643 -0.708 . . . . 1.84 111.192 178.122 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -65.69 -38.1 88.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.803 -0.635 . . . . 0.63 110.792 -178.782 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -72.6 -25.83 61.47 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.112 -0.494 . . . . 0.81 111.202 -177.109 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 62.0 mt -88.32 -50.82 13.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.059 0.457 . . . . 0.55 111.18 -179.156 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' TYR . . . . . 0.404 ' CE1' ' HA ' ' A' ' 73' ' ' TYR . 63.8 t80 -70.9 -34.87 71.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.136 -0.484 . . . . 1.22 111.495 -175.537 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -110.85 157.81 19.42 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.891 0.377 . . . . 1.04 111.542 -172.695 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' LYS . . . . . 0.541 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 0.2 OUTLIER -74.3 149.8 87.02 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 115.771 -0.65 . . . . 3.47 110.767 -177.468 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 118' ' ' PRO . . . . . 0.439 ' HA ' HG11 ' A' ' 123' ' ' VAL . 24.6 Cg_endo -62.24 -16.64 52.33 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.933 2.422 . . . . 0.96 112.976 -178.612 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.52 6.42 48.14 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.994 0.426 . . . . 1.23 111.25 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' ASP . . . . . 0.541 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 0.5 OUTLIER -78.56 157.39 28.8 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 116.162 -0.472 . . . . 1.34 110.618 -178.414 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -67.5 -42.16 83.33 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.598 -0.728 . . . . 1.44 110.345 -177.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 5.5 tp -60.29 -35.84 64.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.972 -0.558 . . . . 0.42 111.009 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.439 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.4 t -68.97 -45.76 79.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.963 -0.384 . . . . 0.35 109.963 178.302 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.82 -29.69 67.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.906 -0.588 . . . . 0.52 110.13 177.617 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' MET . . . . . 0.495 ' O ' HD13 ' A' ' 129' ' ' LEU . 32.8 mtt -76.42 -42.21 44.97 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.376 -0.829 . . . . 0.62 110.654 178.485 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.38 -45.17 72.77 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.073 -0.512 . . . . 0.31 112.095 -177.576 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' GLN . . . . . 0.431 ' HG3' ' H ' ' A' ' 127' ' ' GLN . 0.0 OUTLIER -59.44 -44.18 92.97 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.913 0.387 . . . . 1.94 110.86 179.888 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -68.38 -37.69 80.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 0.32 110.627 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.57 HD21 ' HA ' ' A' ' 56' ' ' ALA . 5.0 mp -64.83 -40.93 95.99 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.394 -0.821 . . . . 0.33 110.734 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -59.27 -24.75 63.51 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.662 -0.699 . . . . 1.47 111.849 -176.452 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.553 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -62.66 -44.0 97.37 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 110.158 -0.312 . . . . 2.24 110.158 -177.895 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.517 HD11 ' HD2' ' A' ' 53' ' ' HIS . 22.1 mt -66.96 -35.61 75.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.128 -0.487 . . . . 1.23 110.343 -179.804 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.468 ' O ' HG23 ' A' ' 137' ' ' VAL . 36.1 t80 -59.89 -62.71 1.67 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.819 -0.628 . . . . 0.46 110.77 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 2.0 pp -64.74 -28.38 69.55 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.954 0.407 . . . . 0.64 110.782 -177.346 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.553 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.3 OUTLIER -60.82 -51.72 68.14 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.673 -0.694 . . . . 1.61 111.024 178.992 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 136' ' ' LYS . . . . . 0.535 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -81.36 -26.51 35.47 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.852 -0.613 . . . . 1.52 110.885 -175.718 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 133' ' ' PHE . 52.4 t -68.86 -29.7 44.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.128 0.489 . . . . 0.35 110.262 176.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.51 -14.77 63.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.162 -0.472 . . . . 0.5 110.531 177.35 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -106.88 -0.57 23.17 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.895 -0.593 . . . . 1.76 110.325 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' MET . . . . . 0.493 ' HG2' ' CE1' ' A' ' 41' ' ' TYR . 0.3 OUTLIER -70.07 147.29 95.63 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 115.874 -0.603 . . . . 0.86 110.752 -178.287 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 141' ' ' PRO . . . . . 0.434 ' C ' ' H ' ' A' ' 143' ' ' GLU . 50.6 Cg_endo -86.18 79.95 1.85 Allowed 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 122.308 2.005 . . . . 0.67 111.324 178.118 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -76.08 21.39 0.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.273 0.558 . . . . 2.91 111.234 -177.63 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 143' ' ' GLU . . . . . 0.434 ' H ' ' C ' ' A' ' 141' ' ' PRO . 2.4 mt-10 -90.62 -32.92 16.06 Favored 'General case' 0 N--CA 1.439 -0.982 0 N-CA-C 108.218 -1.031 . . . . 2.7 108.218 170.41 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 75.18 113.03 0.07 Allowed 'General case' 0 C--O 1.228 -0.064 0 CA-C-N 113.569 -1.651 . . . . 2.34 111.227 176.21 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 15.3 t -125.83 116.73 47.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.825 -0.625 . . . . 0.99 109.613 176.666 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -73.62 147.11 44.11 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.724 0.297 . . . . 1.53 110.499 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 64.6 mt . . . . . 0 C--O 1.247 0.931 0 CA-C-O 118.834 -0.603 . . . . 1.57 109.991 179.521 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.4 p . . . . . 0 N--CA 1.454 -0.27 0 CA-C-O 121.216 0.531 . . . . 0.93 110.387 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -178.44 154.01 0.77 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.341 -0.845 . . . . 1.61 109.661 177.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.544 ' HB3' ' HB2' ' A' ' 31' ' ' LYS . 42.8 t-20 -160.53 124.38 2.0 Allowed Pre-proline 0 C--N 1.318 -0.779 0 CA-C-N 115.846 -0.616 . . . . 1.6 109.52 -179.397 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -65.06 -33.87 48.96 Favored 'Trans proline' 0 N--CA 1.48 0.729 0 C-N-CA 123.407 2.738 . . . . 1.87 112.994 -177.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.4 t -74.3 -20.7 60.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.577 0.703 . . . . 2.18 109.678 -179.485 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.544 ' HB2' ' HB3' ' A' ' 28' ' ' ASN . 2.1 tttp -87.11 134.75 36.03 Favored Pre-proline 0 C--N 1.319 -0.736 0 CA-C-N 115.0 -1.0 . . . . 2.75 109.755 178.464 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.509 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 35.9 Cg_endo -65.66 137.72 51.14 Favored 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.256 1.971 . . . . 1.38 112.317 177.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -153.88 109.27 0.4 Allowed Glycine 0 N--CA 1.442 -0.939 0 N-CA-C 110.788 -0.925 . . . . 0.97 110.788 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -123.81 155.77 37.36 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.789 0.328 . . . . 1.93 110.57 -176.312 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.489 ' HA ' HD22 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -92.62 84.36 5.04 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.191 0.52 . . . . 2.64 110.292 176.486 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.634 HG22 ' HG3' ' A' ' 146' ' ' GLU . 1.2 p -92.02 165.55 13.13 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.228 -0.442 . . . . 0.68 110.826 -179.225 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.446 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 64.0 t30 -63.99 -40.88 97.38 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.282 -0.417 . . . . 1.47 110.591 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -64.51 -38.97 92.86 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 110.203 -0.295 . . . . 1.04 110.203 177.86 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.783 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.7 OUTLIER -63.52 -55.68 22.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.916 -0.584 . . . . 0.8 110.501 178.838 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.48 ' HA ' ' OE1' ' A' ' 43' ' ' GLN . 1.2 mm100 -63.81 -31.53 72.73 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.966 -0.561 . . . . 1.75 110.891 -179.166 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.446 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 63.8 t80 -53.57 -62.68 1.5 Allowed 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.52 -0.764 . . . . 0.64 110.922 176.692 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.529 ' HA ' HG23 ' A' ' 46' ' ' VAL . 3.5 ttm -59.07 -29.98 67.73 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.428 -0.351 . . . . 1.13 111.645 -173.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.577 ' HG2' HD22 ' A' ' 90' ' ' LEU . 24.9 mt-30 -60.12 -58.56 7.98 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.097 0.475 . . . . 1.3 110.502 178.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -84.27 -29.7 26.23 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.702 -0.681 . . . . 0.5 111.534 -174.326 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 97.9 t -87.9 -56.63 5.02 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 N-CA-C 112.336 0.495 . . . . 0.3 112.336 -175.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.529 HG23 ' HA ' ' A' ' 42' ' ' MET . 53.6 t -83.03 -67.26 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 112.076 0.399 . . . . 0.26 112.076 -171.404 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.452 HG12 ' O ' ' A' ' 42' ' ' MET . 2.5 p -72.76 -34.13 46.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 C-N-CA 120.822 -0.351 . . . . 0.83 111.7 -171.689 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 43' ' ' GLN . 0.0 OUTLIER -61.48 -35.4 77.55 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.778 0.323 . . . . 2.4 110.779 179.196 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.419 HG21 ' HE3' ' A' ' 136' ' ' LYS . 27.3 m -80.75 -37.77 29.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.454 -0.339 . . . . 0.55 110.878 178.203 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.691 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -61.47 -40.78 95.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.903 0.383 . . . . 0.33 110.03 177.417 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 23.2 t-105 -64.73 -31.63 72.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.932 -0.576 . . . . 0.39 111.385 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.6 mttt -79.74 -9.83 59.7 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 111.815 0.302 . . . . 2.24 111.815 -175.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 10.5 t-80 -69.1 129.67 40.56 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.588 -0.523 . . . . 0.39 109.588 176.234 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -81.34 9.4 7.23 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.938 0.399 . . . . 1.91 111.658 -173.133 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -110.45 -3.52 16.02 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.303 0.573 . . . . 0.93 109.626 173.275 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.744 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -92.79 9.11 36.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.607 -0.724 . . . . 0.28 110.642 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.471 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 55.9 p-90 -64.31 -31.43 5.93 Favored Pre-proline 0 CA--C 1.546 0.803 0 N-CA-C 113.954 1.094 . . . . 0.58 113.954 -175.313 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.471 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 10.8 Cg_exo -73.11 -4.4 15.35 Favored 'Trans proline' 0 C--N 1.363 1.324 0 CA-C-N 121.151 1.447 . . . . 0.47 111.946 176.447 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -110.19 19.38 18.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.173 0.511 . . . . 1.11 110.008 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -85.84 -8.86 57.81 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.722 -0.672 . . . . 0.63 110.434 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.09 131.42 19.78 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.282 -0.417 . . . . 1.63 110.877 -172.474 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -67.58 154.74 72.68 Favored 'Trans proline' 0 C--O 1.236 0.398 0 C-N-CA 122.689 2.26 . . . . 0.87 113.044 -178.214 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 9.4 t -97.61 101.94 12.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.672 -0.694 . . . . 0.88 109.491 -178.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.444 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.0 OUTLIER -108.48 7.33 26.83 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.619 -0.719 . . . . 1.85 110.84 -178.26 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 86.05 -21.62 0.21 Allowed 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 114.737 -1.12 . . . . 1.29 112.29 178.219 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.7 mt -113.11 -42.69 4.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 O-C-N 122.224 -0.297 . . . . 1.89 111.105 -178.032 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 53.7 tptt -52.91 -54.61 32.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.14 -0.482 . . . . 2.99 110.975 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.405 ' HB3' HD22 ' A' ' 70' ' ' LEU . 9.4 tp -93.48 2.01 56.6 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.263 -0.426 . . . . 1.66 110.605 178.951 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 56.29 71.78 0.54 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.618 -0.719 . . . . 1.74 110.648 -177.54 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.538 ' HG ' ' CD1' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -132.35 75.01 74.98 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.168 -0.924 . . . . 1.61 109.921 -175.614 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -73.17 -37.06 3.65 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.561 2.174 . . . . 1.3 113.416 -173.258 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -91.48 -0.91 57.67 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.244 0.545 . . . . 1.97 110.937 -176.062 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.538 ' CD1' ' HG ' ' A' ' 70' ' ' LEU . 0.9 OUTLIER -65.71 -43.34 89.44 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.491 -0.777 . . . . 1.13 110.768 179.369 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -76.86 10.41 2.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.664 -0.698 . . . . 0.91 112.006 -173.573 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.6 mmtt -97.87 -47.85 5.4 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.125 -0.694 . . . . 2.86 109.125 176.289 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.7 mp -89.09 -52.63 10.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.322 -0.854 . . . . 1.0 110.608 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.9 mm -91.01 97.43 7.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.043 0.449 . . . . 0.75 109.879 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.3 mtmt -75.04 -11.19 60.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.887 -0.597 . . . . 1.99 111.13 -177.827 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -122.13 82.67 44.64 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 115.985 -0.552 . . . . 2.05 110.212 177.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -76.71 72.7 5.57 Favored 'Trans proline' 0 CA--C 1.53 0.28 0 C-N-CA 122.91 2.406 . . . . 0.89 112.016 -178.757 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -110.06 154.39 23.29 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.49 0.662 . . . . 0.82 110.924 -175.487 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.433 ' O ' HG12 ' A' ' 86' ' ' ILE . 13.9 p-10 -133.61 -129.21 0.17 Allowed 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 114.635 -1.166 . . . . 1.42 109.23 -173.677 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -120.44 -18.21 7.94 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.514 -0.55 . . . . 0.8 109.514 177.322 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -78.41 -35.59 32.79 Favored Glycine 0 N--CA 1.439 -1.13 0 N-CA-C 109.642 -1.383 . . . . 0.32 109.642 177.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 23.4 m -71.68 -35.54 70.31 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.254 -0.473 . . . . 0.95 110.63 174.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.433 HG12 ' O ' ' A' ' 82' ' ' ASP . 0.2 OUTLIER -62.83 -52.88 53.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.256 -0.646 . . . . 0.97 109.256 176.914 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.68 -25.5 67.36 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.945 -0.57 . . . . 1.15 111.104 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.477 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 14.9 tttp -68.54 -51.43 42.97 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 120.518 0.199 . . . . 2.46 110.65 179.386 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 11.4 mtp180 -66.54 -28.8 68.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.911 0.386 . . . . 1.16 110.683 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.717 ' HG ' ' SG ' ' A' ' 101' ' ' CYS . 5.6 mt -66.44 -58.55 5.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.936 -0.574 . . . . 0.49 110.96 173.874 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -68.19 -22.94 64.79 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.204 -0.453 . . . . 1.39 111.384 -176.02 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.477 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 7.6 t30 -89.38 -7.32 55.48 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.294 -0.412 . . . . 1.3 110.715 178.571 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 56.76 67.0 1.05 Allowed 'General case' 0 N--CA 1.464 0.251 0 O-C-N 123.648 0.593 . . . . 1.75 110.713 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' TYR . . . . . 0.424 ' HD2' ' CE2' ' A' ' 95' ' ' TYR . 14.1 t80 -77.87 -32.25 51.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.556 -0.747 . . . . 0.96 111.664 -178.536 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.424 ' CE2' ' HD2' ' A' ' 94' ' ' TYR . 0.0 OUTLIER -127.68 -172.72 2.74 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.612 0.72 . . . . 1.28 111.717 -175.897 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 96' ' ' TRP . . . . . 0.509 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 2.2 t-105 -76.17 -59.8 2.61 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 114.236 -1.347 . . . . 1.05 111.087 -177.283 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 8.2 m -128.31 166.37 18.75 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.999 0.428 . . . . 1.0 111.567 -172.054 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.783 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -70.5 -12.56 61.65 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.297 -0.411 . . . . 0.66 111.358 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' SER . . . . . 0.4 ' HA ' ' SD ' ' A' ' 102' ' ' MET . 0.1 OUTLIER -62.13 -22.79 66.13 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.387 0.613 . . . . 0.85 109.887 174.499 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -81.14 -44.95 17.15 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.411 -0.813 . . . . 2.44 110.348 176.303 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.717 ' SG ' ' HG ' ' A' ' 90' ' ' LEU . 1.6 t -69.49 -25.21 63.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.106 -0.497 . . . . 0.95 111.53 -176.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.4 ' SD ' ' HA ' ' A' ' 99' ' ' SER . 1.1 ptm -66.74 -16.75 64.46 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.637 -0.425 . . . . 1.13 110.292 177.269 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -78.5 -44.01 25.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 2.96 110.594 177.461 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ASP . . . . . 0.571 ' OD1' ' HA ' ' A' ' 101' ' ' CYS . 0.4 OUTLIER -75.07 -31.27 61.21 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.847 -0.427 . . . . 1.87 109.847 177.95 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.691 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -54.71 -51.54 65.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.807 -0.633 . . . . 0.38 109.945 170.336 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 -60.43 -46.01 91.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.398 -0.819 . . . . 0.97 110.026 176.139 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 63.3 m -54.69 -45.97 74.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.595 -0.73 . . . . 0.43 111.742 -177.423 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -54.26 -45.68 72.48 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 120.769 0.318 . . . . 0.88 110.73 176.094 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -64.94 -47.3 78.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.834 -0.621 . . . . 0.29 111.049 -178.272 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.31 -41.29 96.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.944 0.402 . . . . 0.66 110.686 -178.644 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -52.06 -46.05 64.98 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.374 -0.83 . . . . 1.84 110.547 177.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' CYS . . . . . 0.475 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 0.0 OUTLIER -70.32 -37.74 74.78 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.92 -0.582 . . . . 0.63 110.855 -178.68 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -71.7 -32.77 68.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.625 -0.261 . . . . 0.81 111.353 -177.764 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 76.9 mt -73.32 -57.98 5.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.531 -0.304 . . . . 0.55 111.33 -177.604 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -70.32 -41.55 73.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.381 -0.372 . . . . 1.22 111.318 -174.202 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' ASN . . . . . 0.475 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 71.7 m-80 -86.28 168.14 14.18 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.926 0.393 . . . . 1.04 111.031 -174.273 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.04 147.27 83.4 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.984 -0.553 . . . . 3.47 110.397 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_endo -60.35 -21.24 66.52 Favored 'Trans proline' 0 C--N 1.343 0.241 0 C-N-CA 122.447 2.098 . . . . 0.96 111.959 177.395 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.15 34.82 4.79 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.059 -0.519 . . . . 1.23 110.638 176.786 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -83.84 167.48 17.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.882 -0.599 . . . . 1.34 110.673 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -67.28 -49.67 63.4 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.868 -0.605 . . . . 1.44 110.49 -177.285 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -64.3 -40.05 87.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.046 -0.525 . . . . 0.42 110.655 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 6.6 t -65.45 -38.68 83.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.057 0.456 . . . . 0.35 110.681 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.31 -28.29 68.0 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.029 -0.532 . . . . 0.52 110.276 177.879 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' MET . . . . . 0.472 ' O ' HD13 ' A' ' 129' ' ' LEU . 3.1 mtt -82.52 -44.98 15.26 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.764 -0.653 . . . . 0.62 110.582 177.311 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.41 -33.24 58.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.679 -0.691 . . . . 0.31 111.697 -179.21 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -59.21 -45.87 89.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.373 -0.376 . . . . 1.94 110.986 178.844 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -73.86 -35.5 64.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.104 -0.498 . . . . 0.32 110.509 179.307 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.744 HD21 ' HA ' ' A' ' 56' ' ' ALA . 5.6 mp -61.37 -46.14 91.44 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.42 -0.809 . . . . 0.33 110.615 179.132 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -62.7 -23.87 67.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.321 -0.854 . . . . 1.47 111.831 -176.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.536 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -62.97 -49.63 73.97 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 109.914 -0.402 . . . . 2.24 109.914 -176.77 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.528 HD12 HD23 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -68.94 -30.09 45.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.953 -0.567 . . . . 1.23 110.481 179.577 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.484 ' O ' HG23 ' A' ' 137' ' ' VAL . 34.8 t80 -61.72 -62.88 1.49 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.984 -0.553 . . . . 0.46 110.99 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.8 pp -66.62 -29.91 70.05 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.821 0.343 . . . . 0.64 110.534 -175.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.536 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.3 OUTLIER -63.39 -48.79 76.41 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.623 -0.717 . . . . 1.61 111.203 -179.549 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 136' ' ' LYS . . . . . 0.419 ' HE3' HG21 ' A' ' 49' ' ' THR . 2.8 mttm -80.89 -14.03 58.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.403 -0.362 . . . . 1.52 111.285 -177.359 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 133' ' ' PHE . 30.9 t -82.53 -34.99 12.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.052 0.453 . . . . 0.35 109.882 178.025 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -66.44 -19.38 65.78 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.197 0.522 . . . . 0.5 110.432 178.373 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -100.05 10.61 41.01 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.991 -0.55 . . . . 1.76 111.172 -179.375 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -61.21 152.08 73.46 Favored Pre-proline 0 N--CA 1.466 0.341 0 CA-C-N 116.267 -0.424 . . . . 0.86 111.055 175.167 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -68.61 121.38 8.3 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.384 2.056 . . . . 0.67 112.074 179.265 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -71.97 1.95 6.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.32 -0.4 . . . . 2.91 112.065 -176.311 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 143' ' ' GLU . . . . . 0.441 ' HB2' HG23 ' A' ' 145' ' ' VAL . 1.2 mt-10 -97.69 -41.3 8.17 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 116.387 -0.37 . . . . 2.7 111.678 -171.675 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 60.55 65.7 1.02 Allowed 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.66 0.6 . . . . 2.34 109.979 -175.553 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 145' ' ' VAL . . . . . 0.441 HG23 ' HB2' ' A' ' 143' ' ' GLU . 16.6 t -98.21 127.78 50.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.699 -0.682 . . . . 0.99 110.294 -177.524 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.634 ' HG3' HG22 ' A' ' 36' ' ' THR . 8.8 tt0 -71.24 138.86 49.79 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.892 -0.41 . . . . 1.53 109.892 175.65 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 40.7 mt . . . . . 0 C--O 1.247 0.953 0 CA-C-O 118.395 -0.812 . . . . 1.57 110.516 -176.146 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.7 p . . . . . 0 N--CA 1.453 -0.296 0 CA-C-O 121.169 0.509 . . . . 0.93 110.158 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 73.1 m -166.95 142.57 4.26 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.551 -0.749 . . . . 1.61 109.347 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.463 ' HB3' ' CB ' ' A' ' 31' ' ' LYS . 34.8 t-20 -145.97 127.91 7.73 Favored Pre-proline 0 C--N 1.319 -0.754 0 N-CA-C 109.663 -0.495 . . . . 1.6 109.663 178.366 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -63.42 -36.12 57.06 Favored 'Trans proline' 0 N--CA 1.478 0.587 0 C-N-CA 123.224 2.616 . . . . 1.87 112.783 -177.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.5 m -80.35 -19.68 45.89 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 115.576 -0.738 . . . . 2.18 110.324 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.463 ' CB ' ' HB3' ' A' ' 28' ' ' ASN . 11.1 tttp -90.33 129.27 46.02 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.114 -0.948 . . . . 2.75 110.254 179.324 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.455 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 35.6 Cg_endo -69.17 135.72 32.63 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 121.96 1.773 . . . . 1.38 112.284 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -145.46 86.05 0.18 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.317 -0.856 . . . . 0.97 111.002 -178.742 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.498 ' HG3' ' CE2' ' A' ' 96' ' ' TRP . 1.7 mmm180 -97.97 163.38 12.8 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.879 0.371 . . . . 1.93 110.498 -176.161 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.424 ' HA ' HD22 ' A' ' 39' ' ' LEU . 4.3 mtmt -104.93 108.92 20.69 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.084 -0.507 . . . . 2.64 110.121 178.809 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.447 HG22 ' HG3' ' A' ' 146' ' ' GLU . 1.3 p -111.94 166.89 10.82 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.889 0.376 . . . . 0.68 110.864 176.227 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.544 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 60.3 t30 -59.75 -37.41 78.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.928 -0.578 . . . . 1.47 110.893 178.249 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -71.07 -37.47 72.48 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.854 0.359 . . . . 1.04 110.409 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.424 HD22 ' HA ' ' A' ' 35' ' ' LYS . 0.6 OUTLIER -63.18 -53.27 55.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.117 -0.492 . . . . 0.8 110.557 178.507 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -69.48 -21.43 63.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.093 -0.503 . . . . 1.75 110.81 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.544 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 52.8 t80 -64.36 -63.41 1.15 Allowed 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.003 -0.544 . . . . 0.64 110.868 178.307 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.609 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.5 OUTLIER -57.91 -31.45 66.79 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.534 -0.303 . . . . 1.13 110.867 -174.633 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -59.69 -55.24 36.83 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.909 -0.587 . . . . 1.3 111.209 178.097 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -86.56 -28.89 23.04 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 112.28 0.474 . . . . 0.5 112.28 -176.582 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 95.1 t -89.23 -57.51 4.19 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 N-CA-C 112.479 0.548 . . . . 0.3 112.479 -175.599 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.609 HG23 ' HA ' ' A' ' 42' ' ' MET . 39.7 t -81.47 -65.63 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 111.739 0.274 . . . . 0.26 111.739 -169.794 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.459 HG12 ' O ' ' A' ' 42' ' ' MET . 2.6 p -67.53 -34.26 67.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 C-N-CA 120.851 -0.34 . . . . 0.83 111.548 -174.253 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.4 mmtt -60.03 -39.5 86.08 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 122.243 -0.285 . . . . 2.4 111.574 177.646 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.3 m -75.97 -36.12 59.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.67 0.272 . . . . 0.55 110.713 178.6 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.597 HD23 HD12 ' A' ' 132' ' ' ILE . 0.1 OUTLIER -59.88 -37.51 79.58 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.406 0.622 . . . . 0.33 109.541 174.312 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 16.7 t-105 -63.9 -27.36 69.1 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.041 -0.982 . . . . 0.39 112.096 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.1 mtpt -88.97 0.79 56.34 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.038 0.384 . . . . 2.24 112.038 -174.014 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.449 ' CD2' HD11 ' A' ' 132' ' ' ILE . 8.7 t-80 -76.76 134.51 39.13 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.893 -0.41 . . . . 0.39 109.893 177.028 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 40.1 mm-40 -72.42 -13.39 61.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.417 -0.356 . . . . 1.91 111.743 -175.144 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.424 ' HB2' ' ND1' ' A' ' 53' ' ' HIS . 3.1 m-85 -96.08 -1.79 47.97 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.152 0.501 . . . . 0.93 110.341 178.556 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.594 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -97.28 13.9 27.91 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.411 0.624 . . . . 0.28 110.311 -179.185 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.623 ' HA ' ' CE2' ' A' ' 60' ' ' TYR . 54.3 p-90 -65.91 -33.6 7.45 Favored Pre-proline 0 CA--C 1.545 0.775 0 N-CA-C 113.787 1.032 . . . . 0.58 113.787 -174.913 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.477 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 1.3 Cg_endo -85.13 12.0 3.2 Favored 'Trans proline' 0 C--N 1.359 1.115 0 C-N-CA 121.695 1.597 . . . . 0.47 111.325 176.682 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -110.57 -0.39 17.32 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.389 -0.823 . . . . 1.11 110.781 -177.241 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.623 ' CE2' ' HA ' ' A' ' 57' ' ' TRP . 16.3 m-30 -82.21 -23.24 35.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.878 0.37 . . . . 0.63 111.179 -178.318 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.98 127.53 27.82 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.214 -0.448 . . . . 1.63 110.717 -174.373 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -69.79 158.22 57.65 Favored 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 122.835 2.357 . . . . 0.87 112.843 -177.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 41.7 t -77.07 94.45 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.618 0.723 . . . . 0.88 110.167 178.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.408 ' CG ' ' H ' ' A' ' 67' ' ' LYS . 0.4 OUTLIER -91.82 -10.24 40.54 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.103 -0.953 . . . . 1.85 110.507 178.499 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 80.37 -32.27 0.12 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.882 0.873 . . . . 1.29 112.646 176.85 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 24.0 mt -99.94 -57.24 4.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 O-C-N 122.122 -0.361 . . . . 1.89 111.724 -175.755 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.408 ' H ' ' CG ' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -66.99 -33.46 75.62 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.98 0.419 . . . . 2.99 110.92 -176.701 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.448 HD12 ' HA ' ' A' ' 68' ' ' LEU . 2.8 tp -90.27 -5.85 55.84 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.121 -0.49 . . . . 1.66 110.843 177.452 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 57.44 57.15 4.55 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.843 -0.617 . . . . 1.74 111.242 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.423 ' O ' ' HB2' ' A' ' 73' ' ' TYR . 25.9 mt -129.07 64.51 71.07 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.564 -0.744 . . . . 1.61 110.812 176.486 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -77.23 -27.74 6.37 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.322 2.015 . . . . 1.3 111.891 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -84.52 2.98 38.65 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.653 -0.703 . . . . 1.97 110.114 -179.453 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.442 ' HA ' ' CE1' ' A' ' 115' ' ' TYR . 1.5 t80 -65.19 -45.46 84.71 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.418 -0.81 . . . . 1.13 110.929 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -78.45 5.97 9.54 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.595 -0.73 . . . . 0.91 111.59 -172.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.0 mmmt -89.77 -22.84 21.95 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 108.989 -0.745 . . . . 2.86 108.989 178.244 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 53.6 mt -118.3 -56.09 3.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 CA-C-N 115.257 -0.883 . . . . 1.0 110.332 179.307 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 37.5 mm -88.83 107.46 17.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.959 -0.564 . . . . 0.75 110.564 -177.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.95 -10.43 59.27 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.895 -0.593 . . . . 1.99 110.889 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -117.58 82.94 16.45 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.004 -0.544 . . . . 2.05 110.109 176.204 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -76.32 91.05 1.14 Allowed 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.755 2.304 . . . . 0.89 112.0 -176.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -129.94 171.22 12.99 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.457 0.646 . . . . 0.82 111.245 -175.016 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.424 ' O ' HG12 ' A' ' 86' ' ' ILE . 12.9 p-10 -153.98 -134.81 0.05 OUTLIER 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.519 -1.219 . . . . 1.42 108.248 -174.943 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.2 ttm -113.25 -19.92 11.6 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.123 -0.695 . . . . 0.8 109.123 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.425 ' O ' ' HB2' ' A' ' 88' ' ' LYS . . . -79.81 -30.88 41.84 Favored Glycine 0 N--CA 1.44 -1.093 0 N-CA-C 109.863 -1.295 . . . . 0.32 109.863 178.006 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 28.5 m -77.14 -29.83 54.82 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.441 -0.379 . . . . 0.95 111.047 174.316 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.539 HD12 ' HB2' ' A' ' 104' ' ' ASP . 0.2 OUTLIER -65.52 -51.7 60.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 109.305 -0.628 . . . . 0.97 109.305 177.076 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.539 ' O ' ' HG2' ' A' ' 91' ' ' GLU . 0.0 OUTLIER -63.91 -27.35 69.09 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.156 -0.474 . . . . 1.15 110.164 177.548 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.558 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 0.8 OUTLIER -63.09 -52.27 63.31 Favored 'General case' 0 C--O 1.227 -0.09 0 CA-C-N 116.129 -0.487 . . . . 2.46 110.616 177.454 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.2 mmm-85 -63.91 -33.88 76.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.748 0.309 . . . . 1.16 110.724 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.8 mt -66.58 -57.89 6.31 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.936 -0.575 . . . . 0.49 111.598 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 11.4 pt-20 -78.55 -14.99 59.07 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.197 0.443 . . . . 1.39 112.197 -173.309 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.558 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 1.0 OUTLIER -90.41 -4.02 57.3 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 110.058 -0.349 . . . . 1.3 110.058 174.977 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.49 58.99 2.75 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.408 -0.815 . . . . 1.75 111.347 179.361 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -71.85 -45.12 62.46 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.999 0.428 . . . . 0.96 110.773 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -108.59 -171.71 1.91 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.9 -0.591 . . . . 1.28 110.896 -175.263 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' TRP . . . . . 0.498 ' CE2' ' HG3' ' A' ' 34' ' ' ARG . 2.0 t90 -86.9 -41.59 13.86 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.556 -0.747 . . . . 1.05 110.394 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 28.6 t -148.96 175.67 11.09 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.255 0.55 . . . . 1.0 111.62 -172.336 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.41 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -75.0 -10.93 59.94 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.618 -0.719 . . . . 0.66 110.653 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.66 -33.25 72.54 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.792 0.806 . . . . 0.85 109.493 173.348 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -82.19 -35.31 28.46 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 114.647 -1.16 . . . . 2.44 110.144 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.511 ' HA ' ' OD1' ' A' ' 104' ' ' ASP . 48.5 t -64.76 -24.61 67.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.984 -0.553 . . . . 0.95 110.709 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.5 mtt -59.73 -25.9 65.2 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.079 -0.509 . . . . 1.13 110.282 176.735 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.404 ' OE1' ' HA ' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -75.61 -47.36 26.92 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.025 -0.534 . . . . 2.96 110.896 179.981 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ASP . . . . . 0.539 ' HB2' HD12 ' A' ' 86' ' ' ILE . 0.2 OUTLIER -70.77 -37.21 73.36 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.806 -0.357 . . . . 1.87 110.472 -179.367 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.573 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -56.09 -48.22 76.53 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.153 0.502 . . . . 0.38 110.043 173.543 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -64.54 -47.29 79.33 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.619 -0.719 . . . . 0.97 110.508 177.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 90.1 m -52.27 -45.4 65.44 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.372 -0.376 . . . . 0.43 111.332 -178.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 6.2 ttp -54.64 -38.97 67.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.348 -0.387 . . . . 0.88 111.453 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -78.78 -51.82 9.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.739 0.304 . . . . 0.29 110.605 -175.427 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.45 -39.72 73.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.171 -0.468 . . . . 0.66 111.165 178.267 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -53.82 -49.3 68.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.073 -0.512 . . . . 1.84 110.964 178.235 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.46 -38.16 90.04 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 116.391 -0.368 . . . . 0.63 110.612 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' TYR . . . . . 0.414 ' HD1' HG22 ' A' ' 123' ' ' VAL . 15.2 m-85 -67.85 -33.19 74.28 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.288 -0.414 . . . . 0.81 111.135 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 70.0 mt -80.79 -50.65 16.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.36 -0.382 . . . . 0.55 111.971 -176.696 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' TYR . . . . . 0.442 ' CE1' ' HA ' ' A' ' 73' ' ' TYR . 64.3 t80 -68.3 -34.37 76.02 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.862 0.363 . . . . 1.22 111.154 -175.491 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 -98.7 -163.73 1.07 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.991 -0.549 . . . . 1.04 110.892 -175.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.67 156.51 44.72 Favored Pre-proline 0 C--N 1.325 -0.464 0 N-CA-C 109.999 -0.371 . . . . 3.47 109.999 179.545 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -59.41 -21.64 62.16 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.333 2.022 . . . . 0.96 111.99 176.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.94 8.64 42.17 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.55 -0.75 . . . . 1.23 111.56 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' ASP . . . . . 0.531 ' OD1' HG22 ' A' ' 122' ' ' ILE . 3.3 t70 -76.04 155.98 34.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.186 0.517 . . . . 1.34 111.401 -175.679 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.47 -42.73 74.45 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.144 -0.935 . . . . 1.44 109.889 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ILE . . . . . 0.531 HG22 ' OD1' ' A' ' 120' ' ' ASP . 2.4 tp -66.17 -33.75 65.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 115.977 -0.556 . . . . 0.42 110.535 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.414 HG22 ' HD1' ' A' ' 113' ' ' TYR . 2.8 t -69.94 -41.4 79.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.128 0.49 . . . . 0.35 110.131 177.913 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.29 -33.52 71.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.92 -0.582 . . . . 0.52 109.968 177.347 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' MET . . . . . 0.462 ' O ' HD13 ' A' ' 129' ' ' LEU . 21.5 mtt -76.49 -46.6 26.0 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.524 -0.762 . . . . 0.62 110.746 178.348 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -52.83 -36.71 59.02 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.284 -0.416 . . . . 0.31 111.634 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -60.73 -39.11 87.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.132 -0.486 . . . . 1.94 111.272 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.91 -36.9 35.76 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.153 0.501 . . . . 0.32 110.438 178.227 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.594 HD21 ' HA ' ' A' ' 56' ' ' ALA . 5.2 mp -60.46 -40.2 90.33 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.46 -0.791 . . . . 0.33 110.697 179.329 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -60.52 -24.54 65.43 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.943 -0.571 . . . . 1.47 111.961 -178.518 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.475 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -65.15 -39.41 92.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.681 0.277 . . . . 2.24 110.41 -177.521 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.597 HD12 HD23 ' A' ' 50' ' ' LEU . 11.3 mt -67.47 -28.55 42.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 1.23 110.846 -178.765 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.438 ' O ' HG23 ' A' ' 137' ' ' VAL . 33.3 t80 -61.46 -63.05 1.41 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.955 -0.566 . . . . 0.46 110.487 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.3 pp -65.89 -25.3 67.1 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.334 0.588 . . . . 0.64 110.51 -178.787 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.475 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -63.95 -34.15 77.33 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.484 -0.78 . . . . 1.61 111.446 -179.339 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 136' ' ' LYS . . . . . 0.577 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -102.13 -21.98 14.31 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.891 0.377 . . . . 1.52 111.036 -178.459 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 133' ' ' PHE . 40.9 t -73.13 -31.28 34.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.078 0.466 . . . . 0.35 110.518 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -72.25 -6.35 42.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.322 0.582 . . . . 0.5 110.36 178.453 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -111.55 2.79 17.58 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.541 -0.754 . . . . 1.76 110.117 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' MET . . . . . 0.424 ' HG3' ' HA ' ' A' ' 137' ' ' VAL . 0.1 OUTLIER -65.54 149.85 96.73 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 115.941 -0.572 . . . . 0.86 111.623 -179.736 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -84.84 87.26 1.07 Allowed 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.435 2.09 . . . . 0.67 111.165 177.576 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 6.6 mm-40 -70.47 11.03 0.39 Allowed 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.407 0.521 . . . . 2.91 112.407 -174.179 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -83.76 -39.6 19.86 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 108.85 -0.796 . . . . 2.7 108.85 173.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 67.82 98.55 0.05 Allowed 'General case' 0 C--O 1.231 0.115 0 CA-C-N 114.263 -1.335 . . . . 2.34 111.017 -177.493 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 9.4 t -100.55 107.47 21.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.746 -0.661 . . . . 0.99 109.304 175.419 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.447 ' HG3' HG22 ' A' ' 36' ' ' THR . 5.7 tt0 -66.21 140.13 58.15 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.741 -0.466 . . . . 1.53 109.741 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 11.1 mt . . . . . 0 C--O 1.246 0.906 0 CA-C-O 118.661 -0.685 . . . . 1.57 110.205 -177.308 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.456 ' O ' ' HB2' ' A' ' 94' ' ' TYR . 4.4 p . . . . . 0 N--CA 1.453 -0.324 0 N-CA-C 109.157 -0.683 . . . . 0.93 109.157 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.7 m -173.66 116.4 0.25 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 114.976 -1.011 . . . . 1.61 108.855 -179.252 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.469 ' OD1' ' HD2' ' A' ' 29' ' ' PRO . 20.3 t30 -140.5 132.69 14.39 Favored Pre-proline 0 C--N 1.319 -0.734 0 C-N-CA 120.918 -0.313 . . . . 1.6 110.75 -173.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' PRO . . . . . 0.469 ' HD2' ' OD1' ' A' ' 28' ' ' ASN . 70.7 Cg_endo -69.42 -38.76 8.08 Favored 'Trans proline' 0 N--CA 1.474 0.368 0 C-N-CA 123.044 2.496 . . . . 1.87 112.002 177.332 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 7.2 m -71.65 -17.22 62.27 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.392 -0.822 . . . . 2.18 110.571 -179.499 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.8 tmtm? -101.55 110.29 61.39 Favored Pre-proline 0 C--N 1.318 -0.802 0 CA-C-N 115.348 -0.842 . . . . 2.75 109.453 175.547 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.633 ' HB2' ' CZ3' ' A' ' 96' ' ' TRP . 24.5 Cg_endo -63.54 133.95 42.2 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 121.549 1.5 . . . . 1.38 111.978 -179.01 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -160.18 80.67 0.15 Allowed Glycine 0 N--CA 1.44 -1.099 0 CA-C-N 115.023 -0.989 . . . . 0.97 110.917 -177.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.1 mtm180 -73.92 -117.09 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.95 0.405 . . . . 1.93 110.186 -179.336 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -175.06 129.04 0.29 Allowed 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.447 -0.575 . . . . 2.64 109.447 178.413 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.779 HG22 ' HG3' ' A' ' 146' ' ' GLU . 4.1 p -118.94 159.76 23.22 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 109.841 -0.429 . . . . 0.68 109.841 174.002 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -57.71 -36.47 72.06 Favored 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 110.091 -0.337 . . . . 1.47 110.091 178.165 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.429 ' OE1' ' HB3' ' A' ' 140' ' ' MET . 0.9 OUTLIER -57.05 -44.09 82.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.696 -0.683 . . . . 1.04 110.922 178.32 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.515 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.4 OUTLIER -63.41 -55.63 22.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.059 -0.518 . . . . 0.8 110.822 -179.052 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -62.98 -33.98 76.55 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.849 -0.614 . . . . 1.75 110.516 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -57.74 -63.38 1.26 Allowed 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 115.973 -0.558 . . . . 0.64 110.388 176.145 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.561 ' HB2' ' SD ' ' A' ' 140' ' ' MET . 8.6 ttp -59.81 -30.66 69.07 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.41 -0.359 . . . . 1.13 110.54 -175.656 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.552 ' HB2' HD22 ' A' ' 90' ' ' LEU . 3.0 tt0 -61.5 -55.92 25.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.665 -0.698 . . . . 1.3 111.101 178.247 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 62.6 m-80 -85.72 -27.24 25.41 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.092 0.404 . . . . 0.5 112.092 -176.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 94.9 t -89.36 -57.73 4.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 N-CA-C 112.305 0.483 . . . . 0.3 112.305 -177.085 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.668 HG22 ' HB3' ' A' ' 136' ' ' LYS . 48.0 t -82.15 -66.66 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 112.143 0.423 . . . . 0.26 112.143 -169.864 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.462 HG12 ' O ' ' A' ' 42' ' ' MET . 0.9 OUTLIER -65.97 -37.18 79.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 C-N-CA 120.707 -0.397 . . . . 0.83 111.248 -174.248 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.533 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 0.2 OUTLIER -56.7 -39.95 74.76 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.544 0.212 . . . . 2.4 111.164 178.702 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 12.2 m -77.47 -35.78 53.44 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 121.131 -0.228 . . . . 0.55 111.158 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.684 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -62.02 -39.05 90.95 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.269 0.557 . . . . 0.33 109.581 175.012 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 33.1 t-105 -62.74 -29.35 70.62 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.549 -0.751 . . . . 0.39 111.235 177.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.533 ' HG3' ' O ' ' A' ' 48' ' ' LYS . 12.7 mtpt -82.5 -5.54 58.78 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 111.949 0.352 . . . . 2.24 111.949 -175.394 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.525 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 4.7 t-80 -74.71 128.19 34.95 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.01 0.433 . . . . 0.39 110.028 177.414 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -82.61 15.7 2.47 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.247 -0.433 . . . . 1.91 111.445 -176.197 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.525 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.4 OUTLIER -112.15 -7.42 14.05 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.175 -0.676 . . . . 0.93 109.175 171.296 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.597 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -96.24 11.42 34.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.63 -0.713 . . . . 0.28 110.498 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.489 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 42.9 p-90 -63.27 -33.33 10.32 Favored Pre-proline 0 CA--C 1.545 0.778 0 N-CA-C 113.849 1.055 . . . . 0.58 113.849 -175.64 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.489 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 10.3 Cg_exo -73.37 -13.76 25.35 Favored 'Trans proline' 0 C--N 1.356 0.956 0 C-N-CA 121.423 1.415 . . . . 0.47 111.88 176.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -94.91 -0.89 53.58 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.986 -0.552 . . . . 1.11 110.665 -178.502 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 12.5 m-30 -66.64 -34.53 78.07 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.017 -0.538 . . . . 0.63 110.987 -179.77 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -94.68 138.35 22.26 Favored Pre-proline 0 C--N 1.325 -0.479 0 CA-C-N 115.857 -0.611 . . . . 1.63 110.663 -175.797 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.617 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 41.2 Cg_endo -69.38 141.95 48.23 Favored 'Trans proline' 0 C--O 1.237 0.468 0 C-N-CA 122.523 2.149 . . . . 0.87 112.65 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.414 HG11 ' CD2' ' A' ' 73' ' ' TYR . 53.1 t -77.32 87.93 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.798 0.809 . . . . 0.88 109.319 177.243 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.45 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.0 OUTLIER -102.98 1.92 34.29 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.286 -0.87 . . . . 1.85 110.41 -178.015 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.45 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 85.72 -21.31 0.22 Allowed 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 114.804 -1.089 . . . . 1.29 112.186 177.091 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 35.0 mm -112.26 -49.37 5.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 120.859 0.361 . . . . 1.89 111.002 -178.086 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.43 -36.32 73.46 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.004 -0.544 . . . . 2.99 111.699 -178.395 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -108.58 4.8 24.43 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.328 -0.396 . . . . 1.66 110.456 178.607 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 55.33 52.27 11.69 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.349 -0.842 . . . . 1.74 111.597 -179.068 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 19.2 mt -127.05 64.9 62.37 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 116.058 -0.519 . . . . 1.61 111.61 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' PRO . . . . . 0.42 ' HA ' ' HB1' ' A' ' 65' ' ' ALA . 64.6 Cg_endo -75.76 -20.23 15.59 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 121.956 1.771 . . . . 1.3 110.865 176.667 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -75.78 -19.8 58.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.958 -1.019 . . . . 1.97 110.361 179.023 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.469 ' OH ' ' HB3' ' A' ' 111' ' ' ASN . 0.5 OUTLIER -64.77 -39.07 93.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.336 -0.847 . . . . 1.13 110.299 178.98 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 74' ' ' HIS . . . . . 0.414 ' HE1' HG12 ' A' ' 63' ' ' VAL . 0.3 OUTLIER -78.29 6.28 8.59 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.507 -0.769 . . . . 0.91 111.456 -174.44 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -97.36 -53.99 3.29 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.096 0.474 . . . . 2.86 109.727 -179.291 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.9 mp -90.53 -47.02 14.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.563 -0.744 . . . . 1.0 110.878 -178.509 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 26.8 mm -78.18 114.83 19.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.964 -0.562 . . . . 0.75 110.353 -177.187 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.9 mtmm -72.86 -27.01 61.67 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.677 -0.692 . . . . 1.99 111.441 -176.015 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -127.13 81.78 69.32 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 116.276 -0.42 . . . . 2.05 110.817 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -65.95 93.63 0.27 Allowed 'Trans proline' 0 C--O 1.236 0.392 0 C-N-CA 122.601 2.201 . . . . 0.89 111.94 178.388 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 1.6 mmt -126.26 157.55 38.02 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.893 -0.594 . . . . 0.82 110.335 -178.012 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.617 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 1.2 p-10 -139.65 -121.72 0.12 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.023 -0.989 . . . . 1.42 109.427 -172.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' MET . . . . . 0.422 ' SD ' HD13 ' A' ' 50' ' ' LEU . 3.6 ttp -130.72 -17.31 3.23 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.033 0.444 . . . . 0.8 110.434 178.778 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -88.71 -27.76 23.44 Favored Glycine 0 N--CA 1.442 -0.944 0 N-CA-C 110.235 -1.146 . . . . 0.32 110.235 -179.241 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -74.23 -36.0 63.9 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.271 -0.464 . . . . 0.95 110.655 176.138 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.438 HG23 ' SG ' ' A' ' 101' ' ' CYS . 75.5 mt -61.73 -53.05 53.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.796 -0.638 . . . . 0.97 110.093 175.03 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.526 ' O ' ' HG2' ' A' ' 91' ' ' GLU . 0.2 OUTLIER -63.08 -28.18 69.9 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.157 -0.474 . . . . 1.15 111.247 178.843 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.409 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 2.3 tptt -64.36 -47.18 80.3 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.894 0.378 . . . . 2.46 110.581 178.755 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.505 ' HB3' ' CE2' ' A' ' 95' ' ' TYR . 6.9 mtp180 -65.33 -29.71 70.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.008 -0.542 . . . . 1.16 110.447 178.222 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.552 HD22 ' HB2' ' A' ' 43' ' ' GLN . 12.4 mt -73.22 -54.92 7.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.759 -0.655 . . . . 0.49 111.674 -179.139 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.526 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 2.6 pt-20 -66.77 -31.56 72.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.432 -0.349 . . . . 1.39 111.215 -175.75 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.409 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 0.7 OUTLIER -81.32 -4.78 56.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.33 -0.395 . . . . 1.3 110.507 178.877 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.5 t30 56.82 58.56 4.0 Favored 'General case' 0 CA--C 1.522 -0.097 0 CA-C-N 115.731 -0.668 . . . . 1.75 111.363 -179.258 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' TYR . . . . . 0.456 ' HB2' ' O ' ' A' ' 26' ' ' VAL . 62.1 t80 -87.54 -35.2 18.28 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.31 -0.404 . . . . 0.96 111.067 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.505 ' CE2' ' HB3' ' A' ' 89' ' ' ARG . 54.1 m-85 -77.71 168.8 19.36 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-O 121.823 0.821 . . . . 1.28 111.624 -176.031 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' TRP . . . . . 0.633 ' CZ3' ' HB2' ' A' ' 32' ' ' PRO . 2.0 t90 -87.48 -44.25 11.45 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 114.116 -1.402 . . . . 1.05 109.432 168.166 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.479 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 3.3 t -153.22 170.89 19.45 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 114.949 -1.023 . . . . 1.0 110.265 -170.756 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.515 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -65.43 -23.43 66.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.746 0.308 . . . . 0.66 111.121 -177.77 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.3 -25.25 67.76 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.09 -0.505 . . . . 0.85 111.03 178.268 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.406 ' HB3' ' CD1' ' A' ' 95' ' ' TYR . 16.6 tt0 -83.86 -29.5 27.19 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.227 0.537 . . . . 2.44 109.653 179.419 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.438 ' SG ' HG23 ' A' ' 86' ' ' ILE . 5.2 t -82.45 -30.98 29.7 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.715 -0.675 . . . . 0.95 111.076 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.02 -30.96 69.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.258 -0.428 . . . . 1.13 110.775 -179.533 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -63.59 -43.07 98.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.13 -0.486 . . . . 2.96 110.261 175.593 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -68.31 -43.16 78.23 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.036 -0.529 . . . . 1.87 109.715 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.684 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -54.92 -52.18 63.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.478 -0.783 . . . . 0.38 110.508 176.138 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -59.78 -40.65 88.98 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.838 -0.619 . . . . 0.97 110.67 178.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' THR . . . . . 0.433 ' HA ' ' OG1' ' A' ' 110' ' ' THR . 97.3 m -63.34 -43.71 96.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.118 -0.492 . . . . 0.43 111.276 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.49 -44.3 68.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.987 0.422 . . . . 0.88 110.82 177.024 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -71.63 -41.08 69.29 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.124 -0.489 . . . . 0.29 111.24 -179.014 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.433 ' OG1' ' HA ' ' A' ' 107' ' ' THR . 0.1 OUTLIER -65.0 -42.15 94.73 Favored 'General case' 0 CA--C 1.52 -0.21 0 C-N-CA 120.88 -0.328 . . . . 0.66 110.623 -179.851 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ASN . . . . . 0.469 ' HB3' ' OH ' ' A' ' 73' ' ' TYR . 59.6 m-20 -48.75 -52.55 23.1 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.656 -0.702 . . . . 1.84 111.114 178.513 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 1.8 t -56.26 -46.42 79.68 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.694 -0.684 . . . . 0.63 111.573 177.385 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -73.58 -20.81 60.52 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.83 0.307 . . . . 0.81 111.83 -174.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 89.0 mt -91.8 -55.93 5.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.653 0.263 . . . . 0.55 111.301 -176.43 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -76.19 -39.98 53.48 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.823 0.344 . . . . 1.22 110.905 -175.156 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -93.01 150.9 20.22 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.339 -0.391 . . . . 1.04 110.414 -176.232 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 2.9 ttpp -64.98 142.03 98.55 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.859 -0.609 . . . . 3.47 110.195 178.821 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' PRO . . . . . 0.44 ' HA ' HG11 ' A' ' 123' ' ' VAL . 16.7 Cg_endo -59.46 -13.1 19.31 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.832 2.355 . . . . 0.96 112.376 178.179 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -111.45 26.91 10.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.119 -0.491 . . . . 1.23 110.811 178.286 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' ASP . . . . . 0.412 ' OD1' HG22 ' A' ' 122' ' ' ILE . 6.2 t70 -88.09 158.7 18.5 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.178 -0.465 . . . . 1.34 110.76 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.81 -43.66 98.41 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.153 -0.93 . . . . 1.44 110.611 -179.313 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ILE . . . . . 0.412 HG22 ' OD1' ' A' ' 120' ' ' ASP . 1.0 OUTLIER -69.16 -36.65 74.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-O 120.998 0.428 . . . . 0.42 110.872 -178.688 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.44 HG11 ' HA ' ' A' ' 118' ' ' PRO . 3.1 t -67.66 -36.52 76.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.075 0.464 . . . . 0.35 110.302 -179.187 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.34 -33.78 71.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.812 -0.631 . . . . 0.52 110.112 178.414 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' MET . . . . . 0.421 ' O ' HD13 ' A' ' 129' ' ' LEU . 16.9 mtt -79.61 -42.93 23.86 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.819 -0.628 . . . . 0.62 110.677 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.94 -36.79 65.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.042 -0.526 . . . . 0.31 111.755 -178.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -62.43 -40.91 98.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.471 . . . . 1.94 111.055 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.04 -37.71 61.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.078 0.466 . . . . 0.32 110.523 179.108 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.597 HD21 ' HA ' ' A' ' 56' ' ' ALA . 1.6 mp -58.85 -39.59 81.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.416 -0.811 . . . . 0.33 110.536 179.037 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -61.47 -25.12 67.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.517 -0.765 . . . . 1.47 112.075 -177.091 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.517 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -66.45 -39.45 88.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.777 0.322 . . . . 2.24 110.433 -176.924 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.573 HD12 HD23 ' A' ' 50' ' ' LEU . 8.9 mt -70.06 -30.9 45.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.069 -0.514 . . . . 1.23 110.416 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.54 ' O ' HG23 ' A' ' 137' ' ' VAL . 61.5 t80 -59.78 -62.87 1.55 Allowed 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.835 -0.621 . . . . 0.46 110.491 179.447 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.61 -30.26 71.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.937 0.398 . . . . 0.64 110.665 -177.593 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.517 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -57.16 -47.42 81.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.491 -0.777 . . . . 1.61 111.267 179.724 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 136' ' ' LYS . . . . . 0.668 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -89.18 -18.55 26.91 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.91 -0.587 . . . . 1.52 111.139 -176.304 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 133' ' ' PHE . 40.5 t -72.34 -31.79 40.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 109.77 -0.455 . . . . 0.35 109.77 177.174 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -60.3 -27.38 67.26 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.48 -0.782 . . . . 0.5 110.588 175.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -91.02 -8.86 47.89 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.054 -0.975 . . . . 1.76 111.123 -173.365 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 140' ' ' MET . . . . . 0.561 ' SD ' ' HB2' ' A' ' 42' ' ' MET . 0.9 OUTLIER -64.81 144.59 98.93 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.11 -0.495 . . . . 0.86 111.171 -178.208 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 141' ' ' PRO . . . . . 0.435 ' C ' ' H ' ' A' ' 143' ' ' GLU . 57.9 Cg_endo -70.34 107.38 1.96 Allowed 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.453 2.102 . . . . 0.67 111.324 178.347 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.78 29.45 0.11 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.273 0.559 . . . . 2.91 111.759 -173.366 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 143' ' ' GLU . . . . . 0.435 ' H ' ' C ' ' A' ' 141' ' ' PRO . 22.3 mt-10 -105.33 -39.71 6.07 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.782 -0.644 . . . . 2.7 109.631 174.649 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 63.27 73.27 0.46 Allowed 'General case' 0 C--N 1.334 -0.089 0 CA-C-N 114.788 -1.096 . . . . 2.34 109.829 -174.402 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 1.5 t -89.62 122.01 40.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.698 -0.683 . . . . 0.99 109.734 -176.043 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.779 ' HG3' HG22 ' A' ' 36' ' ' THR . 7.9 tt0 -70.71 147.58 48.91 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.758 0.313 . . . . 1.53 110.698 -179.291 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 64.9 mt . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.584 -0.722 . . . . 1.57 110.239 -178.856 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.5 p . . . . . 0 N--CA 1.448 -0.552 0 CA-C-O 121.303 0.573 . . . . 0.93 109.48 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.2 m -177.11 138.78 0.25 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-N 114.957 -1.02 . . . . 1.61 109.827 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.5 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 35.3 t-20 -135.34 127.17 17.73 Favored Pre-proline 0 C--N 1.322 -0.625 0 N-CA-C 109.472 -0.566 . . . . 1.6 109.472 178.313 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -61.46 -38.3 64.55 Favored 'Trans proline' 0 N--CA 1.475 0.426 0 C-N-CA 123.239 2.626 . . . . 1.87 113.034 -178.038 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.1 m -80.34 -19.65 46.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.216 0.531 . . . . 2.18 110.49 -178.312 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.5 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 5.6 tttp -96.61 107.07 34.15 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.522 -0.763 . . . . 2.75 110.502 178.432 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.461 ' HB2' ' CZ3' ' A' ' 96' ' ' TRP . 3.2 Cg_exo -72.85 149.02 46.99 Favored 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 122.413 2.075 . . . . 1.38 112.391 -178.119 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -145.92 85.68 0.18 Allowed Glycine 0 N--CA 1.442 -0.965 0 N-CA-C 110.746 -0.941 . . . . 0.97 110.746 178.252 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -74.54 159.25 32.44 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.15 0.5 . . . . 1.93 110.976 -175.81 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.59 104.74 17.19 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.241 -0.436 . . . . 2.64 109.886 179.382 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.589 HG22 ' HG3' ' A' ' 146' ' ' GLU . 1.5 p -104.36 164.29 11.84 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.048 -0.524 . . . . 0.68 110.513 178.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -60.46 -41.37 93.99 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.268 -0.424 . . . . 1.47 110.551 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -61.92 -44.66 96.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.238 -0.437 . . . . 1.04 110.565 178.891 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.16 -52.96 63.11 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.824 -0.625 . . . . 0.8 111.092 -178.8 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 20.7 mm100 -69.26 -28.25 66.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.042 -0.526 . . . . 1.75 110.919 -179.094 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.466 ' CE1' ' HG2' ' A' ' 140' ' ' MET . 53.2 t80 -61.23 -63.84 1.15 Allowed 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.994 -0.548 . . . . 0.64 110.137 177.102 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.517 ' O ' HG12 ' A' ' 47' ' ' VAL . 0.3 OUTLIER -61.52 -30.52 70.68 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.946 -0.301 . . . . 1.13 110.611 -173.091 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 33.0 tt0 -58.71 -59.18 5.81 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.684 -0.689 . . . . 1.3 111.245 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 63.4 m-80 -87.81 -25.95 23.09 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 112.231 0.456 . . . . 0.5 112.231 -177.016 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.404 HG11 ' CZ ' ' A' ' 41' ' ' TYR . 97.4 t -89.1 -57.97 3.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 112.386 0.513 . . . . 0.3 112.386 -175.846 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.475 HG23 ' HA ' ' A' ' 42' ' ' MET . 59.6 t -81.97 -66.25 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 111.941 0.348 . . . . 0.26 111.941 -170.06 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.517 HG12 ' O ' ' A' ' 42' ' ' MET . 2.1 p -66.99 -32.7 59.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 C-N-CA 120.925 -0.31 . . . . 0.83 111.345 -174.002 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.2 -34.0 75.63 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.775 -0.37 . . . . 2.4 111.001 176.939 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 38.2 m -79.89 -36.59 36.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.725 0.297 . . . . 0.55 110.302 177.537 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.653 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -60.5 -44.7 95.7 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.169 -0.469 . . . . 0.33 109.768 175.399 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 17.6 t-105 -62.76 -30.43 71.44 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.457 -0.792 . . . . 0.39 111.556 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.9 mtpp -90.7 7.62 38.6 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.018 0.377 . . . . 2.24 112.018 -174.63 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.493 ' HB3' ' HB2' ' A' ' 56' ' ' ALA . 41.3 t-80 -75.61 143.55 42.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.913 0.387 . . . . 0.39 110.133 177.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -69.12 -25.09 64.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.166 -0.47 . . . . 1.91 112.205 -175.218 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.568 ' HB3' ' HB2' ' A' ' 125' ' ' MET . 21.7 m-85 -105.23 8.42 33.96 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.065 0.459 . . . . 0.93 110.619 -178.819 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.609 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -93.15 8.13 41.4 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.135 0.493 . . . . 0.28 110.837 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.419 ' CG ' ' HD3' ' A' ' 58' ' ' PRO . 62.3 p-90 -62.44 -34.47 15.06 Favored Pre-proline 0 CA--C 1.548 0.872 0 N-CA-C 113.873 1.064 . . . . 0.58 113.873 -175.577 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.643 ' HG2' ' SD ' ' A' ' 125' ' ' MET . 5.6 Cg_exo -80.14 3.66 7.44 Favored 'Trans proline' 0 C--N 1.36 1.173 0 C-N-CA 121.636 1.557 . . . . 0.47 112.221 179.219 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 31.4 m-85 -113.9 47.05 1.23 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.702 0.763 . . . . 1.11 109.166 178.315 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -114.18 -13.61 12.38 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.146 -0.934 . . . . 0.63 109.903 -178.581 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.76 117.0 24.43 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 115.268 -0.878 . . . . 1.63 110.602 -169.377 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.32 143.23 93.55 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 122.337 2.024 . . . . 0.87 112.196 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.479 HG11 ' CD2' ' A' ' 73' ' ' TYR . 2.9 t -67.5 106.09 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-O 121.715 0.769 . . . . 0.88 110.047 178.226 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.404 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.0 OUTLIER -107.51 0.93 23.06 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.859 -1.064 . . . . 1.85 109.379 178.774 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.404 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 77.31 -55.73 0.53 Allowed 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 114.274 -1.33 . . . . 1.29 111.595 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.0 mt -77.77 -49.41 21.99 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.817 0 N-CA-C 111.635 0.235 . . . . 1.89 111.635 -173.15 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.71 -19.73 64.38 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.805 0.298 . . . . 2.99 111.805 -175.801 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.46 HD12 ' HA ' ' A' ' 68' ' ' LEU . 1.4 tp -109.84 -0.86 18.17 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.888 -0.325 . . . . 1.66 111.288 179.257 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 61.88 42.78 9.98 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.711 -0.677 . . . . 1.74 112.129 178.758 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -126.51 68.37 67.74 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 115.969 -0.56 . . . . 1.61 110.683 176.864 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -72.1 -26.0 18.61 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.093 1.862 . . . . 1.3 111.869 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 -84.28 -4.14 58.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.741 -0.663 . . . . 1.97 110.484 -178.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.479 ' CD2' HG11 ' A' ' 63' ' ' VAL . 27.0 t80 -65.29 -30.89 71.79 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.699 -0.682 . . . . 1.13 110.307 178.621 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -80.89 2.93 24.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.548 -0.751 . . . . 0.91 111.613 -171.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.7 mtpt -96.75 -51.08 4.43 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.078 0.466 . . . . 2.86 109.859 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.7 mp -81.58 -45.0 20.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.865 -0.607 . . . . 1.0 110.539 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 45.0 mm -89.56 123.32 41.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.192 -0.458 . . . . 0.75 110.019 -178.892 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.468 ' O ' ' HD3' ' A' ' 80' ' ' PRO . 0.9 OUTLIER -86.44 -36.12 19.29 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.263 -0.426 . . . . 1.99 111.295 -175.235 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -112.33 90.4 14.15 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 109.708 -0.479 . . . . 2.05 109.708 176.598 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.468 ' HD3' ' O ' ' A' ' 78' ' ' LYS . 13.1 Cg_exo -69.11 87.11 0.47 Allowed 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.996 2.464 . . . . 0.89 111.937 -178.78 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.0 mmt -124.0 164.38 19.47 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.888 -0.596 . . . . 0.82 110.766 -176.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.46 ' CG ' ' H ' ' A' ' 83' ' ' MET . 19.9 t70 -143.18 -144.64 0.16 Allowed 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 106.755 -1.572 . . . . 1.42 106.755 -177.105 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' MET . . . . . 0.46 ' H ' ' CG ' ' A' ' 82' ' ' ASP . 0.5 OUTLIER -107.84 -18.06 13.91 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 107.924 -1.139 . . . . 0.8 107.924 177.758 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -74.98 -26.26 67.16 Favored Glycine 0 N--CA 1.439 -1.135 0 N-CA-C 109.398 -1.481 . . . . 0.32 109.398 177.364 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -83.9 -37.22 22.65 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 114.868 -0.666 . . . . 0.95 111.079 177.324 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -61.11 -49.96 82.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.003 -0.544 . . . . 0.97 109.719 178.095 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.415 ' HG3' ' N ' ' A' ' 88' ' ' LYS . 0.1 OUTLIER -66.58 -26.44 67.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.863 -0.608 . . . . 1.15 111.001 179.957 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.415 ' N ' ' HG3' ' A' ' 87' ' ' LYS . 1.2 tptt -67.47 -51.36 52.26 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-O 120.688 0.28 . . . . 2.46 110.703 -179.327 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.453 HH22 ' CG ' ' A' ' 104' ' ' ASP . 10.0 mtm-85 -67.66 -24.05 65.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.944 0.402 . . . . 1.16 110.81 -179.153 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 4.0 mt -73.33 -59.52 2.67 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.957 -0.565 . . . . 0.49 111.041 177.607 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 19.9 pt-20 -66.63 -36.73 83.29 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.738 -0.665 . . . . 1.39 111.114 -175.019 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -79.26 -4.41 50.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.384 -0.371 . . . . 1.3 110.6 -179.05 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 58.25 72.04 0.55 Allowed 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.428 0.632 . . . . 1.75 110.731 176.291 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -93.97 -49.94 5.56 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.002 -0.544 . . . . 0.96 110.98 179.301 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.438 ' CE1' ' HB2' ' A' ' 101' ' ' CYS . 0.2 OUTLIER -96.07 -179.67 4.76 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.846 0.355 . . . . 1.28 110.94 -177.933 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 96' ' ' TRP . . . . . 0.461 ' CZ3' ' HB2' ' A' ' 32' ' ' PRO . 2.1 t-105 -82.58 -46.52 13.23 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.74 -0.664 . . . . 1.05 111.878 -174.055 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.4 t -144.93 172.3 13.24 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 120.424 -0.511 . . . . 1.0 110.929 -173.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -68.16 -17.88 64.46 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.081 -0.508 . . . . 0.66 111.458 -176.255 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.06 -33.81 73.91 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 121.019 0.437 . . . . 0.85 109.976 175.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.4 -37.35 63.4 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.877 -0.601 . . . . 2.44 109.571 177.179 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.438 ' HB2' ' CE1' ' A' ' 95' ' ' TYR . 41.3 t -68.01 -39.49 83.17 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.565 -0.743 . . . . 0.95 111.322 -178.774 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.23 -22.99 67.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.359 -0.382 . . . . 1.13 110.912 -177.029 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -67.2 -44.29 79.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.064 0.459 . . . . 2.96 110.466 175.413 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ASP . . . . . 0.453 ' CG ' HH22 ' A' ' 89' ' ' ARG . 0.6 OUTLIER -78.76 -29.97 45.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.36 -0.382 . . . . 1.87 110.194 -179.348 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.653 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -60.84 -40.72 93.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.77 -0.65 . . . . 0.38 109.647 173.145 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -68.72 -34.52 75.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.771 -0.65 . . . . 0.97 110.126 174.601 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 86.3 m -63.02 -51.93 64.86 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.891 -0.595 . . . . 0.43 111.265 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 10.7 ptm -59.57 -32.75 70.65 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.783 0.325 . . . . 0.88 111.291 -178.797 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -73.13 -47.51 43.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.509 -0.314 . . . . 0.29 110.764 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.1 p -64.84 -38.97 92.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.756 0.312 . . . . 0.66 110.589 179.048 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.0 m-20 -47.83 -53.08 16.65 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.529 -0.759 . . . . 1.84 110.731 177.077 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 10.6 t -60.84 -43.81 97.78 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.312 -0.858 . . . . 0.63 111.02 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -66.14 -33.98 77.02 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.492 -0.322 . . . . 0.81 111.541 -177.229 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 70.6 mt -80.32 -55.46 8.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.575 -0.284 . . . . 0.55 111.622 -176.1 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' TYR . . . . . 0.475 ' CE1' ' HA ' ' A' ' 73' ' ' TYR . 57.6 t80 -68.3 -35.87 78.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.908 0.385 . . . . 1.22 111.43 -174.048 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 63.6 m-80 -94.23 -170.23 2.24 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.137 -0.483 . . . . 1.04 110.725 -175.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.31 154.5 40.54 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 116.32 -0.4 . . . . 3.47 110.363 -177.563 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -61.9 -25.54 78.21 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.415 2.076 . . . . 0.96 111.67 176.318 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.26 22.07 12.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.787 -0.642 . . . . 1.23 111.018 178.273 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' ASP . . . . . 0.41 ' OD1' HG22 ' A' ' 122' ' ' ILE . 3.8 t70 -87.23 155.57 20.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 1.34 110.341 179.431 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -68.83 -42.36 77.31 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.728 -0.669 . . . . 1.44 110.244 -178.292 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' ILE . . . . . 0.707 ' HA ' ' SD ' ' A' ' 125' ' ' MET . 1.4 tp -65.21 -32.81 59.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.853 -0.612 . . . . 0.42 110.743 -177.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 2.7 t -74.09 -37.71 47.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.145 0.498 . . . . 0.35 110.105 178.09 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.14 -38.45 79.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.681 -0.691 . . . . 0.52 110.515 -178.495 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' MET . . . . . 0.707 ' SD ' ' HA ' ' A' ' 122' ' ' ILE . 0.0 OUTLIER -82.5 -39.28 22.67 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.325 -0.398 . . . . 0.62 111.311 177.991 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.23 -32.24 64.26 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.753 0.311 . . . . 0.31 111.566 -178.462 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -63.98 -44.39 92.84 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.17 -0.468 . . . . 1.94 110.692 177.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.63 -41.23 84.23 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.236 -0.438 . . . . 0.32 110.565 177.531 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.609 HD21 ' HA ' ' A' ' 56' ' ' ALA . 9.3 mp -56.73 -45.34 82.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.81 -0.632 . . . . 0.33 110.549 177.599 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -65.05 -23.32 67.15 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.649 -0.705 . . . . 1.47 111.551 -177.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.2 -49.16 53.07 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 110.17 -0.308 . . . . 2.24 110.17 -177.11 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.442 HG13 ' O ' ' A' ' 129' ' ' LEU . 1.0 OUTLIER -72.41 -24.92 22.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.41 -0.359 . . . . 1.23 110.324 178.07 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -60.76 -62.07 2.12 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.97 -0.559 . . . . 0.46 110.406 174.597 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.82 -25.58 67.28 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.897 0.379 . . . . 0.64 110.629 -177.685 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -60.84 -44.06 97.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.68 -0.691 . . . . 1.61 111.042 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 30.6 mttm -91.73 -13.0 32.36 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.955 0.407 . . . . 1.52 111.017 -177.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 19.5 t -81.73 -29.12 10.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.207 0.527 . . . . 0.35 110.04 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -71.76 -7.76 50.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.436 0.636 . . . . 0.5 110.324 176.738 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -107.68 2.87 24.12 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.237 -0.892 . . . . 1.76 110.378 179.488 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' MET . . . . . 0.466 ' HG2' ' CE1' ' A' ' 41' ' ' TYR . 0.6 OUTLIER -61.77 149.51 84.85 Favored Pre-proline 0 C--O 1.232 0.182 0 CA-C-N 115.669 -0.696 . . . . 0.86 110.676 177.022 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -74.02 90.68 0.96 Allowed 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 121.902 1.734 . . . . 0.67 110.832 175.259 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -63.79 -4.15 2.94 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.996 -0.547 . . . . 2.91 111.736 -175.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -79.06 -34.77 43.42 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.771 -0.649 . . . . 2.7 110.066 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 67.68 93.26 0.08 Allowed 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 114.813 -1.085 . . . . 2.34 109.524 -177.024 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -113.04 118.73 58.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.818 -0.628 . . . . 0.99 110.142 -176.245 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.589 ' HG3' HG22 ' A' ' 36' ' ' THR . 2.4 tt0 -74.28 132.59 42.23 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.676 -0.49 . . . . 1.53 109.676 178.291 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 34.3 mt . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.744 -0.646 . . . . 1.57 110.133 -177.062 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 7.9 p . . . . . 0 N--CA 1.452 -0.368 0 CA-C-O 121.897 0.856 . . . . 0.93 108.696 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -146.43 138.42 24.88 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 114.32 -1.309 . . . . 1.61 108.416 177.934 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.527 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 16.4 t-20 -143.01 122.33 7.6 Favored Pre-proline 0 C--N 1.313 -0.98 0 C-N-CA 120.786 -0.366 . . . . 1.6 110.459 176.595 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -67.39 -46.29 2.97 Favored 'Trans proline' 0 N--CA 1.475 0.439 0 C-N-CA 123.43 2.753 . . . . 1.87 113.351 -177.146 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.8 m -71.81 -39.52 69.79 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.975 -0.557 . . . . 2.18 110.502 -175.147 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.527 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 0.2 OUTLIER -66.38 130.37 94.2 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.338 -0.846 . . . . 2.75 110.005 179.638 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -60.97 156.79 42.11 Favored 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.7 2.267 . . . . 1.38 112.554 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -160.67 63.11 0.29 Allowed Glycine 0 N--CA 1.446 -0.667 0 N-CA-C 110.658 -0.977 . . . . 0.97 110.658 -179.588 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.461 ' HG3' ' CZ2' ' A' ' 96' ' ' TRP . 5.8 mtm-85 -79.53 132.54 36.34 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.848 0.356 . . . . 1.93 110.142 -174.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.4 ttmt -80.33 119.75 23.47 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.104 -0.498 . . . . 2.64 110.438 -173.673 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.758 HG22 ' HG3' ' A' ' 146' ' ' GLU . 0.6 OUTLIER -112.76 160.34 18.06 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.815 -0.354 . . . . 0.68 111.154 178.421 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.486 ' OD1' ' HG3' ' A' ' 141' ' ' PRO . 5.4 t-20 -55.51 -46.56 76.96 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 115.786 -0.643 . . . . 1.47 110.321 176.384 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -54.32 -46.31 72.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.648 -0.706 . . . . 1.04 110.925 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.0 -57.96 10.75 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.643 -0.708 . . . . 0.8 111.561 -177.409 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -70.86 -25.29 62.74 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.066 -0.515 . . . . 1.75 110.79 -176.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.584 ' CE1' ' HG2' ' A' ' 140' ' ' MET . 54.0 t80 -61.85 -62.39 1.83 Allowed 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 116.064 -0.516 . . . . 0.64 110.345 175.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.578 ' O ' HG13 ' A' ' 47' ' ' VAL . 0.1 OUTLIER -59.15 -35.22 73.14 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 120.792 0.33 . . . . 1.13 110.15 -175.329 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -56.75 -54.66 43.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.567 -0.742 . . . . 1.3 111.159 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.454 ' O ' ' HB2' ' A' ' 48' ' ' LYS . 69.5 m-80 -87.02 -28.62 22.51 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.362 0.504 . . . . 0.5 112.362 -177.217 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 74.8 t -89.19 -58.24 3.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 112.3 0.482 . . . . 0.3 112.3 -175.62 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.697 HG22 ' HB3' ' A' ' 136' ' ' LYS . 43.3 t -79.52 -62.67 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 116.482 -0.326 . . . . 0.26 111.359 -170.755 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.578 HG13 ' O ' ' A' ' 42' ' ' MET . 1.5 m -62.92 -33.22 59.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 111.669 0.248 . . . . 0.83 111.669 -175.146 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -67.48 -35.24 78.79 Favored 'General case' 0 CA--C 1.528 0.118 0 C-N-CA 120.936 -0.305 . . . . 2.4 111.488 179.275 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.4 m -74.24 -37.76 63.7 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.78 -0.368 . . . . 0.55 110.51 178.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.716 HD23 HD12 ' A' ' 132' ' ' ILE . 0.1 OUTLIER -66.59 -37.61 85.27 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.255 0.55 . . . . 0.33 109.844 175.253 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 9.7 t-105 -65.41 -25.72 67.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.47 -0.786 . . . . 0.39 111.623 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -89.74 3.16 53.65 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 120.61 -0.436 . . . . 2.24 111.665 -177.107 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.525 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 15.7 t-80 -89.1 129.96 35.63 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.647 -0.501 . . . . 0.39 109.647 175.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -77.97 -3.27 41.1 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.188 0.44 . . . . 1.91 112.188 -172.198 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.525 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 2.1 m-30 -93.05 -10.38 36.36 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.157 0.503 . . . . 0.93 110.114 175.795 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.513 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -92.4 19.93 6.67 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.972 -0.558 . . . . 0.28 110.514 178.788 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.642 ' HA ' ' CE2' ' A' ' 60' ' ' TYR . 44.8 p-90 -67.89 -34.45 6.34 Favored Pre-proline 0 CA--C 1.543 0.675 0 N-CA-C 113.309 0.855 . . . . 0.58 113.309 -175.008 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.601 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 3.4 Cg_exo -82.31 10.15 3.68 Favored 'Trans proline' 0 C--N 1.358 1.055 0 C-N-CA 121.711 1.607 . . . . 0.47 111.203 174.129 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -112.57 -15.65 13.0 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.546 -0.752 . . . . 1.11 111.182 -177.085 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.642 ' CE2' ' HA ' ' A' ' 57' ' ' TRP . 12.5 m-85 -66.6 -28.58 68.61 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.389 0.614 . . . . 0.63 110.147 177.445 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -98.35 116.57 65.48 Favored Pre-proline 0 C--N 1.32 -0.693 0 CA-C-N 115.063 -0.971 . . . . 1.63 110.431 -172.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.653 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 18.0 Cg_endo -62.56 133.08 40.77 Favored 'Trans proline' 0 C--O 1.24 0.597 0 C-N-CA 122.564 2.176 . . . . 0.87 112.52 -178.589 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.401 HG11 ' CD2' ' A' ' 73' ' ' TYR . 5.1 t -62.33 111.14 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 CA-C-O 121.893 0.854 . . . . 0.88 109.846 178.066 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.415 ' HB3' ' HG2' ' A' ' 67' ' ' LYS . 0.2 OUTLIER -122.5 -3.53 8.84 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.684 -1.144 . . . . 1.85 109.717 -175.058 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 74.95 -40.43 0.44 Allowed 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 114.967 -1.015 . . . . 1.29 111.596 -178.004 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.8 mt -86.43 -60.92 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 120.677 0.275 . . . . 1.89 111.25 -176.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.415 ' HG2' ' HB3' ' A' ' 64' ' ' ASP . 6.1 pttt -71.5 -10.6 60.01 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.246 0.462 . . . . 2.99 112.246 -175.342 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.461 HD13 ' HA ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -114.58 -1.57 13.34 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.921 0.391 . . . . 1.66 110.596 175.949 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 52.9 50.33 18.24 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.849 -0.614 . . . . 1.74 111.735 -178.726 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.442 HD11 ' HG ' ' A' ' 68' ' ' LEU . 12.7 mt -120.81 71.07 19.32 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.804 -0.634 . . . . 1.61 109.628 174.702 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.71 -31.47 20.7 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.805 2.337 . . . . 1.3 113.458 -170.77 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.456 ' OD1' ' HG3' ' A' ' 75' ' ' LYS . 0.4 OUTLIER -100.11 10.86 40.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.925 0.393 . . . . 1.97 111.316 -176.763 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.401 ' CD2' HG11 ' A' ' 63' ' ' VAL . 15.8 t80 -63.46 -37.41 87.19 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.073 -0.512 . . . . 1.13 110.266 178.071 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 8.6 m-70 -78.99 -1.11 33.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.678 -0.692 . . . . 0.91 111.415 -175.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.456 ' HG3' ' OD1' ' A' ' 72' ' ' ASP . 13.0 mmtm -96.24 -18.01 20.35 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.216 0.531 . . . . 2.86 110.159 -179.272 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.3 mp -114.82 -45.43 4.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.66 -0.7 . . . . 1.0 110.171 178.493 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 33.3 mm -93.72 116.38 34.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 120.953 0.406 . . . . 0.75 110.116 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.85 -28.41 60.66 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.904 -0.589 . . . . 1.99 111.282 -177.028 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -122.33 85.33 47.4 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 116.23 -0.441 . . . . 2.05 110.842 -177.558 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -68.34 89.95 0.39 Allowed 'Trans proline' 0 CA--C 1.528 0.209 0 C-N-CA 122.527 2.152 . . . . 0.89 112.198 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 10.2 mmt -131.73 157.38 43.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.067 -0.515 . . . . 0.82 110.331 -178.474 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.653 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 1.2 p-10 -151.67 -115.39 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.699 -0.682 . . . . 1.42 109.637 -172.227 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' MET . . . . . 0.421 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 11.6 ttp -129.45 -22.28 3.06 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 121.922 -0.486 . . . . 0.8 110.789 176.572 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -83.3 -25.88 46.0 Favored Glycine 0 N--CA 1.444 -0.816 0 N-CA-C 110.607 -0.997 . . . . 0.32 110.607 179.317 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.442 HG23 ' HB3' ' A' ' 62' ' ' PRO . 0.6 OUTLIER -76.82 -44.86 30.83 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.375 -0.413 . . . . 0.95 110.504 175.76 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.404 HG12 ' HB3' ' A' ' 104' ' ' ASP . 83.6 mt -58.5 -48.68 84.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.732 -0.667 . . . . 0.97 110.257 175.199 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.421 ' HB3' ' O ' ' A' ' 83' ' ' MET . 0.0 OUTLIER -59.6 -32.93 70.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.116 -0.493 . . . . 1.15 110.902 178.397 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 8.6 tppt? -67.4 -50.39 59.81 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 120.601 0.239 . . . . 2.46 110.696 -179.393 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.706 ' HB3' ' CE1' ' A' ' 95' ' ' TYR . 15.2 mtp180 -68.22 -28.25 67.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.911 0.386 . . . . 1.16 110.643 179.29 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 5.8 mt -68.14 -56.59 8.24 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.86 -0.609 . . . . 0.49 111.635 177.586 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -65.92 -26.36 67.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.982 0.42 . . . . 1.39 111.24 -176.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -87.96 -4.68 58.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.989 -0.551 . . . . 1.3 110.715 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 50.63 61.66 3.1 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.739 -0.664 . . . . 1.75 110.766 -176.415 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -85.07 -32.83 22.64 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 115.913 -0.585 . . . . 0.96 111.014 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.706 ' CE1' ' HB3' ' A' ' 89' ' ' ARG . 0.1 OUTLIER -80.71 -145.15 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.797 0.808 . . . . 1.28 110.398 178.885 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 96' ' ' TRP . . . . . 0.461 ' CZ2' ' HG3' ' A' ' 34' ' ' ARG . 2.3 t-105 -126.83 -53.59 1.43 Allowed 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 114.479 -1.237 . . . . 1.05 108.091 174.397 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 12.6 t -133.93 -173.06 3.14 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 115.043 -0.98 . . . . 1.0 110.072 -177.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.81 -5.49 58.24 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.611 0.243 . . . . 0.66 111.345 -177.242 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.45 -41.92 98.65 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.902 0.382 . . . . 0.85 110.552 177.739 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -69.66 -28.68 66.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.332 0.587 . . . . 2.44 109.593 177.789 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 4.2 t -71.77 -30.75 65.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.305 -0.862 . . . . 0.95 110.543 177.26 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.6 ttm -64.89 -40.37 94.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.08 -0.509 . . . . 1.13 109.935 177.637 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.2 -37.37 83.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.73 -0.668 . . . . 2.96 110.123 176.674 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ASP . . . . . 0.404 ' HB3' HG12 ' A' ' 86' ' ' ILE . 1.1 m-20 -58.6 -55.58 33.28 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.601 -0.727 . . . . 1.87 110.509 177.14 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.642 ' HE2' HD12 ' A' ' 50' ' ' LEU . 3.5 m-85 -58.31 -44.58 88.65 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.782 -0.645 . . . . 0.38 110.913 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -56.87 -44.98 82.77 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.28 -0.418 . . . . 0.97 110.294 177.85 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 54.3 m -65.12 -47.53 76.81 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.125 -0.489 . . . . 0.43 111.037 178.585 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.72 -41.57 74.05 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.083 -0.508 . . . . 0.88 111.313 -179.706 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -73.41 -45.79 52.59 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.422 -0.354 . . . . 0.29 110.633 -177.049 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.0 p -63.81 -35.6 81.14 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.607 -0.27 . . . . 0.66 110.871 -179.145 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 49.2 m-20 -46.28 -52.08 13.3 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.638 -0.71 . . . . 1.84 111.348 176.831 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 7.4 t -61.02 -38.42 86.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.451 -0.795 . . . . 0.63 111.085 -178.809 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -75.97 -16.21 60.03 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.336 -0.393 . . . . 0.81 111.71 -175.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 57.1 mt -92.39 -51.66 11.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.95 0.405 . . . . 0.55 110.816 178.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -71.52 -35.6 70.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.841 -0.618 . . . . 1.22 111.654 -175.167 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -105.3 -179.82 4.05 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.912 0.387 . . . . 1.04 110.982 -175.53 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.4 154.83 39.27 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.195 -0.457 . . . . 3.47 110.921 -177.027 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -61.48 -17.8 55.81 Favored 'Trans proline' 0 N--CA 1.476 0.49 0 C-N-CA 122.733 2.289 . . . . 0.96 112.373 177.173 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.16 0.42 51.22 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.832 -0.622 . . . . 1.23 111.515 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -71.43 156.25 39.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.446 0.641 . . . . 1.34 111.734 -173.488 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -69.58 -41.59 75.61 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.91 -1.041 . . . . 1.44 109.884 -179.322 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 3.1 tp -67.46 -28.11 40.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.602 -0.727 . . . . 0.42 110.627 -179.538 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 1.3 t -70.48 -45.61 73.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 109.794 -0.447 . . . . 0.35 109.794 176.465 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.68 -33.23 71.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.668 -0.696 . . . . 0.52 109.736 177.783 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 30.5 mtt -71.15 -46.62 61.12 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.475 -0.784 . . . . 0.62 110.506 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.58 -40.42 75.2 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.253 -0.43 . . . . 0.31 111.481 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -44.96 96.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.468 -0.333 . . . . 1.94 111.217 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -70.68 -36.89 73.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.074 0.464 . . . . 0.32 110.564 178.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.513 HD21 ' HA ' ' A' ' 56' ' ' ALA . 0.6 OUTLIER -64.29 -44.06 92.82 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.567 -0.742 . . . . 0.33 110.667 179.589 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -62.18 -25.91 68.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.744 -0.662 . . . . 1.47 111.349 -178.456 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.46 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 17.0 ttpt -64.25 -42.39 96.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.22 -0.445 . . . . 2.24 110.029 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.716 HD12 HD23 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -77.27 -23.69 14.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.09 -0.505 . . . . 1.23 110.501 -179.625 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.491 ' O ' HG23 ' A' ' 137' ' ' VAL . 30.3 t80 -62.09 -62.1 2.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.074 -0.512 . . . . 0.46 110.168 176.83 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.11 -26.46 68.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.126 0.489 . . . . 0.64 110.205 -178.77 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.46 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.01 -33.66 72.3 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.385 -0.825 . . . . 1.61 111.762 179.314 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 136' ' ' LYS . . . . . 0.697 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -97.96 -25.14 15.09 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.135 0.493 . . . . 1.52 110.597 -179.692 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.517 ' O ' ' HB2' ' A' ' 140' ' ' MET . 53.9 t -69.79 -32.35 51.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.948 -0.569 . . . . 0.35 110.619 179.176 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.59 -16.98 64.03 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.124 -0.489 . . . . 0.5 110.49 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -100.29 0.03 39.37 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.741 -0.663 . . . . 1.76 110.223 -179.395 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' MET . . . . . 0.584 ' HG2' ' CE1' ' A' ' 41' ' ' TYR . 0.1 OUTLIER -71.65 161.2 79.86 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.69 -0.686 . . . . 0.86 110.195 176.903 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 141' ' ' PRO . . . . . 0.486 ' HG3' ' OD1' ' A' ' 37' ' ' ASN . 65.3 Cg_endo -74.7 107.67 2.52 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 121.714 1.609 . . . . 0.67 109.796 173.306 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -72.29 2.39 6.12 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.801 0.334 . . . . 2.91 111.881 -171.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -100.22 -111.52 0.19 Allowed 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 108.652 -0.87 . . . . 2.7 108.652 171.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 178.3 131.35 0.07 Allowed 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.606 -0.887 . . . . 2.34 108.606 173.164 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 2.8 t -129.04 94.05 2.27 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.705 -0.48 . . . . 0.99 109.705 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.758 ' HG3' HG22 ' A' ' 36' ' ' THR . 4.8 tt0 -67.99 146.28 53.7 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 110.148 -0.316 . . . . 1.53 110.148 177.634 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 9.8 mt . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.427 -0.797 . . . . 1.57 110.133 -178.598 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.471 ' O ' ' HB2' ' A' ' 94' ' ' TYR . 5.1 p . . . . . 0 N--CA 1.445 -0.686 0 CA-C-O 121.49 0.662 . . . . 0.93 109.216 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -160.52 142.14 12.38 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.305 -0.861 . . . . 1.61 109.053 175.591 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.45 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 23.0 t-20 -134.92 127.12 18.16 Favored Pre-proline 0 C--N 1.316 -0.871 0 CA-C-O 120.639 0.257 . . . . 1.6 110.57 -179.661 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -72.97 -44.89 0.52 Allowed 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 122.837 2.358 . . . . 1.87 112.344 175.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.0 m -74.15 -38.22 63.81 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.743 -0.662 . . . . 2.18 110.719 -175.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.45 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 0.2 OUTLIER -85.78 130.31 51.22 Favored Pre-proline 0 C--N 1.322 -0.612 0 N-CA-C 109.055 -0.72 . . . . 2.75 109.055 177.183 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.448 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 18.6 Cg_endo -57.5 137.8 83.14 Favored 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.794 2.329 . . . . 1.38 112.907 -175.897 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -150.67 84.66 0.16 Allowed Glycine 0 N--CA 1.446 -0.656 0 CA-C-N 114.775 -1.102 . . . . 0.97 110.503 -178.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -100.78 -177.84 3.59 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.101 0.477 . . . . 1.93 111.338 -172.277 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.3 ttmt -123.76 100.0 6.56 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.712 -0.676 . . . . 2.64 110.09 177.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.542 HG22 ' HG3' ' A' ' 146' ' ' GLU . 18.0 p -101.13 173.94 6.23 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 116.41 -0.359 . . . . 0.68 110.042 175.761 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.439 ' HB3' ' O ' ' A' ' 145' ' ' VAL . 0.0 OUTLIER -65.68 -38.4 89.18 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.252 -0.431 . . . . 1.47 110.598 178.779 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.512 ' HB2' ' CD ' ' A' ' 144' ' ' GLU . 1.4 tt0 -62.9 -42.77 99.89 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 120.619 0.247 . . . . 1.04 110.856 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.432 ' HB2' ' HA ' ' A' ' 97' ' ' SER . 0.8 OUTLIER -61.07 -54.09 49.03 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.165 -0.471 . . . . 0.8 110.601 179.917 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.3 mm-40 -63.36 -35.55 80.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.988 -0.551 . . . . 1.75 110.781 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -58.39 -64.05 1.06 Allowed 'General case' 0 C--O 1.217 -0.641 0 CA-C-N 116.181 -0.463 . . . . 0.64 110.359 177.782 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.569 ' SD ' ' HB3' ' A' ' 101' ' ' CYS . 3.3 ttm -60.15 -32.84 71.42 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.414 -0.217 . . . . 1.13 110.414 -174.479 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -59.31 -58.11 10.06 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.904 -0.589 . . . . 1.3 111.056 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.4 m-80 -86.19 -28.04 24.14 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.146 -0.479 . . . . 0.5 112.054 -175.213 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.422 HG12 ' HD3' ' A' ' 136' ' ' LYS . 95.7 t -88.63 -56.57 5.06 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.926 0 CA-C-N 116.093 -0.503 . . . . 0.3 111.641 -176.823 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.507 HG23 ' HA ' ' A' ' 42' ' ' MET . 92.5 t -80.08 -65.74 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.395 -0.366 . . . . 0.26 111.892 -170.703 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -63.57 -34.45 67.69 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 C-N-CA 120.601 -0.439 . . . . 0.83 111.526 -174.425 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.89 -32.0 73.25 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.935 -0.306 . . . . 2.4 111.442 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 51.1 m -75.64 -37.5 59.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.842 0.353 . . . . 0.55 110.329 177.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.629 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -63.56 -40.81 97.94 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.162 -0.681 . . . . 0.33 109.162 174.031 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 12.4 t-105 -59.12 -37.56 77.51 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.115 -0.948 . . . . 0.39 111.494 178.408 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 14.3 mttm -88.86 9.27 25.37 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.178 0.436 . . . . 2.24 112.178 -175.17 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 16.3 t-80 -79.51 144.98 33.46 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.422 -0.584 . . . . 0.39 109.422 174.254 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -79.9 -12.75 59.72 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.616 0.246 . . . . 1.91 111.543 -174.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 3.7 m-30 -99.43 -8.16 25.12 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.992 0.425 . . . . 0.93 110.653 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.434 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -95.36 16.34 17.07 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.084 0.469 . . . . 0.28 110.808 -179.153 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.447 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 60.3 p-90 -62.38 -34.14 14.14 Favored Pre-proline 0 CA--C 1.548 0.867 0 N-CA-C 114.282 1.216 . . . . 0.58 114.282 -174.577 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.447 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 59.4 Cg_endo -90.58 9.88 3.05 Favored 'Trans proline' 0 C--N 1.36 1.148 0 CA-C-N 121.204 1.466 . . . . 0.47 112.866 -178.91 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -106.39 6.97 30.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.184 -0.462 . . . . 1.11 110.88 -177.198 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.8 m-30 -75.66 -24.87 56.4 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.212 -0.449 . . . . 0.63 111.966 -175.103 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -100.16 128.15 31.43 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 116.482 -0.326 . . . . 1.63 111.325 -171.822 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.499 ' HA ' ' OD2' ' A' ' 82' ' ' ASP . 27.0 Cg_endo -63.12 133.22 39.91 Favored 'Trans proline' 0 C--O 1.236 0.424 0 C-N-CA 122.667 2.244 . . . . 0.87 111.482 178.037 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.7 t -59.62 110.48 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 122.189 0.995 . . . . 0.88 111.676 -178.007 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -121.17 125.89 48.3 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 113.848 -1.524 . . . . 1.85 106.977 167.525 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.561 ' HB2' ' NE2' ' A' ' 74' ' ' HIS . . . -63.09 -12.49 27.26 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.62 0.6 . . . . 1.29 112.62 -170.13 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.9 mp -106.58 -42.44 6.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 120.84 0.352 . . . . 1.89 110.497 -177.699 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 36.1 tptt -67.09 -44.12 80.81 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.056 -0.52 . . . . 2.99 111.076 179.474 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.767 ' HB3' HD22 ' A' ' 70' ' ' LEU . 0.2 OUTLIER -97.54 -3.77 39.12 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.374 -0.375 . . . . 1.66 110.693 -179.123 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 53.37 63.04 2.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.607 -0.724 . . . . 1.74 110.689 -176.042 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.767 HD22 ' HB3' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -119.81 70.09 13.58 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 115.749 -0.66 . . . . 1.61 110.235 -179.037 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.79 -24.78 8.34 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.388 2.059 . . . . 1.3 112.622 -175.733 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -96.76 -8.18 31.9 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.004 0.43 . . . . 1.97 110.708 -178.879 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.578 ' O ' ' HB ' ' A' ' 77' ' ' ILE . 17.6 t80 -61.91 -40.17 94.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.762 -0.654 . . . . 1.13 110.208 178.209 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' HIS . . . . . 0.561 ' NE2' ' HB2' ' A' ' 65' ' ' ALA . 9.5 m-70 -80.33 3.82 19.83 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.877 -0.601 . . . . 0.91 111.174 -178.336 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -108.16 -50.12 3.09 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.032 0.444 . . . . 2.86 110.114 179.042 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.0 mt -78.71 -36.95 20.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.74 -0.664 . . . . 1.0 110.692 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.578 ' HB ' ' O ' ' A' ' 73' ' ' TYR . 28.1 mm -99.79 135.6 34.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.903 -0.59 . . . . 0.75 109.819 -178.794 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.66 -40.64 14.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.813 0.339 . . . . 1.99 111.019 -176.571 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 10.1 m-20 -113.26 95.73 36.5 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.196 -0.456 . . . . 2.05 110.03 177.702 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -68.59 92.87 0.42 Allowed 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.924 2.416 . . . . 0.89 112.306 -178.566 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 13.3 mmt -135.79 167.28 21.46 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.121 -0.49 . . . . 0.82 110.633 -178.426 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.499 ' OD2' ' HA ' ' A' ' 62' ' ' PRO . 3.0 p-10 -151.49 -123.19 0.04 OUTLIER 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.044 -0.98 . . . . 1.42 108.788 -177.912 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -125.31 -17.77 5.55 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.082 0.467 . . . . 0.8 110.301 177.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.459 ' O ' ' HB2' ' A' ' 88' ' ' LYS . . . -88.65 -23.97 34.57 Favored Glycine 0 N--CA 1.44 -1.088 0 N-CA-C 110.304 -1.118 . . . . 0.32 110.304 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -76.89 -39.98 49.08 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.332 -0.434 . . . . 0.95 110.442 175.686 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.606 HG23 ' SG ' ' A' ' 101' ' ' CYS . 38.9 mt -59.8 -49.09 85.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.707 -0.679 . . . . 0.97 110.369 176.764 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.421 ' HG3' ' O ' ' A' ' 84' ' ' GLY . 0.2 OUTLIER -67.14 -28.94 68.55 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.367 -0.379 . . . . 1.15 110.682 179.138 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.459 ' HB2' ' O ' ' A' ' 84' ' ' GLY . 11.1 tttt -64.89 -41.73 95.38 Favored 'General case' 0 N--CA 1.457 -0.089 0 CA-C-O 121.049 0.452 . . . . 2.46 110.691 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 10.0 mtp180 -75.25 -32.35 61.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.012 -0.54 . . . . 1.16 110.68 178.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 8.1 mt -63.52 -53.17 56.09 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.863 -0.608 . . . . 0.49 111.167 178.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -66.79 -30.38 70.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.079 -0.51 . . . . 1.39 111.211 -176.158 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 12.4 m-80 -84.15 0.0 50.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.151 -0.477 . . . . 1.3 111.184 -177.102 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 60.52 50.97 5.42 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.705 0.628 . . . . 1.75 111.393 178.86 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' TYR . . . . . 0.471 ' HB2' ' O ' ' A' ' 26' ' ' VAL . 61.3 t80 -82.87 -33.59 26.99 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.082 -0.508 . . . . 0.96 111.193 179.279 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.689 ' CD1' ' HB3' ' A' ' 100' ' ' GLU . 41.0 m-85 -90.78 169.45 10.94 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 121.541 0.686 . . . . 1.28 111.607 -176.148 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' TRP . . . . . 0.448 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 2.0 t90 -88.3 -44.7 10.62 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 114.526 -1.215 . . . . 1.05 109.2 169.314 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.432 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 35.3 t -152.12 177.18 10.77 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.139 -0.937 . . . . 1.0 110.224 -172.477 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -69.29 -18.05 63.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.928 0.394 . . . . 0.66 111.284 -177.461 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.57 -18.44 64.87 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.075 -0.511 . . . . 0.85 110.874 178.332 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.689 ' HB3' ' CD1' ' A' ' 95' ' ' TYR . 1.5 mt-10 -86.32 -39.95 15.96 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 109.435 -0.58 . . . . 2.44 109.435 177.778 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.606 ' SG ' HG23 ' A' ' 86' ' ' ILE . 0.1 OUTLIER -68.58 -30.84 69.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.432 -0.804 . . . . 0.95 110.758 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 9.6 ttm -56.78 -33.43 66.63 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.031 -0.532 . . . . 1.13 110.595 177.588 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -66.28 -41.35 89.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.847 -0.615 . . . . 2.96 110.539 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -76.51 -38.91 54.44 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.089 -0.505 . . . . 1.87 110.494 -178.578 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.629 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -59.7 -47.0 87.36 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.159 -0.473 . . . . 0.38 110.194 177.06 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -57.53 -47.1 82.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.852 -0.613 . . . . 0.97 109.823 175.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 89.1 m -59.95 -50.15 74.88 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.657 -0.701 . . . . 0.43 111.077 179.231 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.03 -41.69 68.33 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 122.594 0.357 . . . . 0.88 111.496 -178.532 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -70.31 -47.5 60.84 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.0 0.429 . . . . 0.29 110.043 -177.383 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 38.1 p -66.63 -30.52 70.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.883 -0.599 . . . . 0.66 111.144 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 23.3 m-20 -54.9 -45.54 74.72 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-O 121.188 0.518 . . . . 1.84 110.127 178.204 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 18.6 t -61.76 -41.5 97.76 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.252 -0.885 . . . . 0.63 110.808 179.056 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' TYR . . . . . 0.492 ' HD1' HG22 ' A' ' 123' ' ' VAL . 22.8 m-85 -71.16 -22.96 61.98 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.168 -0.469 . . . . 0.81 111.531 -176.633 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 51.7 mt -93.15 -52.3 10.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.968 0.413 . . . . 0.55 111.609 -179.01 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -66.31 -35.31 80.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.685 -0.689 . . . . 1.22 111.474 -173.698 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -106.49 -174.41 2.53 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.119 -0.491 . . . . 1.04 110.73 -176.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' LYS . . . . . 0.45 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 0.0 OUTLIER -80.93 145.73 57.83 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 116.585 -0.28 . . . . 3.47 110.257 178.978 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -64.29 -9.08 18.55 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.671 2.248 . . . . 0.96 112.628 179.394 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.35 26.68 7.28 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.037 -0.528 . . . . 1.23 110.369 177.154 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 0.4 OUTLIER -84.18 171.35 12.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.499 . . . . 1.34 111.197 -177.518 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -65.03 -53.05 51.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.745 -0.661 . . . . 1.44 110.607 -177.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 3.1 tp -63.97 -29.61 47.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.629 -0.714 . . . . 0.42 111.104 -178.018 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.492 HG22 ' HD1' ' A' ' 113' ' ' TYR . 2.0 t -70.35 -43.62 78.19 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-O 121.085 0.469 . . . . 0.35 110.02 177.104 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.32 -37.29 74.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.508 -0.769 . . . . 0.52 109.55 177.315 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 125' ' ' MET . . . . . 0.495 ' O ' HD13 ' A' ' 129' ' ' LEU . 33.1 mtt -70.54 -45.68 65.05 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.179 -0.919 . . . . 0.62 110.825 178.485 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.84 -34.91 63.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 0.31 111.973 -178.619 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.39 -47.06 85.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.69 -0.232 . . . . 1.94 111.054 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -70.81 -39.27 73.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.061 0.457 . . . . 0.32 110.606 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.495 HD13 ' O ' ' A' ' 125' ' ' MET . 4.7 mp -56.9 -41.37 77.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.431 -0.804 . . . . 0.33 110.491 177.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -59.82 -30.34 68.86 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.281 -0.872 . . . . 1.47 112.355 -178.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.517 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 9.3 mmtp -63.25 -49.1 75.45 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 120.629 0.252 . . . . 2.24 110.605 -171.26 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -72.49 -24.57 21.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.359 -0.382 . . . . 1.23 110.86 -179.53 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.463 ' O ' HG23 ' A' ' 137' ' ' VAL . 26.4 t80 -63.16 -62.58 1.6 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.247 -0.433 . . . . 0.46 110.564 178.165 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.59 -22.75 62.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.888 0.375 . . . . 0.64 110.689 -175.73 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.517 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -65.03 -51.16 63.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.849 -0.614 . . . . 1.61 110.447 179.798 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 136' ' ' LYS . . . . . 0.422 ' HD3' HG12 ' A' ' 45' ' ' VAL . 40.8 mttt -80.8 -15.31 56.74 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.058 -0.519 . . . . 1.52 111.146 -175.816 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 133' ' ' PHE . 38.8 t -80.49 -35.22 15.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.227 -0.442 . . . . 0.35 110.083 177.762 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -69.51 -11.17 60.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.215 0.531 . . . . 0.5 110.793 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -97.48 -8.63 28.81 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.84 -0.618 . . . . 1.76 110.616 179.06 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -71.71 139.66 83.51 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 116.094 -0.503 . . . . 0.86 111.018 -177.465 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -72.0 98.43 0.9 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.653 2.235 . . . . 0.67 111.969 177.504 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.66 -8.45 56.04 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.014 0.435 . . . . 2.91 110.604 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -66.81 -35.46 80.11 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.082 -0.71 . . . . 2.7 109.082 174.084 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.512 ' CD ' ' HB2' ' A' ' 38' ' ' GLN . 0.0 OUTLIER 74.72 143.17 0.07 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 114.037 -1.438 . . . . 2.34 112.651 174.31 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 145' ' ' VAL . . . . . 0.439 ' O ' ' HB3' ' A' ' 37' ' ' ASN . 2.9 t -140.62 104.16 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-N 114.321 -1.309 . . . . 0.99 108.86 176.025 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.542 ' HG3' HG22 ' A' ' 36' ' ' THR . 16.8 tt0 -72.29 141.32 48.88 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.877 -0.416 . . . . 1.53 109.877 178.805 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 34.8 mt . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.495 -0.764 . . . . 1.57 109.829 -178.543 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.452 -0.331 0 CA-C-O 121.257 0.551 . . . . 0.93 110.218 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.2 m -156.21 138.92 15.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.502 -0.772 . . . . 1.61 109.204 178.758 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.493 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 19.6 t-20 -144.5 138.01 14.27 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-O 120.696 0.284 . . . . 1.6 110.412 178.694 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -69.94 -48.25 0.72 Allowed 'Trans proline' 0 CA--C 1.531 0.366 0 C-N-CA 123.138 2.559 . . . . 1.87 113.287 177.733 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.513 ' O ' ' HD3' ' A' ' 32' ' ' PRO . 28.2 t -77.1 -33.07 57.01 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.952 0.406 . . . . 2.18 110.729 -175.368 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.493 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 0.6 OUTLIER -92.01 104.22 10.11 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.82 -0.627 . . . . 2.75 109.85 177.981 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.513 ' HD3' ' O ' ' A' ' 30' ' ' SER . 16.2 Cg_exo -68.64 154.13 72.05 Favored 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 122.69 2.26 . . . . 1.38 112.845 -177.583 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -131.27 121.85 3.29 Favored Glycine 0 N--CA 1.441 -0.973 0 N-CA-C 110.291 -1.124 . . . . 0.97 110.291 178.607 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.479 ' HG3' ' CE2' ' A' ' 96' ' ' TRP . 1.5 mmm180 -131.47 171.91 12.83 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.895 0.379 . . . . 1.93 110.576 -174.289 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.485 ' HA ' HD22 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -108.94 103.32 12.34 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.105 -0.498 . . . . 2.64 110.134 179.341 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.687 HG22 ' HG3' ' A' ' 146' ' ' GLU . 23.9 p -109.05 170.18 8.21 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.182 -0.463 . . . . 0.68 111.066 178.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.444 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 55.6 t30 -62.67 -49.78 73.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.964 -0.562 . . . . 1.47 110.8 -179.576 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.8 tt0 -61.6 -37.43 83.88 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 120.689 0.281 . . . . 1.04 110.781 -179.116 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.779 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.6 OUTLIER -61.2 -59.2 5.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.932 -0.576 . . . . 0.8 110.884 -179.954 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -67.37 -29.44 68.97 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 116.081 -0.509 . . . . 1.75 110.742 -178.467 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.444 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 44.7 t80 -60.63 -63.39 1.32 Allowed 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.796 -0.638 . . . . 0.64 110.872 177.06 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.493 ' O ' HG12 ' A' ' 47' ' ' VAL . 23.6 ttp -61.04 -28.62 69.19 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.851 0.358 . . . . 1.13 110.358 -173.217 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.536 ' HB2' HD22 ' A' ' 90' ' ' LEU . 12.4 tt0 -61.41 -58.48 8.02 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.54 -0.755 . . . . 1.3 111.273 177.159 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -86.01 -26.59 25.33 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.364 -0.38 . . . . 0.5 111.777 -175.11 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.685 HG12 ' HG2' ' A' ' 136' ' ' LYS . 93.6 t -89.37 -57.84 3.94 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 N-CA-C 112.382 0.512 . . . . 0.3 112.382 -176.68 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.794 HG22 ' HB3' ' A' ' 136' ' ' LYS . 67.9 t -81.82 -66.59 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 112.016 0.376 . . . . 0.26 112.016 -170.385 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.493 HG12 ' O ' ' A' ' 42' ' ' MET . 0.9 OUTLIER -66.43 -34.21 68.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 120.477 -0.489 . . . . 0.83 111.298 -174.016 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.461 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -59.53 -38.04 79.95 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 121.012 -0.275 . . . . 2.4 111.437 178.456 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.7 m -74.6 -35.83 62.97 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.865 -0.334 . . . . 0.55 110.711 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.62 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -67.26 -33.86 76.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.266 0.555 . . . . 0.33 109.574 176.767 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 18.2 t-105 -65.06 -31.18 72.27 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.472 -0.786 . . . . 0.39 110.877 177.195 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.461 ' HG3' ' O ' ' A' ' 48' ' ' LYS . 13.6 mtpp -83.65 14.87 3.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.888 0.375 . . . . 2.24 111.646 -176.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.432 ' CD2' HD11 ' A' ' 132' ' ' ILE . 4.6 t-80 -98.82 128.43 45.03 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.095 -0.705 . . . . 0.39 109.095 173.914 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.415 ' NE2' ' HA ' ' A' ' 54' ' ' GLN . 0.0 OUTLIER -85.57 9.74 15.15 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.698 -0.401 . . . . 1.91 111.797 -173.991 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -103.35 -6.95 21.43 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.26 -0.644 . . . . 0.93 109.26 170.733 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.517 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -94.64 14.99 19.29 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.43 -0.804 . . . . 0.28 110.11 177.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.567 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 48.9 p-90 -66.92 -34.54 7.57 Favored Pre-proline 0 CA--C 1.544 0.74 0 N-CA-C 113.467 0.914 . . . . 0.58 113.467 -175.658 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.567 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 7.6 Cg_exo -73.79 -2.67 12.55 Favored 'Trans proline' 0 C--N 1.364 1.357 0 CA-C-N 121.108 1.431 . . . . 0.47 111.512 177.379 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.439 ' HB3' ' HB2' ' A' ' 83' ' ' MET . 1.9 m-85 -105.64 0.16 26.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.824 -0.626 . . . . 1.11 110.462 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 6.2 m-30 -66.47 -40.47 89.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.331 0.586 . . . . 0.63 110.88 -178.621 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.64 129.48 28.76 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-N 115.467 -0.788 . . . . 1.63 110.179 -176.587 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.572 ' HA ' ' OD2' ' A' ' 82' ' ' ASP . 19.5 Cg_endo -59.95 147.12 94.03 Favored 'Trans proline' 0 C--O 1.238 0.512 0 C-N-CA 122.964 2.443 . . . . 0.87 113.475 -176.233 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.411 ' O ' HG12 ' A' ' 63' ' ' VAL . 2.5 t -86.84 98.88 7.56 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 N-CA-C 108.408 -0.96 . . . . 0.88 108.408 177.674 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -109.78 12.12 24.14 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 114.812 -1.085 . . . . 1.85 110.896 -174.328 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 77.93 -17.55 0.56 Allowed 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 114.721 -1.127 . . . . 1.29 112.526 177.079 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.6 mt -109.29 -49.11 7.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 120.811 0.339 . . . . 1.89 110.762 -177.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.6 ttmm -56.96 -43.38 81.53 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.96 -0.563 . . . . 2.99 110.95 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.585 ' HB3' HD22 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -95.2 0.99 54.56 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.038 -0.528 . . . . 1.66 111.086 179.043 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 53.16 60.43 3.76 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 109.106 -0.701 . . . . 1.74 109.106 -174.099 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.585 HD22 ' HB3' ' A' ' 68' ' ' LEU . 0.4 OUTLIER -128.6 66.07 73.52 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 115.497 -0.774 . . . . 1.61 111.662 -170.124 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -77.49 -27.79 6.03 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.186 1.924 . . . . 1.3 111.828 177.649 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -76.83 -23.99 52.74 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.591 -0.731 . . . . 1.97 110.448 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.46 -43.59 93.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.452 -0.795 . . . . 1.13 110.468 178.254 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -77.66 6.31 7.56 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.254 -0.885 . . . . 0.91 111.195 -175.323 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -108.93 -57.98 2.08 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 120.869 0.366 . . . . 2.86 110.046 -179.801 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 26.9 mt -73.45 -42.7 56.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.835 -0.62 . . . . 1.0 110.852 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.487 HD11 ' HB2' ' A' ' 115' ' ' TYR . 27.1 mm -87.54 126.39 41.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.188 0.518 . . . . 0.75 110.004 -178.782 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.05 -53.99 45.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.515 -0.766 . . . . 1.99 110.879 -176.67 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.742 ' HB2' HG21 ' A' ' 107' ' ' THR . 0.3 OUTLIER -120.48 95.3 49.02 Favored Pre-proline 0 C--N 1.324 -0.539 0 N-CA-C 109.75 -0.463 . . . . 2.05 109.75 178.01 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -67.87 100.25 0.6 Allowed 'Trans proline' 0 CA--C 1.528 0.206 0 C-N-CA 122.19 1.926 . . . . 0.89 111.775 178.592 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.81 159.64 34.22 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.449 0.642 . . . . 0.82 111.428 -176.234 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.572 ' OD2' ' HA ' ' A' ' 62' ' ' PRO . 2.3 p-10 -136.99 -116.21 0.16 Allowed 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.383 -1.281 . . . . 1.42 108.649 -177.739 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' MET . . . . . 0.439 ' HB2' ' HB3' ' A' ' 59' ' ' PHE . 3.5 ttp -132.71 -19.51 2.34 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.795 0.331 . . . . 0.8 110.645 176.045 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -84.1 -29.13 31.97 Favored Glycine 0 N--CA 1.442 -0.905 0 N-CA-C 110.556 -1.018 . . . . 0.32 110.556 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.19 -39.01 68.93 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.925 0.393 . . . . 0.95 110.492 176.596 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.513 HG23 ' SG ' ' A' ' 101' ' ' CYS . 62.1 mt -59.76 -50.41 80.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.559 -0.746 . . . . 0.97 110.304 177.015 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.505 ' O ' ' HG2' ' A' ' 91' ' ' GLU . 0.0 OUTLIER -70.6 -21.9 62.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.337 -0.392 . . . . 1.15 111.37 -178.6 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.533 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 12.5 tppt? -65.09 -42.6 93.93 Favored 'General case' 0 CA--C 1.526 0.043 0 CA-C-O 120.714 0.292 . . . . 2.46 110.765 179.683 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.484 HH21 ' HE2' ' A' ' 94' ' ' TYR . 63.4 mtp180 -68.26 -32.33 72.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.96 0.409 . . . . 1.16 110.456 176.8 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.63 ' HG ' ' OH ' ' A' ' 95' ' ' TYR . 4.7 mt -69.13 -59.72 2.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.543 -0.753 . . . . 0.49 111.662 -177.195 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.505 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 16.6 pt-20 -73.95 -15.98 61.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.044 -0.526 . . . . 1.39 111.819 -173.031 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.533 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 0.9 OUTLIER -94.9 -3.39 48.79 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.997 -0.281 . . . . 1.3 110.363 176.962 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 52.3 57.43 6.46 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.653 -0.703 . . . . 1.75 111.186 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' TYR . . . . . 0.484 ' HE2' HH21 ' A' ' 89' ' ' ARG . 27.6 t80 -75.7 -48.91 19.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.322 -0.399 . . . . 0.96 110.888 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.63 ' OH ' ' HG ' ' A' ' 90' ' ' LEU . 0.1 OUTLIER -97.92 177.65 5.37 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.211 0.529 . . . . 1.28 111.212 -175.212 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 96' ' ' TRP . . . . . 0.479 ' CE2' ' HG3' ' A' ' 34' ' ' ARG . 1.9 t-105 -77.92 -48.03 17.28 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.277 -0.874 . . . . 1.05 110.761 -179.779 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 17.3 t -142.42 168.47 19.66 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.862 0.363 . . . . 1.0 110.892 -173.202 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.779 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -78.23 -11.71 59.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.033 -0.53 . . . . 0.66 111.613 -175.21 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.98 -27.39 66.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.002 0.43 . . . . 0.85 110.581 178.589 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.98 -36.19 59.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.073 -0.512 . . . . 2.44 110.245 177.537 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.513 ' SG ' HG23 ' A' ' 86' ' ' ILE . 0.5 OUTLIER -70.75 -19.81 62.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 0.95 110.897 179.678 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.582 ' HE1' HG22 ' A' ' 137' ' ' VAL . 11.3 mmt -55.95 -26.12 46.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.191 0.519 . . . . 1.13 110.144 173.747 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.16 -39.88 60.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.751 -0.659 . . . . 2.96 109.995 176.945 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.88 -53.98 51.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.817 -0.629 . . . . 1.87 110.345 178.548 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.62 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.6 OUTLIER -57.26 -47.7 80.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.497 -0.774 . . . . 0.38 110.605 -179.934 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -56.85 -44.01 81.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.787 -0.642 . . . . 0.97 110.256 177.133 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' THR . . . . . 0.742 HG21 ' HB2' ' A' ' 79' ' ' ASN . 90.5 m -64.3 -47.47 79.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.02 -0.537 . . . . 0.43 111.317 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.402 ' HG3' ' O ' ' A' ' 82' ' ' ASP . 0.3 OUTLIER -51.12 -44.4 61.34 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.734 0.302 . . . . 0.88 111.011 179.298 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -72.68 -47.55 46.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.02 -0.536 . . . . 0.29 110.953 -177.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.4 p -64.75 -37.5 87.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.46 -0.336 . . . . 0.66 110.91 -178.453 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ASN . . . . . 0.467 ' OD1' HG13 ' A' ' 77' ' ' ILE . 0.4 OUTLIER -54.33 -45.43 72.67 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.803 -0.635 . . . . 1.84 110.32 178.1 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 112' ' ' CYS . . . . . 0.588 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 1.2 m -60.93 -40.58 93.78 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.948 -0.569 . . . . 0.63 110.813 176.328 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -74.6 -19.7 60.21 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.265 -0.425 . . . . 0.81 111.094 -176.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 68.0 mt -93.42 -61.41 2.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.49 -0.323 . . . . 0.55 111.557 -179.376 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' TYR . . . . . 0.487 ' HB2' HD11 ' A' ' 77' ' ' ILE . 43.2 t80 -68.89 -49.62 56.68 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.062 0.458 . . . . 1.22 110.446 -175.65 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' ASN . . . . . 0.588 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 14.0 m120 -80.02 167.58 20.27 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.654 -0.703 . . . . 1.04 110.214 177.848 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 117' ' ' LYS . . . . . 0.484 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 6.4 mttp -98.0 160.73 27.7 Favored Pre-proline 0 C--N 1.318 -0.769 0 N-CA-C 109.739 -0.467 . . . . 3.47 109.739 177.412 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' PRO . . . . . 0.691 ' HA ' HG11 ' A' ' 123' ' ' VAL . 18.9 Cg_endo -61.51 -13.63 30.56 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.474 2.116 . . . . 0.96 111.762 175.473 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.82 -4.11 44.39 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.251 -0.886 . . . . 1.23 111.284 178.873 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' ASP . . . . . 0.484 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 1.9 m-20 -74.06 148.3 42.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.987 0.422 . . . . 1.34 110.471 -176.724 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.77 -43.56 98.6 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.612 -0.722 . . . . 1.44 111.105 -175.537 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 2.0 tp -66.4 -33.1 61.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.874 -0.603 . . . . 0.42 111.291 -178.359 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.691 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.1 t -66.09 -42.06 90.69 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.109 0.48 . . . . 0.35 109.792 178.896 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.81 -32.14 70.37 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.549 -0.75 . . . . 0.52 110.05 178.242 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' MET . . . . . 0.505 ' O ' HD13 ' A' ' 129' ' ' LEU . 11.2 mtt -79.24 -46.07 18.54 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.591 -0.731 . . . . 0.62 110.518 177.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -55.46 -41.69 73.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.361 -0.381 . . . . 0.31 111.711 -178.193 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.66 -31.79 73.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.801 0.334 . . . . 1.94 111.235 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -78.06 -38.88 43.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.094 0.473 . . . . 0.32 110.121 176.302 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.517 HD21 ' HA ' ' A' ' 56' ' ' ALA . 2.2 mp -59.47 -42.46 92.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.414 -0.812 . . . . 0.33 110.172 177.206 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -52.16 -29.36 21.79 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 114.953 -1.021 . . . . 1.47 112.867 -176.861 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.509 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.1 OUTLIER -60.64 -44.21 96.64 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 120.667 0.27 . . . . 2.24 110.757 -173.955 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.44 ' H ' HG13 ' A' ' 132' ' ' ILE . 0.4 OUTLIER -77.77 -23.61 14.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.159 -0.473 . . . . 1.23 111.105 -176.449 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.553 ' O ' HG23 ' A' ' 137' ' ' VAL . 34.1 t80 -65.92 -63.05 1.17 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.504 -0.316 . . . . 0.46 110.578 -179.597 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.446 ' H ' ' HG ' ' A' ' 134' ' ' LEU . 0.4 OUTLIER -68.97 -21.74 64.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.948 0.404 . . . . 0.64 110.657 -176.298 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.509 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -68.01 -45.47 73.94 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.697 -0.683 . . . . 1.61 110.185 178.089 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 136' ' ' LYS . . . . . 0.794 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -79.25 -28.51 42.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.042 -0.526 . . . . 1.52 111.082 -179.216 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.582 HG22 ' HE1' ' A' ' 102' ' ' MET . 54.2 t -65.08 -34.47 70.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.135 0.493 . . . . 0.35 110.573 178.019 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.79 -12.61 61.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.308 0.575 . . . . 0.5 110.509 177.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -105.02 0.37 27.59 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.765 -0.652 . . . . 1.76 110.343 179.013 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 140' ' ' MET . . . . . 0.472 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 11.3 mtp -75.74 141.73 72.57 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.955 -0.566 . . . . 0.86 110.924 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -73.44 92.43 0.85 Allowed 'Trans proline' 0 N--CA 1.462 -0.355 0 C-N-CA 122.324 2.016 . . . . 0.67 110.964 177.206 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -74.24 -1.65 21.5 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.042 -0.526 . . . . 2.91 111.648 -173.465 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -82.1 -39.37 23.45 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.65 -0.5 . . . . 2.7 109.65 175.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 72.93 134.23 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 114.504 -1.226 . . . . 2.34 111.697 178.051 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 34.4 t -142.49 112.24 2.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.299 -0.864 . . . . 0.99 109.14 179.123 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.687 ' HG3' HG22 ' A' ' 36' ' ' THR . 31.1 tt0 -63.13 138.51 58.57 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.719 -0.392 . . . . 1.53 110.396 179.463 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 96.5 mt . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.528 -0.749 . . . . 1.57 110.618 -174.03 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.4 p . . . . . 0 N--CA 1.453 -0.303 0 CA-C-O 121.718 0.77 . . . . 0.93 109.235 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.4 m -162.97 135.38 5.4 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 114.979 -1.01 . . . . 1.61 109.375 175.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.427 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 23.4 t-20 -126.94 125.86 24.3 Favored Pre-proline 0 C--N 1.321 -0.633 0 N-CA-C 109.742 -0.466 . . . . 1.6 109.742 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -66.06 -46.63 4.36 Favored 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 123.057 2.505 . . . . 1.87 113.017 -176.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.8 m -77.93 -22.02 50.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.987 0.422 . . . . 2.18 110.97 -176.119 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.427 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 4.6 ttmt -81.94 113.38 42.64 Favored Pre-proline 0 C--N 1.325 -0.484 0 N-CA-C 109.172 -0.677 . . . . 2.75 109.172 173.783 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.457 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 12.6 Cg_exo -65.34 147.17 87.28 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 121.778 1.652 . . . . 1.38 111.767 -179.234 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -127.81 130.27 6.66 Favored Glycine 0 N--CA 1.442 -0.913 0 CA-C-N 115.417 -0.811 . . . . 0.97 111.197 -176.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 34' ' ' ARG . 1.1 ttp180 -140.3 -179.96 6.3 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 120.975 0.417 . . . . 1.93 110.167 -178.4 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.3 106.06 10.76 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.835 -0.62 . . . . 2.64 109.602 177.565 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.524 HG22 ' HG3' ' A' ' 146' ' ' GLU . 1.3 p -109.14 166.68 10.67 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 120.711 -0.396 . . . . 0.68 110.281 175.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.667 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 0.2 OUTLIER -66.83 -26.56 66.98 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.859 -0.609 . . . . 1.47 110.661 -178.211 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -75.38 -39.29 59.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.817 0.341 . . . . 1.04 110.3 177.392 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.52 -53.45 56.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.924 -0.58 . . . . 0.8 110.555 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.9 mm100 -70.85 -24.11 62.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.825 -0.625 . . . . 1.75 110.682 -178.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.667 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 35.7 t80 -61.14 -64.11 1.06 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 116.169 -0.468 . . . . 0.64 110.905 177.569 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.511 ' O ' HG12 ' A' ' 47' ' ' VAL . 2.2 ttm -60.28 -31.71 70.5 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.813 -0.355 . . . . 1.13 110.506 -174.093 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -59.07 -57.27 13.81 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.734 -0.666 . . . . 1.3 110.997 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -86.28 -29.53 22.99 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.104 0.409 . . . . 0.5 112.104 -176.211 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 99.3 t -88.31 -57.82 3.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 112.161 0.43 . . . . 0.3 112.161 -175.389 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.653 HG22 ' HB3' ' A' ' 136' ' ' LYS . 60.2 t -82.14 -66.8 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 112.11 0.411 . . . . 0.26 112.11 -169.691 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.511 HG12 ' O ' ' A' ' 42' ' ' MET . 1.5 p -68.91 -32.9 56.49 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.326 0 C-N-CA 120.711 -0.395 . . . . 0.83 111.411 -174.099 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.11 -26.1 68.1 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 122.092 -0.38 . . . . 2.4 111.084 177.178 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 35.2 m -85.65 -38.1 18.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.77 0.319 . . . . 0.55 110.503 177.179 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.66 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -66.48 -39.94 89.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.039 0.447 . . . . 0.33 110.211 177.687 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 29.2 t-105 -60.37 -35.52 75.91 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.47 -0.787 . . . . 0.39 111.662 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.59 -4.1 52.83 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.064 0.394 . . . . 2.24 112.064 -174.036 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.589 ' ND1' ' HB2' ' A' ' 55' ' ' PHE . 10.0 t-80 -75.56 128.71 35.88 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.265 -0.643 . . . . 0.39 109.265 176.823 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -81.08 7.13 11.66 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.83 0.348 . . . . 1.91 111.46 -174.318 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.589 ' HB2' ' ND1' ' A' ' 53' ' ' HIS . 2.3 m-30 -103.36 -8.51 20.19 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.514 -0.55 . . . . 0.93 109.514 172.361 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.616 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -91.18 9.98 28.93 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.786 -0.643 . . . . 0.28 110.641 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.495 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 57.8 p-90 -61.9 -35.38 21.22 Favored Pre-proline 0 CA--C 1.547 0.842 0 N-CA-C 113.916 1.08 . . . . 0.58 113.916 -175.21 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.495 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 3.0 Cg_exo -76.98 -10.78 18.08 Favored 'Trans proline' 0 C--N 1.364 1.358 0 CA-C-N 121.016 1.399 . . . . 0.47 111.733 178.716 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -101.6 10.84 39.84 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.702 -0.681 . . . . 1.11 110.431 -177.028 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 2.9 m-30 -73.23 -31.67 64.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.794 -0.639 . . . . 0.63 111.001 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -114.59 144.7 32.35 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 115.77 -0.65 . . . . 1.63 110.564 -173.634 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.549 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 33.3 Cg_endo -66.35 151.46 83.24 Favored 'Trans proline' 0 C--O 1.237 0.474 0 C-N-CA 122.885 2.39 . . . . 0.87 112.905 -178.857 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.467 ' O ' HG12 ' A' ' 63' ' ' VAL . 1.4 t -70.42 101.79 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 CA-C-O 122.258 1.028 . . . . 0.88 109.253 173.707 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -96.16 6.1 49.57 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.336 -1.302 . . . . 1.85 108.993 176.486 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 69.4 -71.68 0.12 Allowed 'General case' 0 C--O 1.226 -0.137 0 CA-C-N 114.525 -1.216 . . . . 1.29 110.555 -175.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 5.7 mt -65.0 -39.68 86.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 116.372 -0.376 . . . . 1.89 111.09 -176.59 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.41 -24.25 65.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.034 -0.53 . . . . 2.99 111.766 -179.593 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.488 HD13 ' HA ' ' A' ' 68' ' ' LEU . 0.2 OUTLIER -117.06 5.74 12.83 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.636 0.255 . . . . 1.66 111.513 -178.662 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 65.24 35.37 7.76 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.826 -0.624 . . . . 1.74 111.576 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 2.6 mt -120.19 74.03 21.01 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 115.86 -0.609 . . . . 1.61 110.303 177.242 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.19 -29.85 25.88 Favored 'Trans proline' 0 C--O 1.233 0.25 0 C-N-CA 122.413 2.075 . . . . 1.3 113.216 -173.536 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -101.74 13.37 35.06 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.263 0.554 . . . . 1.97 111.057 -177.142 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.401 ' CD2' HG11 ' A' ' 63' ' ' VAL . 13.9 t80 -57.52 -41.25 80.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.68 -0.691 . . . . 1.13 110.442 177.323 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 18.7 m-70 -76.2 3.42 10.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.738 -0.665 . . . . 0.91 111.744 -176.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.0 mmpt? -97.28 -38.32 9.72 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.05 0.452 . . . . 2.86 109.972 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.9 mt -94.81 -47.7 13.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.962 -0.563 . . . . 1.0 110.037 177.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 41.9 mm -91.66 102.42 13.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.822 -0.626 . . . . 0.75 109.469 179.058 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.1 mtmt -72.35 -29.15 63.53 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.375 -0.83 . . . . 1.99 111.308 -174.627 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -116.22 80.17 9.36 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 115.719 -0.673 . . . . 2.05 110.315 178.109 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -69.16 97.69 0.6 Allowed 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.9 2.4 . . . . 0.89 111.865 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.6 mmt -133.36 155.02 50.21 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-O 121.363 0.601 . . . . 0.82 110.673 -177.298 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.549 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 5.0 p-10 -134.98 -129.85 0.16 Allowed 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 114.411 -1.268 . . . . 1.42 109.078 -172.029 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.25 -14.54 4.82 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.299 0.571 . . . . 0.8 110.266 178.859 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -90.62 -32.03 9.71 Favored Glycine 0 N--CA 1.441 -1.021 0 N-CA-C 109.921 -1.271 . . . . 0.32 109.921 -178.26 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.471 ' OG1' ' HB3' ' A' ' 62' ' ' PRO . 98.0 m -67.79 -37.32 81.88 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.004 -0.598 . . . . 0.95 110.5 173.792 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 54.9 mt -63.22 -50.87 77.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.984 -0.553 . . . . 0.97 109.976 176.137 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.542 ' O ' ' HG2' ' A' ' 91' ' ' GLU . 0.0 OUTLIER -65.47 -29.9 70.62 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.691 -0.686 . . . . 1.15 110.9 -179.737 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 30.6 tttt -66.79 -37.82 85.31 Favored 'General case' 0 C--N 1.337 0.053 0 CA-C-O 120.986 0.422 . . . . 2.46 110.687 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.403 HH12 ' CG ' ' A' ' 104' ' ' ASP . 29.5 mtp180 -74.56 -29.97 61.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.072 -0.513 . . . . 1.16 110.594 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.566 ' HG ' ' OH ' ' A' ' 95' ' ' TYR . 2.8 mt -70.09 -57.54 4.85 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.791 -0.64 . . . . 0.49 111.084 179.031 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.542 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 9.0 pt-20 -72.25 -7.23 48.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.888 -0.596 . . . . 1.39 112.081 -173.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -106.58 -4.22 19.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.412 0.148 . . . . 1.3 111.168 178.206 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 57.69 63.8 1.72 Allowed 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.337 0.589 . . . . 1.75 110.854 -177.645 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -78.23 -26.4 47.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.603 -0.726 . . . . 0.96 111.404 -179.066 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.627 ' HE2' ' HG ' ' A' ' 101' ' ' CYS . 0.1 OUTLIER -135.62 179.19 6.49 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.056 -0.52 . . . . 1.28 111.202 -172.21 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 96' ' ' TRP . . . . . 0.457 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 1.8 t-105 -66.55 -47.5 72.65 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.451 -0.795 . . . . 1.05 110.742 178.272 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 26.9 t -150.35 167.06 28.15 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.996 -0.547 . . . . 1.0 110.888 -174.815 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -76.1 -4.69 42.89 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.762 -0.653 . . . . 0.66 111.682 -175.027 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.36 -32.08 70.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.05 0.452 . . . . 0.85 110.476 178.926 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -66.42 -43.25 86.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.755 -0.657 . . . . 2.44 110.011 177.478 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.627 ' HG ' ' HE2' ' A' ' 95' ' ' TYR . 0.0 OUTLIER -75.73 -20.28 58.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.925 -0.579 . . . . 0.95 111.381 -177.226 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -55.55 -29.17 58.5 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.199 0.523 . . . . 1.13 109.989 174.554 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -73.55 -41.18 63.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.679 -0.691 . . . . 2.96 110.281 175.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ASP . . . . . 0.452 ' OD1' ' HA ' ' A' ' 101' ' ' CYS . 8.9 m-20 -68.04 -38.9 83.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.029 -0.532 . . . . 1.87 110.453 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.66 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -59.21 -46.88 87.28 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.871 -0.604 . . . . 0.38 110.466 177.938 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -62.55 -42.69 99.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.884 -0.598 . . . . 0.97 109.977 177.165 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 94.7 m -63.27 -40.21 96.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.487 -0.779 . . . . 0.43 111.687 -179.144 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.75 -42.68 62.51 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.057 0.456 . . . . 0.88 110.902 177.026 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -71.1 -40.33 71.57 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.93 -0.577 . . . . 0.29 110.988 -178.771 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -41.56 75.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.604 -0.271 . . . . 0.66 111.115 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -48.16 -53.26 17.42 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.619 -0.718 . . . . 1.84 111.062 178.66 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.62 -34.41 77.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.695 -0.684 . . . . 0.63 111.011 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' TYR . . . . . 0.561 ' HD1' HG22 ' A' ' 123' ' ' VAL . 18.5 m-30 -77.22 -17.77 58.21 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.457 -0.338 . . . . 0.81 111.663 -177.374 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 67.5 mt -92.72 -53.63 8.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 120.668 0.27 . . . . 0.55 111.305 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -68.59 -37.75 80.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.322 -0.399 . . . . 1.22 110.53 -176.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -108.7 140.94 41.4 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.082 -0.508 . . . . 1.04 109.654 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.33 146.18 97.77 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 116.434 -0.348 . . . . 3.47 110.507 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' PRO . . . . . 0.822 ' HA ' HG11 ' A' ' 123' ' ' VAL . 37.0 Cg_exo -58.93 -12.12 14.25 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.215 2.61 . . . . 0.96 113.511 -177.532 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.93 -7.59 59.39 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.432 -0.349 . . . . 1.23 111.655 178.903 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -81.88 171.03 14.96 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.506 0.669 . . . . 1.34 112.043 -174.209 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -76.5 -41.58 46.44 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.497 -1.229 . . . . 1.44 110.791 -174.232 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' ILE . . . . . 0.634 ' HA ' ' SD ' ' A' ' 125' ' ' MET . 2.6 tp -62.15 -35.55 69.47 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.11 0 CA-C-O 120.974 0.416 . . . . 0.42 110.043 179.313 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.822 HG11 ' HA ' ' A' ' 118' ' ' PRO . 12.5 t -69.74 -49.32 58.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.118 -0.492 . . . . 0.35 110.04 177.201 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.9 -40.09 72.52 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.305 -0.862 . . . . 0.52 110.892 -177.9 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' MET . . . . . 0.634 ' SD ' ' HA ' ' A' ' 122' ' ' ILE . 0.1 OUTLIER -75.58 -38.7 58.93 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.163 -0.472 . . . . 0.62 111.21 179.742 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 126' ' ' ALA . . . . . 0.42 ' N ' ' HG2' ' A' ' 125' ' ' MET . . . -60.15 -28.82 68.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.394 -0.366 . . . . 0.31 111.099 177.305 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.88 -38.52 91.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.26 -0.427 . . . . 1.94 110.815 177.717 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -73.59 -37.63 65.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.094 -0.503 . . . . 0.32 110.151 177.339 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.616 HD21 ' HA ' ' A' ' 56' ' ' ALA . 7.1 mp -58.25 -44.75 88.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.532 -0.758 . . . . 0.33 110.213 177.011 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -59.54 -30.56 68.7 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.081 -0.963 . . . . 1.47 111.842 -176.021 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.477 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -65.38 -46.58 79.54 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.576 -0.284 . . . . 2.24 110.467 -175.023 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.49 HD12 HD23 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -74.0 -21.73 18.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.537 -0.301 . . . . 1.23 110.746 179.828 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.514 ' O ' HG23 ' A' ' 137' ' ' VAL . 30.0 t80 -65.12 -62.23 1.67 Allowed 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.334 -0.394 . . . . 0.46 110.299 177.037 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.5 pp -66.59 -26.96 67.35 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.035 0.445 . . . . 0.64 110.341 -177.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.477 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -57.93 -48.22 80.55 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.446 -0.797 . . . . 1.61 111.046 178.708 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 136' ' ' LYS . . . . . 0.653 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -82.81 -24.41 33.38 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.14 -0.482 . . . . 1.52 110.948 -177.873 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 133' ' ' PHE . 59.2 t -70.97 -32.04 47.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.086 0.47 . . . . 0.35 110.362 178.273 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -69.53 -10.49 58.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.064 0.459 . . . . 0.5 110.471 177.269 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -103.34 -3.55 25.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.946 -0.57 . . . . 1.76 110.926 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' MET . . . . . 0.492 ' HG3' ' HA ' ' A' ' 137' ' ' VAL . 0.7 OUTLIER -67.91 143.9 96.76 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.094 -0.503 . . . . 0.86 111.337 -177.883 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -70.77 110.79 2.85 Favored 'Trans proline' 0 N--CA 1.462 -0.356 0 C-N-CA 122.52 2.147 . . . . 0.67 111.675 177.874 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.05 5.79 7.51 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.913 -0.585 . . . . 2.91 111.917 -175.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 143' ' ' GLU . . . . . 0.413 ' O ' ' HB3' ' A' ' 144' ' ' GLU . 18.3 mt-10 -103.17 -41.18 6.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.436 -0.347 . . . . 2.7 111.244 -177.673 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.413 ' HB3' ' O ' ' A' ' 143' ' ' GLU . 2.7 tt0 70.95 101.57 0.06 Allowed 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.991 0.807 . . . . 2.34 110.866 -177.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 2.6 t -108.52 133.96 51.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.135 -0.691 . . . . 0.99 109.135 176.096 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.524 ' HG3' HG22 ' A' ' 36' ' ' THR . 1.2 tt0 -80.63 148.18 30.37 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.004 0.43 . . . . 1.53 111.13 -176.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 22.0 mt . . . . . 0 C--O 1.247 0.955 0 CA-C-O 118.896 -0.573 . . . . 1.57 110.142 178.134 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.448 -0.535 0 CA-C-O 121.348 0.594 . . . . 0.93 109.847 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -158.95 137.08 10.55 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.123 -0.944 . . . . 1.61 110.001 176.26 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.469 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 23.8 t-20 -136.8 122.92 13.47 Favored Pre-proline 0 C--N 1.32 -0.69 0 N-CA-C 109.357 -0.608 . . . . 1.6 109.357 173.741 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -60.4 -46.31 18.5 Favored 'Trans proline' 0 N--CA 1.474 0.338 0 C-N-CA 123.249 2.633 . . . . 1.87 113.008 -175.456 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.3 m -78.97 -30.04 44.25 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 116.037 -0.529 . . . . 2.18 110.957 -175.201 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.469 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 24.4 tttp -67.41 134.03 93.04 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.564 -0.744 . . . . 2.75 111.419 -177.378 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_exo -49.18 141.11 24.2 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 123.182 2.588 . . . . 1.38 112.993 173.366 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -158.91 117.07 0.75 Allowed Glycine 0 N--CA 1.443 -0.84 0 N-CA-C 110.218 -1.153 . . . . 0.97 110.218 177.282 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.434 ' HE ' ' CD ' ' A' ' 146' ' ' GLU . 7.2 mmm180 -131.55 158.82 39.94 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.013 0.435 . . . . 1.93 110.935 -175.377 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.518 ' HA ' HD22 ' A' ' 39' ' ' LEU . 1.5 mtpp -103.6 84.52 2.3 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.981 -0.554 . . . . 2.64 109.598 176.613 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.643 HG22 ' HG3' ' A' ' 146' ' ' GLU . 1.6 p -87.17 168.56 13.13 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.244 -0.434 . . . . 0.68 110.515 -179.285 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -59.12 -50.98 71.97 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-N 116.489 -0.323 . . . . 1.47 110.749 -178.434 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.512 ' HB2' ' OE2' ' A' ' 144' ' ' GLU . 1.7 mt-30 -59.21 -39.83 83.92 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.711 0.291 . . . . 1.04 111.222 -179.006 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.653 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.8 OUTLIER -61.66 -55.17 33.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.109 -0.496 . . . . 0.8 110.72 -179.638 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 18.2 mm100 -68.53 -30.47 69.29 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.872 -0.603 . . . . 1.75 110.862 -179.338 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -61.6 -63.36 1.3 Allowed 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.825 -0.625 . . . . 0.64 110.488 176.556 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.581 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -58.44 -33.62 69.9 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 110.175 -0.306 . . . . 1.13 110.175 -175.418 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -56.98 -56.62 19.34 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.569 -0.741 . . . . 1.3 111.121 178.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 61.3 m-80 -86.66 -28.16 23.34 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.285 -0.416 . . . . 0.5 112.039 -176.447 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 94.5 t -89.61 -56.89 4.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 N-CA-C 112.243 0.46 . . . . 0.3 112.243 -176.037 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.702 HG22 ' HB3' ' A' ' 136' ' ' LYS . 59.9 t -79.41 -65.82 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 121.012 -0.275 . . . . 0.26 111.521 -172.275 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.5 HG13 ' O ' ' A' ' 42' ' ' MET . 1.9 m -63.49 -33.58 62.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 N-CA-C 111.75 0.278 . . . . 0.83 111.75 -174.833 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.05 -39.35 86.92 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 121.102 -0.239 . . . . 2.4 111.53 -178.897 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 5.9 m -75.1 -33.26 61.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.728 0.299 . . . . 0.55 110.642 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.578 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -67.03 -41.06 87.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.324 0.583 . . . . 0.33 109.595 174.128 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 6.9 t-105 -63.03 -35.79 81.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.607 -0.724 . . . . 0.39 111.253 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.3 mmpt? -87.62 22.75 2.15 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.25 0.463 . . . . 2.24 112.25 -175.781 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.55 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 12.9 t-80 -96.24 139.99 31.59 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.42 -0.354 . . . . 0.39 110.07 175.232 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 40.6 mm-40 -81.44 7.03 12.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.777 0.323 . . . . 1.91 111.852 -176.126 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.55 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.7 OUTLIER -115.2 -7.29 12.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.022 0.439 . . . . 0.93 110.165 175.673 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.519 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -99.0 11.05 40.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.059 0.457 . . . . 0.28 110.939 -177.868 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.586 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 32.4 p-90 -63.24 -33.84 11.75 Favored Pre-proline 0 CA--C 1.547 0.855 0 N-CA-C 113.88 1.067 . . . . 0.58 113.88 -175.114 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.586 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 5.9 Cg_exo -78.97 -0.61 10.9 Favored 'Trans proline' 0 C--N 1.359 1.124 0 CA-C-N 121.2 1.464 . . . . 0.47 112.289 176.805 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -97.99 -2.01 41.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.121 -0.491 . . . . 1.11 110.614 -175.566 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.555 ' CZ ' ' HA ' ' A' ' 57' ' ' TRP . 13.1 m-30 -74.55 -11.7 60.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.02 -0.536 . . . . 0.63 110.603 179.24 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -106.96 119.71 50.42 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 115.902 -0.59 . . . . 1.63 111.23 -170.631 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.619 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 21.5 Cg_exo -63.44 145.45 92.36 Favored 'Trans proline' 0 C--O 1.237 0.438 0 C-N-CA 122.933 2.422 . . . . 0.87 113.103 -178.621 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 22.3 t -91.01 90.1 3.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 122.119 0.961 . . . . 0.88 108.847 177.568 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.4 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.6 OUTLIER -108.14 5.12 25.61 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.783 -1.099 . . . . 1.85 110.677 -176.774 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.508 ' HB2' ' NE2' ' A' ' 74' ' ' HIS . . . 79.28 -29.73 0.14 Allowed 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.003 -0.999 . . . . 1.29 112.58 177.385 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -98.76 -49.54 11.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 120.855 0.359 . . . . 1.89 111.901 -174.423 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.01 -22.45 49.28 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.136 -0.484 . . . . 2.99 111.632 -173.109 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.2 tp -112.87 3.59 16.44 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.864 0.364 . . . . 1.66 110.767 177.343 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ASN . . . . . 0.534 ' O ' HD13 ' A' ' 70' ' ' LEU . 15.4 t-20 53.68 69.41 0.71 Allowed 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.461 -0.791 . . . . 1.74 110.88 -178.378 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.534 HD13 ' O ' ' A' ' 69' ' ' ASN . 0.0 OUTLIER -133.31 64.18 68.46 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.584 -0.735 . . . . 1.61 110.596 178.218 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -78.54 -38.8 0.47 Allowed 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.417 2.078 . . . . 1.3 112.548 -178.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -77.97 -15.95 58.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.512 0.672 . . . . 1.97 109.896 -178.598 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.499 ' HA ' ' CE1' ' A' ' 115' ' ' TYR . 13.2 t80 -53.43 -41.6 66.23 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.845 -1.07 . . . . 1.13 111.007 177.102 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' HIS . . . . . 0.508 ' NE2' ' HB2' ' A' ' 65' ' ' ALA . 1.8 m-70 -80.35 3.84 19.85 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.585 -0.734 . . . . 0.91 111.724 -173.053 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.9 mttp -88.14 -21.98 24.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.396 0.617 . . . . 2.86 109.589 178.616 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.8 mp -117.63 -46.42 3.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.143 -0.935 . . . . 1.0 110.339 -179.244 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.5 mm -86.84 111.56 21.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.009 -0.541 . . . . 0.75 110.476 -179.281 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.91 -29.5 58.43 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.072 -0.513 . . . . 1.99 110.87 -179.5 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 57.1 m-20 -119.84 81.95 27.06 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 116.031 -0.531 . . . . 2.05 109.962 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -76.06 98.85 1.23 Allowed 'Trans proline' 0 N--CA 1.464 -0.235 0 C-N-CA 123.265 2.644 . . . . 0.89 112.091 -177.673 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -132.81 174.97 9.75 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.51 0.671 . . . . 0.82 111.087 -176.633 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.619 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 3.1 p-10 -152.38 -126.99 0.04 OUTLIER 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.555 -1.202 . . . . 1.42 109.135 -173.255 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -126.24 -14.28 5.98 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.185 0.517 . . . . 0.8 110.188 -179.618 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.475 ' O ' ' HG3' ' A' ' 88' ' ' LYS . . . -92.7 -33.19 7.59 Favored Glycine 0 N--CA 1.438 -1.191 0 N-CA-C 110.157 -1.177 . . . . 0.32 110.157 -179.066 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.612 HG23 ' HB3' ' A' ' 62' ' ' PRO . 0.8 OUTLIER -65.56 -41.0 93.43 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.107 0.48 . . . . 0.95 110.435 176.875 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.439 HG12 ' HB3' ' A' ' 104' ' ' ASP . 79.0 mt -61.79 -47.95 90.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.365 -0.834 . . . . 0.97 109.935 175.074 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -32.28 73.39 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.692 -0.686 . . . . 1.15 111.136 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.475 ' HG3' ' O ' ' A' ' 84' ' ' GLY . 33.4 mttm -59.9 -52.9 63.43 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 120.951 0.405 . . . . 2.46 110.515 178.798 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -70.47 -30.42 67.23 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.633 -0.712 . . . . 1.16 111.233 -177.479 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.2 mt -66.14 -56.69 10.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.022 0.439 . . . . 0.49 111.119 178.406 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -68.42 -28.78 67.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.853 -0.612 . . . . 1.39 111.167 -177.114 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -80.69 -10.92 59.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.524 -0.307 . . . . 1.3 110.873 179.468 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 60.34 61.87 1.69 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.674 -0.694 . . . . 1.75 110.189 -178.013 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -79.75 -52.73 7.56 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.79 -0.641 . . . . 0.96 111.434 -178.223 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -97.03 -178.71 4.29 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.071 0.462 . . . . 1.28 110.955 -175.32 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 -72.59 -54.08 10.12 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.589 -0.732 . . . . 1.05 111.216 -179.255 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 26.4 t -145.32 -178.82 6.26 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.054 0.454 . . . . 1.0 111.495 -172.763 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.653 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -76.81 -7.07 54.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.997 -0.547 . . . . 0.66 111.132 -177.028 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -34.86 73.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.323 0.583 . . . . 0.85 109.82 175.183 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.09 -30.79 62.52 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.418 -0.81 . . . . 2.44 110.14 177.461 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.48 ' HB3' ' SD ' ' A' ' 42' ' ' MET . 0.1 OUTLIER -74.36 -28.56 61.18 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.485 -0.779 . . . . 0.95 111.242 -179.258 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.77 -36.07 73.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.148 0.499 . . . . 1.13 110.326 177.616 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -70.05 -40.24 75.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.572 -0.74 . . . . 2.96 110.417 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ASP . . . . . 0.439 ' HB3' HG12 ' A' ' 86' ' ' ILE . 0.3 OUTLIER -70.06 -49.65 49.01 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.015 -0.539 . . . . 1.87 111.05 -176.55 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.578 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -55.66 -45.26 77.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.073 -0.512 . . . . 0.38 110.948 -179.496 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -60.56 -45.33 94.29 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.142 -0.481 . . . . 0.97 110.294 177.898 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 66.4 m -64.4 -37.15 86.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.79 -0.641 . . . . 0.43 111.462 -178.708 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -34.73 71.08 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.214 -0.448 . . . . 0.88 110.69 177.176 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -79.21 -36.93 39.36 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.37 -0.377 . . . . 0.29 110.515 -178.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.0 -37.23 86.96 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.764 0.316 . . . . 0.66 110.611 175.566 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -43.63 -55.06 4.56 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.271 -0.877 . . . . 1.84 110.925 177.58 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' CYS . . . . . 0.49 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 2.1 t -58.76 -47.73 83.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.196 -0.911 . . . . 0.63 111.906 -179.509 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 47.7 m-85 -74.85 -15.92 60.7 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.719 0.637 . . . . 0.81 112.719 -170.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 85.5 mt -91.77 -54.33 7.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.759 0.314 . . . . 0.55 111.271 -179.261 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' TYR . . . . . 0.499 ' CE1' ' HA ' ' A' ' 73' ' ' TYR . 41.7 t80 -78.24 -40.35 37.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.78 0.324 . . . . 1.22 111.194 -175.31 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' ASN . . . . . 0.49 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 27.5 m120 -86.12 -168.57 2.28 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.376 -0.375 . . . . 1.04 110.481 -177.252 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.26 154.07 43.78 Favored Pre-proline 0 C--N 1.32 -0.693 0 N-CA-C 110.526 -0.176 . . . . 3.47 110.526 -177.466 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -58.61 -25.97 77.08 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.409 2.072 . . . . 0.96 112.276 177.656 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.79 16.37 25.28 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.124 -0.489 . . . . 1.23 111.325 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 120' ' ' ASP . . . . . 0.433 ' OD1' HG22 ' A' ' 122' ' ' ILE . 3.8 t70 -76.52 159.72 30.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.47 . . . . 1.34 110.976 -177.605 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -69.56 -47.88 62.17 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.362 -0.836 . . . . 1.44 110.02 -178.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' ILE . . . . . 0.433 HG22 ' OD1' ' A' ' 120' ' ' ASP . 2.2 tp -68.28 -30.4 47.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.384 -0.825 . . . . 0.42 110.666 -177.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 1.4 t -71.75 -41.36 70.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.225 -0.443 . . . . 0.35 110.163 177.532 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.07 -32.24 71.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.955 -0.566 . . . . 0.52 110.045 179.721 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 25.8 mtt -75.39 -39.16 59.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.539 -0.755 . . . . 0.62 110.546 177.723 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.35 -28.0 66.44 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.201 -0.454 . . . . 0.31 111.837 -178.823 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.68 -44.79 89.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.849 0.357 . . . . 1.94 111.213 179.286 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -76.72 -36.87 56.88 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.127 0.489 . . . . 0.32 110.433 179.166 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.519 HD21 ' HA ' ' A' ' 56' ' ' ALA . 1.0 OUTLIER -59.39 -43.51 92.92 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.357 -0.838 . . . . 0.33 111.047 179.909 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -65.93 -24.42 66.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.903 -0.589 . . . . 1.47 111.687 -175.749 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.508 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 19.1 ttmt -64.89 -41.62 95.46 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.768 -0.456 . . . . 2.24 109.768 -178.789 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.531 HD12 HD23 ' A' ' 50' ' ' LEU . 3.3 mt -69.39 -34.78 64.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.918 -0.583 . . . . 1.23 110.316 178.01 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.443 ' O ' HG23 ' A' ' 137' ' ' VAL . 29.9 t80 -58.35 -61.75 2.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.652 -0.703 . . . . 0.46 110.662 179.273 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 2.0 pp -63.94 -30.02 71.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.923 0.392 . . . . 0.64 110.406 -177.776 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.508 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.56 -50.73 72.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.549 -0.75 . . . . 1.61 111.13 178.894 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 136' ' ' LYS . . . . . 0.702 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -77.53 -23.29 50.18 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.77 -0.65 . . . . 1.52 111.055 -176.611 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.45 ' HA ' ' HG3' ' A' ' 140' ' ' MET . 46.4 t -78.15 -33.74 18.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.011 -0.54 . . . . 0.35 110.56 -179.476 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.03 -13.35 61.83 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.116 0.484 . . . . 0.5 110.616 179.05 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -106.71 4.2 27.51 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.681 -0.691 . . . . 1.76 110.869 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 140' ' ' MET . . . . . 0.45 ' HG3' ' HA ' ' A' ' 137' ' ' VAL . 0.7 OUTLIER -66.36 143.03 98.09 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.296 -0.411 . . . . 0.86 110.505 176.908 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -63.82 114.13 2.45 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.27 1.98 . . . . 0.67 111.272 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 13.6 mm-40 -79.37 26.29 0.29 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.184 -0.462 . . . . 2.91 111.622 -173.333 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.06 -40.16 3.0 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 115.936 -0.574 . . . . 2.7 110.763 -178.731 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 144' ' ' GLU . . . . . 0.512 ' OE2' ' HB2' ' A' ' 38' ' ' GLN . 0.0 OUTLIER 63.28 93.8 0.05 Allowed 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.063 -0.972 . . . . 2.34 110.313 -174.696 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 1.5 t -112.89 116.83 53.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 115.522 -0.763 . . . . 0.99 109.961 -178.397 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.643 ' HG3' HG22 ' A' ' 36' ' ' THR . 7.5 tt0 -64.8 133.14 51.37 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.693 0.283 . . . . 1.53 110.392 178.592 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 14.9 mt . . . . . 0 C--O 1.246 0.897 0 CA-C-O 118.697 -0.668 . . . . 1.57 110.372 -177.808 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.2 p . . . . . 0 N--CA 1.451 -0.418 0 CA-C-O 122.058 0.932 . . . . 0.93 108.57 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.2 m -149.17 141.35 23.99 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 114.159 -1.382 . . . . 1.61 108.192 176.761 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -145.11 136.67 12.77 Favored Pre-proline 0 C--N 1.315 -0.929 0 C-N-CA 121.112 -0.235 . . . . 1.6 110.579 -177.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -65.76 -48.13 3.27 Favored 'Trans proline' 0 N--CA 1.473 0.278 0 C-N-CA 123.061 2.507 . . . . 1.87 112.955 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.467 ' O ' ' HD3' ' A' ' 32' ' ' PRO . 5.4 m -75.74 -19.31 59.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.082 -0.508 . . . . 2.18 110.872 -176.175 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.468 ' HE3' ' CZ ' ' A' ' 94' ' ' TYR . 0.0 OUTLIER -102.33 100.63 16.14 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.55 -0.75 . . . . 2.75 110.598 178.409 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.467 ' HD3' ' O ' ' A' ' 30' ' ' SER . 15.2 Cg_exo -66.63 152.57 80.41 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.096 1.864 . . . . 1.38 111.564 178.675 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -136.02 88.78 0.23 Allowed Glycine 0 N--CA 1.444 -0.778 0 N-CA-C 111.662 -0.575 . . . . 0.97 111.662 -177.683 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.463 ' HG3' ' CZ2' ' A' ' 96' ' ' TRP . 7.3 mtm180 -91.87 148.81 21.94 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.723 -0.473 . . . . 1.93 109.723 178.681 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.0 120.62 32.14 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.395 -0.366 . . . . 2.64 110.103 -178.157 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.626 HG22 ' HG3' ' A' ' 146' ' ' GLU . 1.0 OUTLIER -111.36 160.58 16.92 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.827 -0.349 . . . . 0.68 110.722 177.89 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.489 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 8.1 t30 -60.69 -37.84 82.99 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-N 115.879 -0.6 . . . . 1.47 110.113 178.292 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.417 ' O ' ' HB3' ' A' ' 41' ' ' TYR . 23.4 tt0 -64.18 -42.37 96.71 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.303 -0.408 . . . . 1.04 110.433 178.829 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.785 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.4 OUTLIER -63.32 -52.01 63.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.216 -0.447 . . . . 0.8 110.549 179.027 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.422 ' O ' ' HG3' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -67.5 -22.98 65.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.288 0.566 . . . . 1.75 110.789 -179.541 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.489 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 62.3 t80 -64.45 -59.73 3.99 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 115.523 -0.762 . . . . 0.64 110.769 176.624 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.556 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -58.99 -34.39 71.79 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.573 -0.285 . . . . 1.13 111.749 -172.587 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.562 ' HA ' ' CG1' ' A' ' 47' ' ' VAL . 0.0 OUTLIER -65.68 -45.21 83.72 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.426 -0.509 . . . . 1.3 110.851 -177.521 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 -85.68 -34.24 21.34 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.085 -0.507 . . . . 0.5 111.795 -177.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 85.6 t -88.73 -57.81 3.96 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 112.332 0.493 . . . . 0.3 112.332 -175.793 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.664 HG22 ' HB3' ' A' ' 136' ' ' LYS . 42.4 t -79.63 -66.63 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 111.855 0.317 . . . . 0.26 111.855 -170.636 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.562 ' CG1' ' HA ' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -68.94 -35.97 71.75 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.314 0 C-N-CA 120.677 -0.409 . . . . 0.83 111.624 -173.728 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.46 -38.64 87.95 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.678 -0.409 . . . . 2.4 111.376 179.066 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.2 m -73.64 -36.37 65.39 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 121.083 -0.247 . . . . 0.55 110.824 178.24 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.626 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -66.24 -39.63 89.65 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 109.588 -0.523 . . . . 0.33 109.588 174.991 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 11.6 t-105 -58.04 -36.38 72.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.641 -0.709 . . . . 0.39 110.98 177.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -84.78 10.59 11.04 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.198 0.444 . . . . 2.24 112.198 -175.155 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 19.1 t-80 -83.12 139.06 33.42 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.842 0.353 . . . . 0.39 110.465 177.15 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.9 mm-40 -72.26 1.79 7.11 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.005 -0.543 . . . . 1.91 112.308 -175.786 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -118.83 -7.84 10.4 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.771 0.32 . . . . 0.93 110.918 178.165 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.662 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -92.6 6.43 47.34 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.955 0.407 . . . . 0.28 111.217 -176.089 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.55 ' HA ' ' CZ ' ' A' ' 60' ' ' TYR . 40.4 p-90 -62.97 -35.14 16.38 Favored Pre-proline 0 CA--C 1.548 0.867 0 N-CA-C 114.099 1.148 . . . . 0.58 114.099 -174.397 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.51 ' HD3' ' CG ' ' A' ' 57' ' ' TRP . 15.3 Cg_exo -71.19 -17.9 30.93 Favored 'Trans proline' 0 C--N 1.357 0.987 0 CA-C-N 121.095 1.427 . . . . 0.47 112.435 177.478 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -85.36 -4.53 59.19 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.196 -0.456 . . . . 1.11 111.257 -175.773 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.55 ' CZ ' ' HA ' ' A' ' 57' ' ' TRP . 17.6 m-30 -60.54 -38.08 83.29 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.304 0.573 . . . . 0.63 110.883 -178.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -97.45 132.8 24.63 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-N 115.41 -0.814 . . . . 1.63 110.615 -177.049 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.73 145.09 25.42 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.334 2.023 . . . . 0.87 112.083 178.343 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.454 HG11 ' CD1' ' A' ' 73' ' ' TYR . 4.4 t -69.59 110.11 2.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-O 121.727 0.775 . . . . 0.88 110.794 177.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.406 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.5 OUTLIER -110.23 -0.74 17.67 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.897 -1.047 . . . . 1.85 109.559 179.474 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 74.69 -64.19 0.39 Allowed 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 114.627 -1.169 . . . . 1.29 111.055 -175.727 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 12.9 mt -68.56 -48.84 70.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.788 0.328 . . . . 1.89 111.115 -176.455 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 38.2 tttp -50.46 -51.92 42.67 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.73 -0.668 . . . . 2.99 112.331 -177.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.629 ' HB3' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -105.1 7.24 33.76 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.496 -0.32 . . . . 1.66 111.573 -171.958 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ASN . . . . . 0.433 ' O ' HD13 ' A' ' 70' ' ' LEU . 17.7 t-20 59.11 67.28 0.93 Allowed 'General case' 0 N--CA 1.467 0.418 0 O-C-N 123.731 0.644 . . . . 1.74 111.207 -178.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.629 HD22 ' HB3' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -128.06 66.94 73.44 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.349 -0.841 . . . . 1.61 110.798 -179.699 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.96 -34.93 21.97 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 121.909 1.739 . . . . 1.3 111.972 -179.353 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -72.0 -30.8 65.6 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.98 -0.554 . . . . 1.97 110.678 -178.844 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.454 ' CD1' HG11 ' A' ' 63' ' ' VAL . 2.8 t80 -59.67 -45.9 90.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.65 -0.705 . . . . 1.13 110.577 -178.478 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 4.1 m170 -75.73 -7.8 55.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.128 -0.487 . . . . 0.91 110.977 -177.144 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt -95.72 -44.6 7.37 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 116.082 -0.508 . . . . 2.86 110.004 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.6 mt -82.78 -50.31 15.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.859 -0.609 . . . . 1.0 111.026 -178.711 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 43.7 mm -83.1 138.08 19.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.438 -0.346 . . . . 0.75 110.339 -177.424 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.62 -47.43 12.09 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.205 -0.452 . . . . 1.99 110.936 -179.721 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -115.22 96.43 45.44 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 116.476 -0.329 . . . . 2.05 110.822 -179.535 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -73.38 99.01 1.07 Allowed 'Trans proline' 0 CA--C 1.529 0.271 0 C-N-CA 122.381 2.054 . . . . 0.89 112.516 178.005 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.24 145.76 47.94 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 116.056 -0.52 . . . . 0.82 110.085 -178.929 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.454 ' O ' HD13 ' A' ' 86' ' ' ILE . 5.4 m-20 -145.35 -153.93 0.51 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 114.862 -1.063 . . . . 1.42 108.297 -172.536 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.53 -18.72 21.94 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.065 -0.717 . . . . 0.8 109.065 -172.55 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -80.37 -25.07 57.86 Favored Glycine 0 N--CA 1.44 -1.084 0 N-CA-C 109.539 -1.424 . . . . 0.32 109.539 175.795 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -84.47 -41.28 16.75 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 114.705 -0.747 . . . . 0.95 111.486 178.385 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.486 ' CD1' ' HB3' ' A' ' 104' ' ' ASP . 0.2 OUTLIER -56.41 -47.42 81.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 121.163 0.506 . . . . 0.97 109.727 178.398 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.6 ptmt -66.15 -27.54 68.1 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.765 -0.652 . . . . 1.15 111.506 -179.091 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.9 tttt -67.92 -43.02 80.15 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.935 0.398 . . . . 2.46 110.795 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.543 ' HD3' ' OD2' ' A' ' 104' ' ' ASP . 1.6 mtt180 -69.84 -32.0 70.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.309 -0.405 . . . . 1.16 110.558 178.578 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.418 ' HG ' ' SG ' ' A' ' 101' ' ' CYS . 7.7 mt -67.71 -54.41 19.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.656 -0.702 . . . . 0.49 111.22 178.991 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 25.0 pt-20 -64.92 -26.74 68.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.119 -0.491 . . . . 1.39 111.313 -175.496 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -95.29 10.67 35.31 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.081 -0.509 . . . . 1.3 111.276 -178.098 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.3 p30 37.25 54.9 1.33 Allowed 'General case' 0 N--CA 1.475 0.825 0 O-C-N 124.169 0.918 . . . . 1.75 111.711 -177.517 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' TYR . . . . . 0.468 ' CZ ' ' HE3' ' A' ' 31' ' ' LYS . 29.8 t80 -66.06 -73.5 0.13 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.057 -0.974 . . . . 0.96 112.06 -175.911 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -94.87 39.44 1.1 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.518 -0.765 . . . . 1.28 112.582 -172.651 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' TRP . . . . . 0.463 ' CZ3' ' HB2' ' A' ' 32' ' ' PRO . 1.2 t-105 71.25 -66.07 0.31 Allowed 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.24 0.83 . . . . 1.05 113.24 169.012 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -125.15 161.26 27.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.114 0.483 . . . . 1.0 111.912 -168.143 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.785 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -73.4 -12.71 60.91 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.973 -0.558 . . . . 0.66 111.071 -179.665 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 20.0 m -64.05 -26.32 68.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.293 0.568 . . . . 0.85 109.791 175.297 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -82.47 -26.68 32.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.522 -0.763 . . . . 2.44 110.35 176.6 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.418 ' SG ' ' HG ' ' A' ' 90' ' ' LEU . 0.5 OUTLIER -74.64 -23.08 58.63 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.539 -0.755 . . . . 0.95 110.62 179.475 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 6.5 ttm -60.94 -31.65 71.19 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.053 -0.521 . . . . 1.13 110.134 176.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.4 -38.16 68.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.696 -0.683 . . . . 2.96 110.252 178.18 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ASP . . . . . 0.543 ' OD2' ' HD3' ' A' ' 89' ' ' ARG . 1.5 m-20 -67.3 -50.41 60.37 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.994 -0.548 . . . . 1.87 110.502 -178.405 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.626 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -55.75 -43.92 77.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.692 -0.685 . . . . 0.38 110.272 177.479 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -60.41 -49.87 75.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.615 -0.72 . . . . 0.97 110.361 178.064 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 71.3 m -55.37 -51.14 67.76 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 123.584 0.552 . . . . 0.43 111.259 179.68 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 2.3 ttp -53.42 -40.88 65.5 Favored 'General case' 0 C--O 1.233 0.216 0 O-C-N 123.326 0.391 . . . . 0.88 111.151 178.581 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -67.8 -43.58 79.33 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.485 -0.325 . . . . 0.29 110.971 -178.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.37 -43.71 98.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.738 0.304 . . . . 0.66 110.888 177.564 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ASN . . . . . 0.416 ' HB3' ' OH ' ' A' ' 73' ' ' TYR . 7.1 m-20 -47.24 -48.86 24.28 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.455 -0.793 . . . . 1.84 111.335 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' CYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 14.0 t -57.24 -42.46 81.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.724 -0.671 . . . . 0.63 111.518 179.124 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -80.44 -21.06 42.52 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.857 0.36 . . . . 0.81 111.833 -173.756 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 55.5 mt -87.01 -50.86 13.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.935 0.398 . . . . 0.55 110.75 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -73.43 -42.83 61.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.054 -0.521 . . . . 1.22 110.739 -177.304 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' ASN . . . . . 0.414 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 33.9 m120 -100.01 161.5 13.57 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.233 -0.439 . . . . 1.04 110.728 -174.541 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.1 mmtt -82.83 147.95 56.22 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.95 -0.568 . . . . 3.47 109.844 178.007 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' PRO . . . . . 0.919 ' HA ' HG11 ' A' ' 123' ' ' VAL . 24.2 Cg_endo -62.26 -12.98 29.63 Favored 'Trans proline' 0 N--CA 1.473 0.271 0 C-N-CA 122.786 2.324 . . . . 0.96 112.386 178.837 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.41 9.35 39.77 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.82 -0.627 . . . . 1.23 111.338 179.686 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -85.92 164.0 17.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.081 0.467 . . . . 1.34 111.062 -177.797 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.76 -45.41 94.01 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.234 -0.894 . . . . 1.44 110.943 -177.64 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -69.33 -34.85 64.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.176 -0.92 . . . . 0.42 111.487 -174.946 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.919 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.3 t -71.32 -35.04 56.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.881 0.372 . . . . 0.35 110.088 179.507 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.87 -32.06 65.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.5 0.667 . . . . 0.52 109.646 177.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' MET . . . . . 0.487 ' O ' HD13 ' A' ' 129' ' ' LEU . 8.7 mtt -80.13 -43.95 20.78 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 114.992 -1.004 . . . . 0.62 110.787 179.739 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.86 -35.16 63.72 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.246 -0.434 . . . . 0.31 111.885 -177.612 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.63 -41.98 98.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.403 -0.362 . . . . 1.94 111.386 -179.542 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -78.06 -36.56 48.2 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.174 0.512 . . . . 0.32 110.466 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.662 HD21 ' HA ' ' A' ' 56' ' ' ALA . 4.0 mp -60.8 -42.06 96.86 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.445 -0.798 . . . . 0.33 111.042 -179.333 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -61.13 -28.63 69.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.883 -0.599 . . . . 1.47 111.967 -175.295 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.491 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 7.0 mttm -64.53 -34.35 78.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.839 0.352 . . . . 2.24 110.441 -177.119 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 13.9 mt -75.54 -31.0 22.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.036 -0.529 . . . . 1.23 110.67 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.505 ' O ' HG23 ' A' ' 137' ' ' VAL . 29.4 t80 -58.66 -62.33 1.95 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.009 -0.541 . . . . 0.46 110.691 -179.426 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.28 -28.24 69.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.104 0.478 . . . . 0.64 110.488 -179.364 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.491 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.36 -39.8 88.48 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.469 -0.787 . . . . 1.61 111.481 179.231 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 136' ' ' LYS . . . . . 0.664 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -90.76 -26.56 19.43 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.895 0.378 . . . . 1.52 110.745 -178.677 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 133' ' ' PHE . 55.8 t -67.8 -32.03 54.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.1 -0.5 . . . . 0.35 110.23 177.403 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -64.96 -18.69 65.48 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.029 -0.532 . . . . 0.5 110.849 179.074 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.3 mm100 -103.58 -0.28 29.91 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.599 -0.728 . . . . 1.76 110.958 -178.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 140' ' ' MET . . . . . 0.472 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 0.4 OUTLIER -66.43 142.32 97.65 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.155 -0.475 . . . . 0.86 111.371 -179.432 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -74.77 101.7 1.49 Allowed 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.472 2.114 . . . . 0.67 111.895 179.565 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 76.5 mm-40 -70.05 -2.24 12.21 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 112.192 0.441 . . . . 2.91 112.192 -175.086 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -81.83 -38.42 25.52 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.881 0.372 . . . . 2.7 110.384 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 67.09 86.33 0.13 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.842 -1.072 . . . . 2.34 110.347 -178.685 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 1.2 t -96.25 120.19 45.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.564 -0.744 . . . . 0.99 109.618 178.977 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.626 ' HG3' HG22 ' A' ' 36' ' ' THR . 0.4 OUTLIER -73.15 146.02 45.95 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.752 0.311 . . . . 1.53 110.625 179.972 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 69.1 mt . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.555 -0.736 . . . . 1.57 110.371 -177.432 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.536 HG21 ' HG2' ' A' ' 88' ' ' LYS . 2.3 p . . . . . 0 N--CA 1.455 -0.202 0 CA-C-O 121.449 0.642 . . . . 0.93 110.059 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -148.92 132.68 16.95 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.645 -0.707 . . . . 1.61 110.027 177.21 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -140.77 131.01 13.39 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 116.366 -0.379 . . . . 1.6 110.319 178.008 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -67.35 -47.33 2.26 Favored 'Trans proline' 0 CA--C 1.53 0.316 0 C-N-CA 123.093 2.529 . . . . 1.87 113.093 -179.167 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 3.1 m -80.54 -22.48 40.79 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.083 -0.508 . . . . 2.18 111.331 -174.062 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.461 ' HA ' ' HD3' ' A' ' 32' ' ' PRO . 17.5 tttm -77.85 127.27 82.48 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 115.932 -0.577 . . . . 2.75 110.941 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 31' ' ' LYS . 3.8 Cg_exo -72.36 151.42 53.98 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.386 2.058 . . . . 1.38 111.952 177.843 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -151.84 113.36 0.58 Allowed Glycine 0 N--CA 1.443 -0.856 0 N-CA-C 110.681 -0.967 . . . . 0.97 110.681 179.674 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.6 mtm180 -124.7 159.74 30.16 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 110.099 -0.334 . . . . 1.93 110.099 -175.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.506 ' HA ' HD22 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -99.2 84.2 2.99 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.118 0.485 . . . . 2.64 110.99 179.284 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.489 ' HA ' ' HA ' ' A' ' 146' ' ' GLU . 5.4 p -94.46 176.6 6.23 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 120.927 0.394 . . . . 0.68 111.401 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.575 ' HA ' HD11 ' A' ' 147' ' ' LEU . 37.9 t30 -63.31 -54.92 29.55 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.613 -0.721 . . . . 1.47 110.679 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -56.74 -39.85 74.7 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.771 0.319 . . . . 1.04 111.105 -178.035 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.506 HD22 ' HA ' ' A' ' 35' ' ' LYS . 0.9 OUTLIER -60.53 -58.99 6.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.057 -0.52 . . . . 0.8 111.282 -179.767 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.4 mt-30 -69.54 -26.02 64.3 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.962 -0.563 . . . . 1.75 110.721 -177.588 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.406 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 47.8 t80 -60.85 -62.95 1.48 Allowed 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.739 -0.664 . . . . 0.64 110.669 177.164 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.554 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -61.06 -30.41 70.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.726 0.298 . . . . 1.13 110.529 -173.912 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.472 ' HB2' HD22 ' A' ' 90' ' ' LEU . 7.7 tt0 -59.14 -56.24 24.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.866 -0.606 . . . . 1.3 110.836 178.351 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 -86.4 -30.42 22.14 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.99 0.424 . . . . 0.5 111.927 -176.109 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 91.7 t -88.48 -57.6 4.12 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 N-CA-C 112.423 0.527 . . . . 0.3 112.423 -174.973 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.569 HG22 ' HB3' ' A' ' 136' ' ' LYS . 50.1 t -80.46 -66.51 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 C-N-CA 120.716 -0.394 . . . . 0.26 111.712 -170.015 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.472 HG12 ' O ' ' A' ' 42' ' ' MET . 1.5 p -70.67 -34.11 55.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 C-N-CA 120.581 -0.448 . . . . 0.83 111.437 -173.658 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.4 ' O ' ' HE3' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -65.02 -34.79 79.27 Favored 'General case' 0 C--N 1.329 -0.29 0 O-C-N 122.195 -0.316 . . . . 2.4 111.578 179.345 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.0 m -77.5 -39.1 47.46 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.909 -0.316 . . . . 0.55 110.54 177.086 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.591 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -60.53 -38.05 83.19 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.246 0.546 . . . . 0.33 109.875 175.663 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 17.6 t-105 -60.76 -28.73 68.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.461 -0.79 . . . . 0.39 111.499 178.409 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.4 ' HE3' ' O ' ' A' ' 48' ' ' LYS . 4.7 mtmt -92.72 18.79 8.28 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.014 0.375 . . . . 2.24 112.014 -174.177 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.425 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 23.3 t-80 -89.48 139.12 30.85 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.963 -0.384 . . . . 0.39 109.963 175.759 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -70.76 -8.88 55.52 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.323 -0.399 . . . . 1.91 112.023 -175.47 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.425 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 1.8 m-30 -107.53 -1.49 21.27 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.96 0.409 . . . . 0.93 110.47 177.762 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.586 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -92.25 2.29 56.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.271 0.558 . . . . 0.28 110.972 -177.802 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.461 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 54.0 p-90 -63.87 -33.22 9.23 Favored Pre-proline 0 CA--C 1.547 0.855 0 N-CA-C 114.489 1.292 . . . . 0.58 114.489 -173.683 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.461 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 6.6 Cg_exo -74.59 -5.1 16.42 Favored 'Trans proline' 0 C--N 1.36 1.179 0 CA-C-N 121.296 1.499 . . . . 0.47 112.49 178.411 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -100.9 3.13 41.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.875 0.369 . . . . 1.11 110.269 -177.352 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.416 ' CZ ' ' HA ' ' A' ' 57' ' ' TRP . 16.0 m-30 -71.83 -26.15 62.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.048 -0.524 . . . . 0.63 111.159 -178.484 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.408 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -110.52 123.91 34.52 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.098 -0.501 . . . . 1.63 110.896 -174.617 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.535 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 39.1 Cg_exo -60.41 159.62 26.66 Favored 'Trans proline' 0 C--O 1.237 0.45 0 C-N-CA 122.968 2.445 . . . . 0.87 113.166 179.395 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.514 HG11 ' CD2' ' A' ' 73' ' ' TYR . 2.7 t -100.77 105.14 17.23 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 CA-C-O 121.705 0.764 . . . . 0.88 109.103 -178.575 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -114.12 2.9 15.05 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.919 -1.037 . . . . 1.85 110.885 -176.211 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 73.02 -9.03 1.18 Allowed 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 115.195 -0.911 . . . . 1.29 112.812 175.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 21.5 mm -113.96 -55.39 4.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.019 0.438 . . . . 1.89 110.666 -175.631 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.68 -40.3 88.51 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.756 -0.656 . . . . 2.99 110.611 -177.548 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.61 -5.08 57.49 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.91 -0.586 . . . . 1.66 110.564 178.221 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 58.9 t30 53.21 68.11 0.89 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.774 -0.648 . . . . 1.74 110.507 -174.707 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -130.04 65.59 75.75 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 115.603 -0.726 . . . . 1.61 110.667 -177.067 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -70.5 -30.36 18.95 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.166 1.91 . . . . 1.3 112.414 -177.422 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.23 -9.14 59.6 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.043 -0.526 . . . . 1.97 110.951 -177.805 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.514 ' CD2' HG11 ' A' ' 63' ' ' VAL . 11.9 t80 -63.55 -42.27 98.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.144 -0.48 . . . . 1.13 110.468 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -71.39 -7.82 49.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.0 -0.545 . . . . 0.91 111.637 -176.342 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 52.9 mmtt -92.5 -28.88 16.52 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.107 0.48 . . . . 2.86 110.095 -177.788 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.6 mt -101.72 -42.37 9.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.416 0.627 . . . . 1.0 110.184 178.452 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 47.8 mm -105.17 117.49 50.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 115.76 -0.655 . . . . 0.75 110.014 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.66 -15.68 34.31 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.289 -0.414 . . . . 1.99 110.697 -176.699 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -120.36 84.45 35.14 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.921 -0.582 . . . . 2.05 109.896 177.333 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -70.7 91.24 0.61 Allowed 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.604 2.203 . . . . 0.89 112.318 -176.862 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 1.6 mmt -129.39 162.51 27.87 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.03 -0.532 . . . . 0.82 110.436 -178.009 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.535 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 8.4 p-10 -146.92 -126.01 0.06 Allowed 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 114.79 -1.096 . . . . 1.42 109.082 -173.568 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -120.0 -22.01 6.87 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.139 0.495 . . . . 0.8 110.15 -178.918 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -84.64 -24.89 44.37 Favored Glycine 0 N--CA 1.442 -0.931 0 N-CA-C 110.759 -0.937 . . . . 0.32 110.759 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.68 -38.56 64.86 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 121.104 0.478 . . . . 0.95 110.252 177.371 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.581 HG23 ' SG ' ' A' ' 101' ' ' CYS . 75.9 mt -60.17 -49.27 84.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.404 -0.816 . . . . 0.97 110.046 175.255 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.89 -27.45 66.67 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.562 -0.745 . . . . 1.15 111.303 -178.623 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.536 ' HG2' HG21 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -62.48 -44.63 95.93 Favored 'General case' 0 N--CA 1.456 -0.128 0 CA-C-O 120.521 0.2 . . . . 2.46 111.301 -178.837 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 24.0 mtp180 -75.97 -29.03 58.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.638 0.256 . . . . 1.16 110.698 -179.766 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.584 ' HG ' ' OH ' ' A' ' 95' ' ' TYR . 3.9 mt -63.67 -55.52 22.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.945 -0.57 . . . . 0.49 110.91 178.429 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -72.05 -22.53 61.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.229 -0.441 . . . . 1.39 111.249 -176.852 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.408 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 4.9 m-80 -83.72 -9.04 59.11 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.491 -0.322 . . . . 1.3 110.558 178.183 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 56.71 53.8 7.96 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.604 0.716 . . . . 1.75 110.142 -178.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -81.35 -16.27 52.83 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.329 -0.85 . . . . 0.96 111.411 -175.503 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.584 ' OH ' ' HG ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -129.18 174.22 9.77 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.042 0.449 . . . . 1.28 110.936 -179.455 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 -73.64 -50.47 20.87 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.178 -0.919 . . . . 1.05 110.671 -178.667 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 29.1 t -143.55 176.74 8.97 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.033 -0.531 . . . . 1.0 110.228 -175.456 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.466 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -75.82 -7.35 54.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.475 -0.33 . . . . 0.66 111.741 -173.823 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.74 -32.23 71.52 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.937 0.398 . . . . 0.85 110.795 -179.515 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -73.26 -32.03 64.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.844 -0.617 . . . . 2.44 110.522 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.625 ' HA ' ' OD2' ' A' ' 104' ' ' ASP . 0.5 OUTLIER -75.44 -20.65 58.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.737 -0.665 . . . . 0.95 111.539 -175.94 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.38 -27.39 62.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.006 0.432 . . . . 1.13 110.182 176.555 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -71.9 -40.52 68.8 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.851 -0.613 . . . . 2.96 110.511 177.848 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ASP . . . . . 0.625 ' OD2' ' HA ' ' A' ' 101' ' ' CYS . 5.3 m-20 -66.47 -48.21 70.62 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.977 -0.556 . . . . 1.87 110.404 -179.565 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.591 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.4 OUTLIER -56.82 -42.88 80.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.873 -0.603 . . . . 0.38 110.558 179.617 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -58.69 -50.47 73.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.169 -0.468 . . . . 0.97 110.054 175.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 30.9 m -57.88 -49.09 77.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.128 -0.487 . . . . 0.43 111.315 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.31 -38.05 57.43 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.878 0.471 . . . . 0.88 111.927 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -77.87 -49.12 14.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.972 0.415 . . . . 0.29 110.167 -175.293 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.81 -36.39 80.98 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.937 -0.574 . . . . 0.66 111.61 178.044 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -49.31 -52.83 25.28 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.013 0.435 . . . . 1.84 111.201 178.525 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' CYS . . . . . 0.43 ' SG ' ' HA ' ' A' ' 123' ' ' VAL . 1.0 OUTLIER -63.95 -41.71 97.52 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.536 -0.756 . . . . 0.63 110.998 -178.753 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -63.28 -37.92 89.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.399 -0.364 . . . . 0.81 111.411 -177.403 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 55.8 mt -80.04 -48.96 19.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.451 -0.341 . . . . 0.55 111.887 -176.293 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 92.2 t80 -69.8 -26.63 64.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.75 0.31 . . . . 1.22 111.55 -174.016 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -111.46 175.8 5.28 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.15 0.5 . . . . 1.04 111.375 -173.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -97.06 152.04 38.08 Favored Pre-proline 0 C--N 1.322 -0.625 0 CA-C-N 115.543 -0.753 . . . . 3.47 110.298 -177.744 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' PRO . . . . . 0.464 ' HA ' HG11 ' A' ' 123' ' ' VAL . 18.5 Cg_endo -60.18 -21.69 67.17 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.798 2.332 . . . . 0.96 112.697 179.783 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.52 18.39 16.76 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.131 -0.486 . . . . 1.23 111.347 -179.862 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -96.7 155.71 16.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.236 -0.438 . . . . 1.34 110.361 178.648 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -71.7 -41.05 69.07 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.792 -0.64 . . . . 1.44 110.703 -175.738 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.2 tp -62.65 -34.02 62.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.99 -0.55 . . . . 0.42 110.853 -178.319 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.464 HG11 ' HA ' ' A' ' 118' ' ' PRO . 0.9 OUTLIER -68.99 -41.71 81.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.113 0.483 . . . . 0.35 109.861 177.102 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.37 -34.83 79.07 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.646 -0.707 . . . . 0.52 109.819 -179.604 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' MET . . . . . 0.562 ' O ' HD13 ' A' ' 129' ' ' LEU . 14.5 mtt -69.0 -47.09 66.37 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.257 -0.883 . . . . 0.62 110.677 179.568 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.59 -39.43 67.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.239 -0.437 . . . . 0.31 111.394 -179.391 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.76 -36.74 83.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.14 -0.482 . . . . 1.94 111.386 -178.42 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -74.95 -37.15 62.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.198 0.523 . . . . 0.32 110.319 178.68 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.586 HD21 ' HA ' ' A' ' 56' ' ' ALA . 7.6 mp -61.05 -39.85 91.4 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.264 -0.88 . . . . 0.33 110.323 178.085 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -55.0 -32.75 62.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.574 -0.739 . . . . 1.47 112.071 -176.504 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.616 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -62.59 -38.8 91.55 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 120.692 0.282 . . . . 2.24 110.676 -175.389 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 25.0 mt -72.2 -34.19 48.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.17 -0.468 . . . . 1.23 110.5 179.493 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.556 ' O ' HG23 ' A' ' 137' ' ' VAL . 30.7 t80 -60.52 -62.72 1.66 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.947 -0.57 . . . . 0.46 110.845 -178.684 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.428 ' HG ' ' H ' ' A' ' 134' ' ' LEU . 0.3 OUTLIER -64.8 -28.41 69.55 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 120.917 0.389 . . . . 0.64 110.612 -177.022 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.616 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -58.9 -57.53 12.64 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.611 -0.722 . . . . 1.61 110.777 176.626 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 136' ' ' LYS . . . . . 0.569 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -71.15 -26.48 63.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.786 -0.643 . . . . 1.52 111.081 -176.552 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' ' 133' ' ' PHE . 75.8 t -68.93 -31.87 52.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.936 0.398 . . . . 0.35 110.245 177.003 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -70.52 -12.5 61.61 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.111 0.482 . . . . 0.5 110.718 177.572 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -104.26 -1.36 27.17 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.877 -0.601 . . . . 1.76 110.333 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 140' ' ' MET . . . . . 0.475 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 0.5 OUTLIER -68.29 144.94 97.15 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 115.907 -0.588 . . . . 0.86 111.193 -178.193 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 141' ' ' PRO . . . . . 0.419 ' C ' ' H ' ' A' ' 143' ' ' GLU . 58.5 Cg_endo -73.95 91.14 0.93 Allowed 'Trans proline' 0 N--CA 1.459 -0.508 0 C-N-CA 122.4 2.067 . . . . 0.67 111.436 177.002 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -78.98 26.4 0.25 Allowed 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.633 0.73 . . . . 2.91 111.875 -176.739 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 143' ' ' GLU . . . . . 0.419 ' H ' ' C ' ' A' ' 141' ' ' PRO . 4.5 mp0 -114.13 -43.13 3.26 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-N 115.14 -0.937 . . . . 2.7 108.49 174.791 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 72.35 137.99 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 114.667 -1.151 . . . . 2.34 112.37 171.793 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -155.58 150.63 10.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 114.845 -1.07 . . . . 0.99 108.5 177.683 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.489 ' HA ' ' HA ' ' A' ' 36' ' ' THR . 0.9 OUTLIER -81.74 148.31 29.0 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 119.793 -0.763 . . . . 1.53 109.602 174.387 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.575 HD11 ' HA ' ' A' ' 37' ' ' ASN . 14.1 mt . . . . . 0 C--O 1.247 0.923 0 CA-C-O 118.581 -0.723 . . . . 1.57 110.906 -178.188 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.523 HG21 ' HG3' ' A' ' 88' ' ' LYS . 8.1 p . . . . . 0 N--CA 1.455 -0.222 0 CA-C-O 121.719 0.771 . . . . 0.93 109.596 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.491 ' HB3' ' ND2' ' A' ' 92' ' ' ASN . 66.9 p -163.7 141.8 7.57 Favored 'General case' 0 N--CA 1.439 -0.993 0 CA-C-N 114.893 -1.049 . . . . 1.61 109.21 179.179 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.459 ' HB3' ' CB ' ' A' ' 31' ' ' LYS . 39.1 t-20 -148.05 124.77 5.49 Favored Pre-proline 0 C--N 1.316 -0.86 0 CA-C-N 116.261 -0.427 . . . . 1.6 110.099 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.19 -40.13 9.19 Favored 'Trans proline' 0 N--CA 1.472 0.244 0 C-N-CA 123.093 2.529 . . . . 1.87 112.685 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.6 m -77.46 -22.68 51.0 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 116.054 -0.521 . . . . 2.18 110.363 -177.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.459 ' CB ' ' HB3' ' A' ' 28' ' ' ASN . 5.3 tttp -83.52 131.4 52.68 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.512 -0.767 . . . . 2.75 110.232 177.115 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.436 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 40.9 Cg_endo -68.3 140.5 48.87 Favored 'Trans proline' 0 N--CA 1.463 -0.3 0 C-N-CA 122.758 2.306 . . . . 1.38 112.702 177.77 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -142.45 121.58 1.8 Allowed Glycine 0 N--CA 1.446 -0.635 0 N-CA-C 110.491 -1.043 . . . . 0.97 110.491 177.118 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.444 ' HE ' ' CD ' ' A' ' 146' ' ' GLU . 0.3 OUTLIER -129.38 173.03 10.91 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 117.052 0.426 . . . . 1.93 110.877 -174.452 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -110.33 100.97 9.74 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.778 -0.646 . . . . 2.64 110.778 177.472 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.404 ' HA ' ' HA ' ' A' ' 146' ' ' GLU . 4.7 p -108.66 164.25 12.54 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.781 -0.368 . . . . 0.68 110.58 175.682 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.465 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 0.1 OUTLIER -65.72 -35.87 81.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.931 -0.577 . . . . 1.47 110.647 -179.666 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -67.43 -36.27 80.88 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 120.748 0.308 . . . . 1.04 110.505 178.162 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.43 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.6 OUTLIER -63.1 -53.7 49.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.991 -0.55 . . . . 0.8 110.648 178.971 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -68.51 -30.36 69.16 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.985 -0.552 . . . . 1.75 110.617 -179.584 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.465 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 43.3 t80 -57.9 -63.2 1.33 Allowed 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 115.846 -0.616 . . . . 0.64 110.781 176.417 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.468 ' HG2' HG21 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -60.23 -31.87 70.59 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.749 0.309 . . . . 1.13 110.915 -172.945 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.428 ' HA ' ' CG1' ' A' ' 47' ' ' VAL . 11.1 tt0 -67.41 -48.2 68.01 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.88 -0.6 . . . . 1.3 110.978 -178.449 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 66.9 m-80 -85.81 -32.41 21.79 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 112.369 0.507 . . . . 0.5 112.369 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 72.6 t -88.23 -57.4 4.28 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 N-CA-C 112.214 0.45 . . . . 0.3 112.214 -174.724 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.468 HG21 ' HG2' ' A' ' 42' ' ' MET . 78.6 t -82.6 -66.22 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 C-N-CA 120.695 -0.402 . . . . 0.26 111.864 -170.176 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.459 HG12 ' O ' ' A' ' 42' ' ' MET . 1.4 p -64.54 -36.79 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 C-N-CA 120.431 -0.508 . . . . 0.83 111.669 -174.026 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.38 -36.97 79.3 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.848 0.356 . . . . 2.4 111.037 177.416 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 56.3 m -77.88 -34.31 51.66 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.59 -0.277 . . . . 0.55 110.948 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.718 HD23 HD11 ' A' ' 132' ' ' ILE . 0.0 OUTLIER -65.47 -42.63 92.05 Favored 'General case' 0 C--N 1.332 -0.196 0 N-CA-C 109.654 -0.499 . . . . 0.33 109.654 175.275 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 21.2 t-105 -61.9 -38.54 88.74 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.743 -0.662 . . . . 0.39 111.006 178.471 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -84.42 15.37 3.71 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.018 0.377 . . . . 2.24 112.018 -175.31 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -87.3 134.47 33.55 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.557 -0.535 . . . . 0.39 109.557 175.138 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -74.9 -4.54 38.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.896 0.379 . . . . 1.91 111.782 -175.393 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.466 ' CD2' ' HG2' ' A' ' 125' ' ' MET . 3.0 m-30 -105.38 1.64 28.03 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.118 0.485 . . . . 0.93 110.202 177.065 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.727 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -101.24 12.78 36.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.173 -0.467 . . . . 0.28 111.05 -178.612 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.489 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 55.6 p-90 -65.62 -34.62 9.61 Favored Pre-proline 0 CA--C 1.546 0.822 0 N-CA-C 113.507 0.929 . . . . 0.58 113.507 -175.921 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.489 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 4.7 Cg_exo -75.01 -1.84 11.76 Favored 'Trans proline' 0 C--N 1.364 1.357 0 CA-C-N 120.924 1.366 . . . . 0.47 112.136 178.617 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -106.9 10.59 30.53 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.019 -0.537 . . . . 1.11 110.405 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 11.7 m-30 -79.57 -13.25 59.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.894 -0.593 . . . . 0.63 111.317 -178.647 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -113.55 136.55 21.97 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 116.267 -0.424 . . . . 1.63 110.712 -174.452 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.586 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 37.1 Cg_endo -67.1 140.81 55.31 Favored 'Trans proline' 0 C--O 1.239 0.532 0 C-N-CA 122.765 2.31 . . . . 0.87 112.592 -179.474 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.414 HG11 ' CD2' ' A' ' 73' ' ' TYR . 47.4 t -83.97 86.03 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 CA-C-O 122.373 1.082 . . . . 0.88 109.408 178.962 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.534 ' OD1' ' HB2' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -103.18 17.1 24.87 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 114.259 -1.337 . . . . 1.85 108.612 177.26 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 78.21 -66.08 0.22 Allowed 'General case' 0 C--O 1.215 -0.719 0 CA-C-N 113.379 -1.737 . . . . 1.29 111.254 -176.883 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 55.7 mt -75.53 -37.5 37.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 112.173 0.435 . . . . 1.89 112.173 -171.108 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.534 ' HB2' ' OD1' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -57.67 -50.03 74.53 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.044 0.387 . . . . 2.99 112.044 -177.311 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 68' ' ' LEU . 9.9 tp -95.37 -2.63 48.71 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.289 0.566 . . . . 1.66 110.151 178.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ASN . . . . . 0.458 ' O ' HD13 ' A' ' 70' ' ' LEU . 1.2 t-20 63.57 56.98 1.51 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 114.95 -1.023 . . . . 1.74 112.168 178.627 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.458 HD13 ' O ' ' A' ' 69' ' ' ASN . 1.1 mm? -122.23 78.79 43.96 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.17 -0.923 . . . . 1.61 108.89 172.281 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.18 -32.85 26.23 Favored 'Trans proline' 0 C--O 1.233 0.269 0 C-N-CA 122.336 2.024 . . . . 1.3 113.198 -172.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.12 7.21 46.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.438 -0.346 . . . . 1.97 111.202 -174.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.484 ' OH ' ' HB3' ' A' ' 111' ' ' ASN . 1.0 OUTLIER -59.16 -42.81 91.65 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.321 -0.4 . . . . 1.13 110.25 179.437 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -77.29 0.9 20.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.857 -0.61 . . . . 0.91 111.315 -175.401 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.9 mttp -97.99 -39.05 9.14 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.212 0.529 . . . . 2.86 110.327 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.6 mt -99.09 -39.73 8.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.941 -0.572 . . . . 1.0 110.766 -178.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 50.0 mm -97.3 124.89 50.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.893 -0.594 . . . . 0.75 110.171 -178.011 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.38 -17.24 30.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.342 -0.39 . . . . 1.99 111.262 -176.494 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -128.32 87.28 55.67 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-O 120.841 0.353 . . . . 2.05 110.343 177.658 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -71.36 90.51 0.68 Allowed 'Trans proline' 0 CA--C 1.528 0.203 0 C-N-CA 122.976 2.451 . . . . 0.89 111.938 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 4.0 mmt -122.33 150.49 42.31 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 121.471 0.653 . . . . 0.82 110.527 -178.375 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.586 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 1.0 OUTLIER -128.45 -119.69 0.24 Allowed 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.589 -1.187 . . . . 1.42 109.03 -177.255 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -134.03 -17.68 2.12 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.941 0.4 . . . . 0.8 110.628 174.654 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -86.99 -30.77 19.47 Favored Glycine 0 CA--C 1.502 -0.749 0 N-CA-C 109.72 -1.352 . . . . 0.32 109.72 -178.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.3 m -74.17 -26.87 60.54 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.662 -0.769 . . . . 0.95 110.159 172.328 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.6 mm -66.19 -57.41 10.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.856 -0.611 . . . . 0.97 109.766 175.746 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.16 -24.46 66.31 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.554 -0.748 . . . . 1.15 110.886 179.049 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.523 ' HG3' HG21 ' A' ' 26' ' ' VAL . 4.3 tppt? -63.17 -48.09 79.87 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 120.703 0.287 . . . . 2.46 110.565 178.925 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 11.7 mtp180 -67.77 -29.54 68.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.973 0.416 . . . . 1.16 110.818 -179.691 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 9.4 mt -72.07 -51.38 21.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.855 -0.611 . . . . 0.49 111.182 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -73.72 -19.86 60.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.819 0.342 . . . . 1.39 111.252 -176.539 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.491 ' ND2' ' HB3' ' A' ' 27' ' ' SER . 17.6 t30 -95.06 0.83 54.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.369 -0.378 . . . . 1.3 111.371 -179.087 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 56.25 65.7 1.37 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.394 0.616 . . . . 1.75 110.874 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -80.41 -47.51 14.28 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 116.122 -0.49 . . . . 0.96 111.382 178.682 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.421 ' HB3' ' OE1' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -106.32 -173.95 2.42 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.664 0.745 . . . . 1.28 111.835 -174.311 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 96' ' ' TRP . . . . . 0.436 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 2.1 t90 -83.11 -45.29 14.14 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.298 -1.319 . . . . 1.05 110.159 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 46.1 t -149.49 173.67 13.34 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.47 -0.786 . . . . 1.0 110.002 -173.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.43 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -70.84 -8.55 53.43 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.398 -0.365 . . . . 0.66 111.264 -176.639 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -37.36 76.58 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.762 -0.654 . . . . 0.85 111.005 179.433 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.44 ' O ' ' HB3' ' A' ' 103' ' ' GLN . 3.1 tt0 -81.6 -30.7 32.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.05 -0.523 . . . . 2.44 110.718 -178.756 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 13.7 t -65.19 -22.74 66.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.205 0.526 . . . . 0.95 110.834 -178.32 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.26 -24.1 66.15 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.121 -0.49 . . . . 1.13 110.224 176.589 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.588 ' HG2' ' N ' ' A' ' 104' ' ' ASP . 0.0 OUTLIER -72.06 -51.38 21.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 2.96 110.445 179.158 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ASP . . . . . 0.588 ' N ' ' HG2' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -70.63 -36.45 73.44 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.269 -0.423 . . . . 1.87 110.475 -177.491 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.698 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -60.58 -51.47 69.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.946 -0.57 . . . . 0.38 110.485 174.859 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -58.97 -41.27 87.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.891 -0.595 . . . . 0.97 110.766 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 71.1 m -56.41 -48.5 76.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.88 -0.6 . . . . 0.43 110.943 179.545 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.46 -42.9 61.92 Favored 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.439 0.462 . . . . 0.88 111.5 178.324 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -72.34 -45.04 61.62 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.43 -0.35 . . . . 0.29 111.159 -176.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.71 -36.16 82.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.132 0.492 . . . . 0.66 110.55 178.425 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ASN . . . . . 0.484 ' HB3' ' OH ' ' A' ' 73' ' ' TYR . 25.1 m-20 -53.08 -51.91 60.31 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.314 -0.857 . . . . 1.84 111.05 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 43.8 t -60.26 -40.65 91.07 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.829 -0.623 . . . . 0.63 111.379 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -71.18 -26.84 63.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.475 -0.329 . . . . 0.81 111.528 -176.077 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 56.0 mt -92.65 -53.67 8.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.875 0.369 . . . . 0.55 111.708 -177.824 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -71.03 -35.49 72.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.294 -0.412 . . . . 1.22 111.355 -174.043 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 50.3 m-20 -101.42 166.0 10.97 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.925 0.393 . . . . 1.04 110.705 -174.546 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 1.7 mmpt? -78.68 140.86 59.44 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 115.947 -0.569 . . . . 3.47 110.188 178.543 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' PRO . . . . . 0.638 ' HA ' HG11 ' A' ' 123' ' ' VAL . 28.2 Cg_endo -65.49 -8.63 19.64 Favored 'Trans proline' 0 CA--C 1.531 0.361 0 C-N-CA 122.357 2.038 . . . . 0.96 112.541 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -103.01 4.18 37.03 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.375 -0.375 . . . . 1.23 111.251 177.516 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -76.5 154.45 34.63 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.628 -0.508 . . . . 1.34 109.628 178.672 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -67.97 -33.29 74.36 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.972 -0.558 . . . . 1.44 110.205 -178.159 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.9 tp -63.27 -36.52 76.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 116.339 -0.391 . . . . 0.42 110.519 177.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.638 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.6 t -73.18 -43.31 57.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 N-CA-C 109.778 -0.453 . . . . 0.35 109.778 178.139 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.521 ' HA ' ' OE1' ' A' ' 127' ' ' GLN . 0.2 OUTLIER -61.63 -29.77 70.27 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.001 -0.545 . . . . 0.52 110.008 -179.466 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 125' ' ' MET . . . . . 0.466 ' HG2' ' CD2' ' A' ' 55' ' ' PHE . 46.7 mtt -80.63 -35.43 33.99 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.565 -0.743 . . . . 0.62 110.565 176.645 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.33 -36.81 76.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.021 -0.536 . . . . 0.31 111.592 -179.136 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' GLN . . . . . 0.521 ' OE1' ' HA ' ' A' ' 124' ' ' LEU . 18.9 mt-30 -61.22 -45.96 92.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.687 0.28 . . . . 1.94 110.638 179.319 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.85 -41.34 83.06 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.102 -0.499 . . . . 0.32 110.598 178.258 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.727 HD21 ' HA ' ' A' ' 56' ' ' ALA . 2.5 mp -58.78 -46.19 88.09 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.687 -0.688 . . . . 0.33 110.211 177.547 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -66.48 -30.05 70.29 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.672 -0.695 . . . . 1.47 111.061 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.1 OUTLIER -64.28 -43.33 95.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.221 -0.445 . . . . 2.24 110.285 -177.068 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.718 HD11 HD23 ' A' ' 50' ' ' LEU . 5.5 pt -79.93 -26.89 12.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.305 -0.407 . . . . 1.23 110.45 177.364 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.483 ' O ' HG23 ' A' ' 137' ' ' VAL . 37.7 t80 -59.57 -61.59 2.51 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.595 -0.275 . . . . 0.46 110.598 175.415 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 2.8 pp -65.03 -22.16 66.95 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.112 0.482 . . . . 0.64 110.442 -178.096 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.526 ' O ' ' HG3' ' A' ' 139' ' ' GLN . 0.8 OUTLIER -66.07 -54.09 30.17 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.596 -0.729 . . . . 1.61 109.979 177.572 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 4.7 mmtm -65.03 -33.71 76.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.61 -0.723 . . . . 1.52 110.692 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.485 ' O ' ' HB2' ' A' ' 140' ' ' MET . 78.7 t -67.16 -31.66 54.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.037 -0.529 . . . . 0.35 110.566 178.293 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.29 -19.52 64.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.058 0.456 . . . . 0.5 110.565 178.23 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 139' ' ' GLN . . . . . 0.526 ' HG3' ' O ' ' A' ' 135' ' ' GLN . 6.9 mt-30 -100.52 0.08 38.84 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.675 -0.693 . . . . 1.76 110.703 -178.787 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 140' ' ' MET . . . . . 0.485 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 0.2 OUTLIER -66.14 147.62 98.77 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.965 -0.561 . . . . 0.86 111.115 -179.411 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 141' ' ' PRO . . . . . 0.416 ' C ' ' H ' ' A' ' 143' ' ' GLU . 59.9 Cg_endo -71.35 107.01 2.05 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 C-N-CA 122.557 2.171 . . . . 0.67 112.01 -176.192 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.04 14.93 0.46 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.172 0.511 . . . . 2.91 111.372 -178.947 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 143' ' ' GLU . . . . . 0.416 ' H ' ' C ' ' A' ' 141' ' ' PRO . 0.5 OUTLIER -95.2 -40.22 9.69 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 115.74 -0.664 . . . . 2.7 109.774 178.082 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 52.8 tt0 55.24 70.06 0.67 Allowed 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.025 -0.989 . . . . 2.34 110.776 -179.045 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 1.7 t -94.6 132.34 38.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.111 -0.495 . . . . 0.99 110.241 -177.637 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.444 ' CD ' ' HE ' ' A' ' 34' ' ' ARG . 26.8 tt0 -78.21 146.0 35.22 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.739 0.304 . . . . 1.53 110.191 178.236 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 82.5 mt . . . . . 0 C--O 1.247 0.934 0 CA-C-O 118.626 -0.702 . . . . 1.57 110.118 -179.315 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 9.8 p . . . . . 0 N--CA 1.451 -0.421 0 CA-C-O 121.32 0.581 . . . . 0.93 109.879 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 33.7 m -161.55 138.26 8.4 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.369 -0.832 . . . . 1.61 109.263 -178.551 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -134.43 121.07 15.06 Favored Pre-proline 0 C--N 1.322 -0.615 0 N-CA-C 110.113 -0.328 . . . . 1.6 110.113 178.352 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -74.86 -37.28 2.2 Favored 'Trans proline' 0 N--CA 1.473 0.305 0 C-N-CA 123.414 2.743 . . . . 1.87 112.843 -178.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 16.3 m -69.46 -25.14 63.95 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 121.795 0.807 . . . . 2.18 109.64 179.4 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.4 ttmm -82.85 134.16 47.46 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 114.685 -1.143 . . . . 2.75 109.496 174.811 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.487 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 11.4 Cg_endo -56.06 133.76 60.01 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.02 1.813 . . . . 1.38 111.115 175.484 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -124.57 69.35 0.48 Allowed Glycine 0 N--CA 1.444 -0.818 0 CA-C-N 115.644 -0.707 . . . . 0.97 111.887 -171.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.424 ' HE ' ' CD ' ' A' ' 146' ' ' GLU . 0.9 OUTLIER -101.35 -179.13 3.94 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.307 -0.627 . . . . 1.93 109.307 178.37 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.51 ' O ' ' HG2' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -143.32 137.53 28.86 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.89 -0.411 . . . . 2.64 109.89 178.271 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.54 HG22 ' HG3' ' A' ' 146' ' ' GLU . 2.1 p -120.64 174.59 6.48 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.311 -0.404 . . . . 0.68 110.251 179.296 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 56.7 t-20 -50.34 -44.65 54.54 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.705 0.628 . . . . 1.47 110.158 175.558 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.434 ' HG2' ' SD ' ' A' ' 140' ' ' MET . 3.3 mt-30 -60.63 -43.1 97.9 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.227 -0.442 . . . . 1.04 110.836 179.204 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.41 ' HB2' ' H ' ' A' ' 36' ' ' THR . 1.9 tm? -55.02 -56.88 14.85 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.528 -0.76 . . . . 0.8 110.856 -178.731 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -70.88 -31.03 67.56 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.84 -0.618 . . . . 1.75 111.105 -178.426 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.528 ' CZ ' HG11 ' A' ' 45' ' ' VAL . 58.9 t80 -58.34 -63.72 1.17 Allowed 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.814 -0.63 . . . . 0.64 111.42 -179.505 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.607 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.3 OUTLIER -60.1 -30.69 69.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.618 0.247 . . . . 1.13 111.039 -172.427 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -62.29 -53.17 58.99 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.038 -0.528 . . . . 1.3 111.317 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.469 ' O ' ' HB2' ' A' ' 48' ' ' LYS . 50.3 m-80 -87.94 -29.49 20.77 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.932 0.396 . . . . 0.5 112.048 -177.579 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.528 HG11 ' CZ ' ' A' ' 41' ' ' TYR . 92.7 t -89.26 -58.66 3.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 N-CA-C 112.559 0.578 . . . . 0.3 112.559 -175.814 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.673 HG22 ' HB3' ' A' ' 136' ' ' LYS . 61.3 t -77.54 -65.12 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 C-N-CA 120.977 -0.289 . . . . 0.26 111.579 -169.246 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.474 HG12 ' O ' ' A' ' 42' ' ' MET . 1.6 p -66.51 -34.19 68.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 C-N-CA 120.512 -0.475 . . . . 0.83 111.546 -174.785 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -62.86 -35.46 80.05 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 120.559 -0.457 . . . . 2.4 111.457 177.826 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 22.8 m -77.35 -39.28 48.11 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.858 -0.337 . . . . 0.55 110.79 177.763 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.648 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -60.72 -37.97 83.49 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.221 0.534 . . . . 0.33 109.699 176.24 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 16.6 t-105 -63.78 -30.18 71.31 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.231 -0.895 . . . . 0.39 111.626 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.9 mttm -83.16 -5.94 59.3 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.197 0.443 . . . . 2.24 112.197 -173.812 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.405 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 3.7 t-80 -74.73 131.72 41.06 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.546 -0.539 . . . . 0.39 109.546 176.19 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -76.79 -11.87 59.9 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.591 -0.277 . . . . 1.91 111.397 -175.176 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.405 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 1.5 m-30 -92.87 -2.54 55.78 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.11 0.481 . . . . 0.93 110.14 176.281 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.781 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -96.78 14.26 25.76 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.111 -0.495 . . . . 0.28 110.596 179.245 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.52 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 47.6 p-90 -66.37 -33.2 6.29 Favored Pre-proline 0 CA--C 1.546 0.811 0 N-CA-C 114.016 1.117 . . . . 0.58 114.016 -174.909 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.52 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 11.7 Cg_exo -71.94 -2.05 10.92 Favored 'Trans proline' 0 C--N 1.361 1.228 0 C-N-CA 121.443 1.429 . . . . 0.47 112.328 178.825 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -111.19 15.73 21.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.272 -0.422 . . . . 1.11 110.632 -178.431 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.45 ' CE2' ' HA ' ' A' ' 57' ' ' TRP . 18.3 m-30 -83.21 -12.07 57.22 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.051 -0.522 . . . . 0.63 110.699 179.261 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.71 135.28 27.11 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.205 -0.452 . . . . 1.63 110.306 -177.919 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -71.47 147.3 51.9 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 122.718 2.279 . . . . 0.87 112.599 -177.648 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.419 HG21 ' CZ ' ' A' ' 73' ' ' TYR . 2.6 t -70.38 105.92 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.525 0 CA-C-O 121.931 0.872 . . . . 0.88 110.326 176.74 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.458 ' HB3' ' HB3' ' A' ' 67' ' ' LYS . 12.0 t70 -116.07 131.1 57.04 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 107.601 -1.259 . . . . 1.85 107.601 166.348 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.14 -16.11 61.18 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.317 -0.401 . . . . 1.29 111.462 -173.241 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.9 mt -97.42 -44.08 12.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.031 0.443 . . . . 1.89 110.663 177.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.458 ' HB3' ' HB3' ' A' ' 64' ' ' ASP . 14.8 tptm -66.0 -48.41 71.29 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.729 -0.669 . . . . 2.99 111.587 -177.019 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -101.8 1.74 37.53 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.502 -0.317 . . . . 1.66 110.701 -177.137 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 47.7 t30 58.23 55.06 5.32 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.868 -0.605 . . . . 1.74 111.332 178.436 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.0 mt -123.37 70.67 44.7 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 115.892 -0.595 . . . . 1.61 111.269 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.98 -19.78 22.77 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.158 1.905 . . . . 1.3 111.441 178.842 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -77.46 -16.44 58.76 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.322 -0.854 . . . . 1.97 110.557 -179.756 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.419 ' CZ ' HG21 ' A' ' 63' ' ' VAL . 0.8 OUTLIER -61.27 -38.17 85.77 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.371 -0.831 . . . . 1.13 111.732 -176.412 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 8.1 m-70 -83.43 -0.79 51.58 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.083 -0.508 . . . . 0.91 111.303 -169.511 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.5 mtpt -93.02 -21.51 19.7 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.141 0.496 . . . . 2.86 109.815 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mt -114.53 -49.28 5.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.51 -0.768 . . . . 1.0 111.001 -178.346 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.452 HG22 ' H ' ' A' ' 79' ' ' ASN . 33.9 mm -99.87 123.12 52.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.058 0.456 . . . . 0.75 110.44 -178.121 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.37 -9.25 51.05 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.985 -0.552 . . . . 1.99 110.891 -177.463 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.452 ' H ' HG22 ' A' ' 77' ' ' ILE . 0.2 OUTLIER -134.6 80.31 51.04 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.9 -0.591 . . . . 2.05 110.743 -179.414 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -70.7 94.7 0.61 Allowed 'Trans proline' 0 CA--C 1.529 0.26 0 C-N-CA 122.478 2.119 . . . . 0.89 112.219 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -128.13 159.78 34.07 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.167 0.508 . . . . 0.82 110.981 -176.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.2 p-10 -135.93 -126.45 0.15 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.929 -1.032 . . . . 1.42 109.742 -175.021 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.4 ttm -122.76 -18.1 6.64 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.43 -0.581 . . . . 0.8 109.43 177.116 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.432 ' HA2' ' HG2' ' A' ' 87' ' ' LYS . . . -82.13 -35.74 20.15 Favored Glycine 0 N--CA 1.44 -1.036 0 N-CA-C 109.808 -1.317 . . . . 0.32 109.808 179.484 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.8 m -72.36 -31.64 65.78 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.236 -0.482 . . . . 0.95 110.621 174.888 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.5 HD12 ' HB2' ' A' ' 104' ' ' ASP . 0.2 OUTLIER -64.67 -53.29 44.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 109.145 -0.687 . . . . 0.97 109.145 177.454 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.432 ' HG2' ' HA2' ' A' ' 84' ' ' GLY . 0.2 OUTLIER -65.39 -26.18 67.88 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.896 -0.593 . . . . 1.15 110.737 179.384 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.01 -47.21 81.19 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-O 120.81 0.338 . . . . 2.46 110.54 179.124 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 9.5 mtp180 -67.81 -31.59 71.55 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.23 -0.441 . . . . 1.16 110.619 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.3 mt -68.43 -52.27 34.57 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.061 -0.518 . . . . 0.49 111.254 178.458 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -75.66 -18.82 59.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.36 -0.382 . . . . 1.39 111.822 -175.655 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -95.27 0.05 53.44 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.749 0.309 . . . . 1.3 110.411 178.094 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 56.58 66.48 1.18 Allowed 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.614 -0.721 . . . . 1.75 110.921 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 11.3 t80 -70.76 -57.76 4.32 Favored 'General case' 0 CA--C 1.512 -0.483 0 CA-C-O 121.765 0.793 . . . . 0.96 110.725 175.44 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -103.7 -177.88 3.5 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 114.268 -1.333 . . . . 1.28 112.074 -173.901 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' TRP . . . . . 0.487 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 2.3 t-105 -79.89 -44.61 20.12 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.444 -1.253 . . . . 1.05 110.647 -177.217 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 14.5 t -146.68 175.37 10.65 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.994 -0.548 . . . . 1.0 110.971 -173.636 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.15 -14.54 60.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.253 -0.43 . . . . 0.66 111.083 -176.959 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.12 -31.22 68.74 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.479 0.657 . . . . 0.85 109.869 174.469 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.64 -39.31 45.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.365 -0.834 . . . . 2.44 110.228 177.012 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 31.7 t -62.85 -22.62 66.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.595 -0.729 . . . . 0.95 110.586 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 5.4 mtt -58.97 -21.1 57.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.89 -0.595 . . . . 1.13 110.646 175.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -76.27 -55.94 5.1 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 116.38 -0.373 . . . . 2.96 110.328 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ASP . . . . . 0.5 ' HB2' HD12 ' A' ' 86' ' ' ILE . 0.1 OUTLIER -67.07 -40.62 87.07 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.361 -0.381 . . . . 1.87 111.224 -176.21 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.648 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -59.24 -45.32 91.45 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.129 0.49 . . . . 0.38 110.548 176.623 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -64.72 -43.96 91.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.847 -0.615 . . . . 0.97 110.336 178.324 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' THR . . . . . 0.467 ' O ' ' HB3' ' A' ' 111' ' ' ASN . 57.3 m -53.98 -46.58 71.73 Favored 'General case' 0 C--N 1.332 -0.157 0 O-C-N 123.76 0.663 . . . . 0.43 111.31 -178.403 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -52.83 -40.29 63.21 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.12 -0.491 . . . . 0.88 111.07 178.195 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -74.85 -50.53 16.72 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.303 -0.408 . . . . 0.29 111.512 -177.447 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.28 -43.47 97.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.926 0.393 . . . . 0.66 111.058 -177.041 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ASN . . . . . 0.467 ' HB3' ' O ' ' A' ' 107' ' ' THR . 0.1 OUTLIER -51.76 -44.31 63.31 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.386 -0.825 . . . . 1.84 111.252 179.229 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.83 -36.01 82.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.402 -0.363 . . . . 0.63 110.842 -178.535 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -71.85 -24.32 61.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.252 -0.431 . . . . 0.81 111.395 -178.006 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 25.2 mt -89.84 -49.11 14.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.361 -0.381 . . . . 0.55 111.226 -177.386 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 88.0 t80 -69.22 -32.11 71.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.442 . . . . 1.22 111.461 -175.005 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 54.1 m-80 -108.15 169.62 8.51 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.126 0.489 . . . . 1.04 111.531 -173.016 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 11.2 mmtt -82.53 149.45 61.02 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.672 -0.694 . . . . 3.47 109.969 177.845 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' PRO . . . . . 0.568 ' HA ' HG11 ' A' ' 123' ' ' VAL . 34.2 Cg_endo -66.23 -9.6 24.26 Favored 'Trans proline' 0 CA--C 1.53 0.319 0 C-N-CA 122.576 2.184 . . . . 0.96 112.848 -177.557 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -111.53 27.67 9.46 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.822 0.344 . . . . 1.23 111.269 179.605 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' ASP . . . . . 0.471 ' OD2' HG22 ' A' ' 122' ' ' ILE . 8.6 t70 -99.85 164.58 11.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 1.34 110.705 178.255 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -64.26 -49.16 72.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.834 -0.621 . . . . 1.44 110.417 -178.632 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' ILE . . . . . 0.471 HG22 ' OD2' ' A' ' 120' ' ' ASP . 3.4 tp -61.45 -35.95 70.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.12 -0.491 . . . . 0.42 111.054 -175.517 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.568 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.4 t -70.4 -47.1 67.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 121.001 0.429 . . . . 0.35 110.157 177.682 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.2 mt -60.91 -35.25 76.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.726 -0.67 . . . . 0.52 110.238 -179.052 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 29.6 mtt -73.2 -43.36 61.46 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.757 -0.656 . . . . 0.62 110.619 179.118 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.97 -35.22 68.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.239 -0.437 . . . . 0.31 111.491 -179.522 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -62.89 -42.65 99.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.275 -0.42 . . . . 1.94 111.007 179.023 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -77.06 -39.73 48.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 0.32 110.518 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.781 HD21 ' HA ' ' A' ' 56' ' ' ALA . 2.3 mp -57.49 -39.74 77.09 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.483 -0.78 . . . . 0.33 110.757 178.954 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.6 -26.63 68.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.706 -0.679 . . . . 1.47 111.527 -177.68 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.498 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 27.6 mttt -64.9 -35.97 82.87 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.887 -0.412 . . . . 2.24 109.887 -179.64 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.464 ' H ' HG13 ' A' ' 132' ' ' ILE . 2.5 mt -74.77 -30.51 24.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.735 -0.666 . . . . 1.23 110.393 178.629 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.476 ' O ' HG23 ' A' ' 137' ' ' VAL . 49.5 t80 -59.29 -61.84 2.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.88 -0.6 . . . . 0.46 110.153 177.434 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.02 -30.07 71.32 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.102 0.477 . . . . 0.64 110.534 -178.861 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.498 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -59.49 -31.6 69.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.469 -0.787 . . . . 1.61 112.173 -180.0 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 136' ' ' LYS . . . . . 0.673 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -99.72 -22.32 15.43 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.072 0.463 . . . . 1.52 110.444 -179.504 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.648 ' O ' ' HB2' ' A' ' 140' ' ' MET . 56.1 t -77.92 -31.9 17.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.63 -0.714 . . . . 0.35 110.436 -179.329 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.24 -18.27 64.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.167 0.508 . . . . 0.5 110.419 178.342 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 139' ' ' GLN . . . . . 0.471 ' HB2' ' OH ' ' A' ' 41' ' ' TYR . 1.9 mt-30 -98.18 2.8 48.82 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.633 -0.712 . . . . 1.76 110.324 179.487 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 140' ' ' MET . . . . . 0.648 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 1.6 mtt -67.39 147.68 98.81 Favored Pre-proline 0 C--O 1.233 0.219 0 CA-C-N 115.874 -0.603 . . . . 0.86 110.667 177.85 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.31 105.7 2.09 Favored 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.222 1.948 . . . . 0.67 111.508 175.818 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.04 8.37 2.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.083 0.468 . . . . 2.91 111.487 -174.936 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -91.06 -38.82 12.55 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.846 -0.616 . . . . 2.7 109.864 178.76 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 61.8 91.31 0.06 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 114.647 -1.161 . . . . 2.34 110.641 -177.466 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 10.3 t -111.08 126.27 68.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 115.897 -0.592 . . . . 0.99 109.532 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.54 ' HG3' HG22 ' A' ' 36' ' ' THR . 4.1 tt0 -71.64 149.23 45.77 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.993 0.425 . . . . 1.53 111.135 -177.443 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 16.0 mt . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.881 -0.58 . . . . 1.57 110.555 -178.245 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.3 p . . . . . 0 N--CA 1.452 -0.341 0 CA-C-O 121.583 0.706 . . . . 0.93 109.522 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 70.8 m -160.83 145.85 14.22 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 114.963 -1.017 . . . . 1.61 109.73 178.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.479 ' HB3' ' HB2' ' A' ' 31' ' ' LYS . 24.8 t-20 -146.57 126.85 6.93 Favored Pre-proline 0 C--N 1.316 -0.852 0 N-CA-C 108.765 -0.828 . . . . 1.6 108.765 175.954 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -61.81 -46.13 14.72 Favored 'Trans proline' 0 N--CA 1.474 0.374 0 C-N-CA 123.241 2.628 . . . . 1.87 113.305 -175.024 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 6.1 m -77.55 -22.74 50.56 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.212 0.529 . . . . 2.18 110.927 -177.045 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.479 ' HB2' ' HB3' ' A' ' 28' ' ' ASN . 9.3 tttm -77.22 124.77 87.12 Favored Pre-proline 0 C--N 1.321 -0.665 0 CA-C-N 115.393 -0.821 . . . . 2.75 111.231 -177.624 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.403 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 6.0 Cg_exo -76.09 151.57 34.87 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.538 2.159 . . . . 1.38 111.975 175.754 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -136.85 136.06 8.09 Favored Glycine 0 N--CA 1.443 -0.86 0 N-CA-C 110.366 -1.094 . . . . 0.97 110.366 177.177 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.98 166.19 22.96 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.187 0.517 . . . . 1.93 111.361 -176.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -115.23 70.13 0.74 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.32 -0.854 . . . . 2.64 109.483 -179.593 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.68 HG22 ' HG3' ' A' ' 146' ' ' GLU . 2.6 p -89.0 170.02 11.02 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.84 -0.344 . . . . 0.68 110.726 -177.414 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.506 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 67.2 t30 -59.55 -47.34 85.95 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 115.939 -0.573 . . . . 1.47 110.406 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -56.0 -46.58 78.68 Favored 'General case' 0 C--O 1.233 0.231 0 O-C-N 123.296 0.373 . . . . 1.04 110.821 179.723 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.91 -59.61 5.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.103 -0.498 . . . . 0.8 111.355 -178.248 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -65.55 -28.26 69.03 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.088 -0.505 . . . . 1.75 110.613 -177.289 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.561 ' CE1' ' HG2' ' A' ' 140' ' ' MET . 36.3 t80 -60.89 -63.34 1.33 Allowed 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.172 -0.467 . . . . 0.64 110.974 176.736 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.526 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.2 OUTLIER -63.82 -28.45 69.87 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.736 -0.385 . . . . 1.13 110.648 -172.436 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.651 ' HB2' HD22 ' A' ' 90' ' ' LEU . 4.1 tt0 -66.08 -50.58 63.62 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.86 -0.609 . . . . 1.3 110.743 178.907 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.9 m-80 -86.53 -31.1 21.45 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 111.99 0.367 . . . . 0.5 111.99 -177.52 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 99.4 t -89.34 -58.47 3.47 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.924 0 N-CA-C 112.446 0.536 . . . . 0.3 112.446 -176.586 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.69 HG22 ' HB3' ' A' ' 136' ' ' LYS . 71.3 t -77.23 -66.14 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.337 -0.392 . . . . 0.26 111.685 -169.15 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.452 HG11 HD13 ' A' ' 90' ' ' LEU . 1.8 p -65.83 -36.05 76.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 C-N-CA 120.531 -0.468 . . . . 0.83 111.588 -175.185 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 7.8 mttt -63.05 -39.61 95.25 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.343 -0.543 . . . . 2.4 111.496 178.835 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.605 HG21 ' HE2' ' A' ' 136' ' ' LYS . 90.2 m -69.75 -39.33 76.8 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.729 0.299 . . . . 0.55 110.801 177.554 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.639 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -64.28 -40.29 95.65 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 109.724 -0.473 . . . . 0.33 109.724 176.391 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 51' ' ' TRP . . . . . 0.427 ' CE3' ' HE3' ' A' ' 83' ' ' MET . 15.5 t-105 -62.87 -35.91 81.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.541 -0.754 . . . . 0.39 111.025 177.937 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -81.68 9.59 7.51 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.412 -0.358 . . . . 2.24 111.873 -177.21 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.401 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 10.8 t-80 -90.05 126.46 35.78 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.299 -0.63 . . . . 0.39 109.299 173.276 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -81.97 15.46 2.28 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 112.114 0.412 . . . . 1.91 112.114 -173.279 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.401 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.3 OUTLIER -111.43 -5.3 14.62 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.205 -0.665 . . . . 0.93 109.205 171.524 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.634 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -95.57 16.93 15.83 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.579 -0.737 . . . . 0.28 110.613 179.681 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.517 ' CG ' ' HD3' ' A' ' 58' ' ' PRO . 57.9 p-90 -67.28 -35.16 8.07 Favored Pre-proline 0 CA--C 1.54 0.593 0 N-CA-C 113.527 0.936 . . . . 0.58 113.527 -175.366 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.517 ' HD3' ' CG ' ' A' ' 57' ' ' TRP . 2.9 Cg_exo -76.17 2.82 6.77 Favored 'Trans proline' 0 C--N 1.361 1.223 0 C-N-CA 121.445 1.43 . . . . 0.47 111.425 175.314 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -107.2 -4.85 18.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.396 -0.82 . . . . 1.11 110.687 -178.716 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.0 m-30 -71.15 -29.1 64.8 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.315 -0.402 . . . . 0.63 111.748 -176.868 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.75 123.39 45.88 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-N 116.269 -0.423 . . . . 1.63 111.203 -172.512 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.683 ' HB3' HG23 ' A' ' 85' ' ' THR . 25.0 Cg_exo -61.56 144.65 97.88 Favored 'Trans proline' 0 C--O 1.238 0.481 0 C-N-CA 122.686 2.258 . . . . 0.87 112.314 178.164 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 4.0 t -80.69 111.49 17.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-O 121.661 0.743 . . . . 0.88 110.633 -179.665 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.451 ' HB3' ' HG2' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -111.51 -0.09 16.31 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.043 -0.98 . . . . 1.85 109.478 177.488 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.498 ' HB2' ' NE2' ' A' ' 74' ' ' HIS . . . 78.38 -55.66 0.48 Allowed 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 114.762 -1.108 . . . . 1.29 111.5 -177.989 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.7 mp -80.41 -44.32 21.99 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 O-C-N 122.177 -0.327 . . . . 1.89 111.749 -173.142 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.451 ' HG2' ' HB3' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -64.03 -31.04 72.09 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.594 0.22 . . . . 2.99 111.594 -177.424 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.451 ' HB3' HD22 ' A' ' 70' ' ' LEU . 5.0 tp -109.81 3.61 20.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.643 0.258 . . . . 1.66 111.601 -176.482 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 58.85 59.52 2.81 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.361 0.6 . . . . 1.74 111.236 179.287 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.451 HD22 ' HB3' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -124.7 72.96 62.12 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 115.222 -0.899 . . . . 1.61 109.625 178.051 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -74.49 -58.83 0.05 OUTLIER 'Trans proline' 0 CA--C 1.531 0.34 0 C-N-CA 121.952 1.768 . . . . 1.3 112.928 -174.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -79.83 6.77 10.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.387 0.613 . . . . 1.97 111.019 -176.445 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -61.04 -38.42 86.08 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.233 -0.894 . . . . 1.13 110.613 177.929 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' HIS . . . . . 0.498 ' NE2' ' HB2' ' A' ' 65' ' ' ALA . 5.1 m-70 -80.25 -0.4 36.24 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.461 -0.79 . . . . 0.91 111.404 -175.764 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.2 mmtp -94.47 -44.24 7.98 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.658 -0.497 . . . . 2.86 109.658 -179.032 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 14.0 mt -82.99 -47.18 18.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.807 -0.633 . . . . 1.0 110.807 179.374 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.6 mm -93.53 133.64 33.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.167 -0.47 . . . . 0.75 110.056 -178.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.55 -36.28 24.12 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.136 -0.484 . . . . 1.99 110.54 -177.161 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -119.56 88.88 39.82 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 115.771 -0.65 . . . . 2.05 110.279 -179.713 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -74.46 80.57 2.24 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 122.857 2.371 . . . . 0.89 112.297 -178.35 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.63 176.52 5.14 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.358 0.599 . . . . 0.82 111.158 -178.442 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.571 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 4.4 p-10 -154.32 -129.08 0.03 OUTLIER 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 114.763 -1.108 . . . . 1.42 108.96 -172.254 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' MET . . . . . 0.469 ' SD ' HD13 ' A' ' 50' ' ' LEU . 6.7 ttp -124.69 -16.8 6.12 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.245 0.545 . . . . 0.8 110.242 -177.875 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -90.05 -29.47 15.09 Favored Glycine 0 N--CA 1.44 -1.044 0 N-CA-C 110.455 -1.058 . . . . 0.32 110.455 -178.872 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.683 HG23 ' HB3' ' A' ' 62' ' ' PRO . 0.7 OUTLIER -70.06 -42.65 72.55 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 121.258 0.552 . . . . 0.95 110.373 177.185 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 48.8 mt -61.95 -44.1 98.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.249 -0.887 . . . . 0.97 109.944 175.819 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.73 -34.56 76.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.838 -0.619 . . . . 1.15 111.44 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.0 mtpt -62.1 -49.09 77.31 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.393 0.616 . . . . 2.46 110.518 179.345 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 32.5 mtp180 -66.69 -29.38 69.36 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.382 -0.827 . . . . 1.16 111.314 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.651 HD22 ' HB2' ' A' ' 43' ' ' GLN . 6.3 mt -70.18 -51.67 29.35 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.297 -0.41 . . . . 0.49 110.883 177.917 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -73.68 -17.45 61.14 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.142 -0.481 . . . . 1.39 111.695 -175.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 14.4 t30 -100.94 1.32 39.69 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 121.028 -0.269 . . . . 1.3 110.825 178.496 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 54.77 58.92 4.41 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.937 -0.574 . . . . 1.75 111.184 178.149 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -76.51 -28.56 56.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.167 -0.47 . . . . 0.96 111.283 -178.603 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -117.36 179.76 3.95 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.119 0.485 . . . . 1.28 111.217 -177.537 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' TRP . . . . . 0.403 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 2.1 t-105 -81.34 -44.47 17.57 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.282 -0.872 . . . . 1.05 110.771 -177.071 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 36.5 t -148.12 -179.6 7.04 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.034 -0.53 . . . . 1.0 111.166 -172.887 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.45 -18.05 60.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.067 -0.515 . . . . 0.66 111.196 -176.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.38 -29.43 67.7 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.319 0.581 . . . . 0.85 110.195 177.322 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -82.34 -24.64 34.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.508 -0.769 . . . . 2.44 110.265 -179.488 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 9.6 t -83.42 -30.57 27.2 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.528 -0.76 . . . . 0.95 110.876 -178.753 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 8.8 ttm -59.01 -33.8 71.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.802 -0.635 . . . . 1.13 111.532 -177.5 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.48 -45.51 87.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.165 -0.471 . . . . 2.96 110.611 -179.54 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.26 -38.05 71.9 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.328 -0.396 . . . . 1.87 110.316 -179.422 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.639 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -57.97 -43.97 86.81 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.856 -0.611 . . . . 0.38 110.802 178.466 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 31.0 t30 -66.53 -46.29 76.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.973 -0.558 . . . . 0.97 110.08 176.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 94.2 m -57.14 -41.38 79.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.787 -0.642 . . . . 0.43 111.859 -179.234 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -54.25 -35.09 62.13 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 120.792 0.33 . . . . 0.88 111.141 177.762 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -78.97 -49.58 12.53 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.233 -0.439 . . . . 0.29 110.753 -177.626 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.77 -42.85 89.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.352 -0.385 . . . . 0.66 110.876 179.759 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -51.6 -47.1 63.73 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.589 -0.732 . . . . 1.84 111.002 178.017 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 4.4 t -62.32 -44.82 95.6 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 120.765 0.316 . . . . 0.63 110.938 177.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -65.41 -34.2 77.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.295 -0.411 . . . . 0.81 111.613 -177.421 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 54.4 mt -80.48 -52.77 13.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.468 -0.333 . . . . 0.55 111.701 -176.147 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 93.0 t80 -64.77 -35.49 81.25 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.865 0.364 . . . . 1.22 111.156 -175.179 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 -99.8 -175.98 3.13 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.084 -0.507 . . . . 1.04 110.552 -175.539 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' LYS . . . . . 0.578 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 0.2 OUTLIER -93.33 150.73 39.5 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 109.469 -0.567 . . . . 3.47 109.469 176.161 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 118' ' ' PRO . . . . . 0.403 ' HA ' HG11 ' A' ' 123' ' ' VAL . 38.2 Cg_exo -62.9 -15.35 46.81 Favored 'Trans proline' 0 N--CA 1.471 0.174 0 C-N-CA 122.29 1.993 . . . . 0.96 112.141 177.463 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.88 16.63 24.89 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.6 -0.727 . . . . 1.23 110.927 177.474 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 120' ' ' ASP . . . . . 0.578 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 0.2 OUTLIER -80.04 159.01 26.34 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 120.884 0.373 . . . . 1.34 110.569 -178.752 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -68.01 -46.72 70.47 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.726 -0.67 . . . . 1.44 110.666 -177.856 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -62.69 -37.83 80.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.123 -0.489 . . . . 0.42 110.634 179.232 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.403 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.3 t -66.12 -42.19 90.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.009 0.433 . . . . 0.35 110.252 178.703 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -33.38 72.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.843 -0.617 . . . . 0.52 109.878 179.909 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 125' ' ' MET . . . . . 0.458 ' O ' HD13 ' A' ' 129' ' ' LEU . 11.9 mtt -75.06 -47.47 28.73 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.403 -0.817 . . . . 0.62 110.515 177.001 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -55.9 -37.91 69.51 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.11 -0.495 . . . . 0.31 111.358 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -59.03 -41.4 87.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.979 -0.555 . . . . 1.94 111.043 178.268 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -76.17 -38.89 56.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.027 0.442 . . . . 0.32 110.602 178.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.634 HD21 ' HA ' ' A' ' 56' ' ' ALA . 2.3 mp -57.31 -41.76 80.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.566 -0.743 . . . . 0.33 110.399 177.787 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -61.27 -26.28 67.66 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.281 -0.872 . . . . 1.47 112.106 -176.676 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.534 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 49.4 mttm -62.64 -45.78 91.27 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 120.751 0.31 . . . . 2.24 110.38 -175.623 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.443 HD12 HD23 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -77.48 -21.89 14.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.185 -0.462 . . . . 1.23 110.903 -179.601 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.544 ' O ' HG23 ' A' ' 137' ' ' VAL . 22.0 t80 -63.43 -61.98 1.98 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.652 -0.249 . . . . 0.46 110.516 177.971 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.0 -27.2 67.95 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.115 0.484 . . . . 0.64 110.219 -178.386 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.534 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -58.87 -56.74 18.34 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.173 -0.922 . . . . 1.61 110.865 174.384 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 136' ' ' LYS . . . . . 0.69 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -66.67 -30.29 70.51 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.92 -0.582 . . . . 1.52 110.867 -177.761 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 133' ' ' PHE . 83.2 t -66.53 -34.8 72.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.146 -0.479 . . . . 0.35 110.229 176.311 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -70.84 -15.32 62.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.163 -0.472 . . . . 0.5 111.019 179.477 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 139' ' ' GLN . . . . . 0.479 ' HG3' ' O ' ' A' ' 135' ' ' GLN . 11.1 mt-30 -98.25 -6.38 31.24 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.398 -0.364 . . . . 1.76 110.596 177.816 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 140' ' ' MET . . . . . 0.561 ' HG2' ' CE1' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -66.12 159.21 72.7 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.086 -0.507 . . . . 0.86 110.453 -179.927 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -74.65 116.95 4.77 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 121.479 1.452 . . . . 0.67 110.366 174.707 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 -71.34 -2.78 17.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.514 0.673 . . . . 2.91 110.391 -178.471 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.6 -130.92 0.21 Allowed 'General case' 0 N--CA 1.432 -1.371 0 CA-C-N 114.768 -1.105 . . . . 2.7 108.861 179.843 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 178.8 132.5 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.08 -0.711 . . . . 2.34 109.08 169.641 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 2.4 t -131.66 114.45 25.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.305 -0.407 . . . . 0.99 110.118 -179.49 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.68 ' HG3' HG22 ' A' ' 36' ' ' THR . 15.8 tt0 -76.09 134.21 40.09 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 110.221 -0.288 . . . . 1.53 110.221 179.397 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 4.3 mt . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.647 -0.692 . . . . 1.57 110.346 -179.195 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.1 p . . . . . 0 N--CA 1.452 -0.355 0 CA-C-O 121.632 0.729 . . . . 0.93 109.329 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.2 m -169.87 143.37 2.58 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.706 -1.134 . . . . 1.61 108.514 178.441 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -151.91 140.21 13.33 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-O 120.555 0.216 . . . . 1.6 110.527 -178.814 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -70.76 -45.15 1.12 Allowed 'Trans proline' 0 N--CA 1.475 0.439 0 C-N-CA 123.193 2.595 . . . . 1.87 113.323 177.657 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.7 m -74.8 -28.34 60.68 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 121.206 0.527 . . . . 2.18 110.389 -176.297 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -86.31 114.84 59.61 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 115.488 -0.778 . . . . 2.75 109.015 174.347 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.498 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 5.9 Cg_exo -66.66 148.11 82.64 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 121.651 1.567 . . . . 1.38 111.812 -176.84 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -144.81 119.51 1.26 Allowed Glycine 0 N--CA 1.44 -1.045 0 N-CA-C 110.638 -0.985 . . . . 0.97 110.638 -179.194 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.3 mmm-85 -134.52 171.51 14.21 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.861 -0.422 . . . . 1.93 109.861 -176.848 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.472 ' HA ' HD22 ' A' ' 39' ' ' LEU . 26.7 ttpt -111.1 98.56 7.62 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.649 -0.5 . . . . 2.64 109.649 -179.124 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.695 HG22 ' HG3' ' A' ' 146' ' ' GLU . 2.8 p -106.15 167.25 9.94 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.748 0.309 . . . . 0.68 111.366 -178.945 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.572 ' HB3' ' O ' ' A' ' 145' ' ' VAL . 0.1 OUTLIER -66.78 -35.52 80.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.096 -0.502 . . . . 1.47 110.781 -179.582 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -70.32 -38.87 75.02 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.894 0.378 . . . . 1.04 110.34 176.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.827 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.5 OUTLIER -62.88 -52.63 62.37 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.003 -0.544 . . . . 0.8 110.339 178.253 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.95 -20.88 65.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.008 -0.542 . . . . 1.75 111.134 -179.416 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.57 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 43.4 t80 -68.31 -63.47 1.05 Allowed 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.741 -0.663 . . . . 0.64 111.33 179.851 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.551 ' HA ' HG23 ' A' ' 46' ' ' VAL . 1.5 ttm -60.37 -33.85 73.04 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 111.978 0.362 . . . . 1.13 111.978 -170.101 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.557 ' HG2' ' O ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -63.01 -48.91 76.75 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.154 0.502 . . . . 1.3 110.585 -175.423 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.544 ' O ' ' HB2' ' A' ' 48' ' ' LYS . 69.7 m-80 -85.79 -31.29 22.41 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.835 -0.621 . . . . 0.5 111.537 -178.312 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 88.3 t -89.01 -59.72 2.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 112.878 0.695 . . . . 0.3 112.878 -175.38 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.691 HG22 ' HB3' ' A' ' 136' ' ' LYS . 21.9 t -79.14 -51.82 16.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 C-N-CA 120.992 -0.283 . . . . 0.26 110.669 -171.183 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.55 HG23 ' O ' ' A' ' 42' ' ' MET . 14.7 t -58.34 -47.61 87.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.912 -0.586 . . . . 0.83 111.083 -178.03 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.544 ' HB2' ' O ' ' A' ' 44' ' ' ASN . 3.6 mttt -63.34 -29.9 71.13 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.214 0.449 . . . . 2.4 112.214 -177.474 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.489 HG21 ' HD3' ' A' ' 136' ' ' LYS . 25.5 m -73.99 -42.05 60.99 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.77 -0.372 . . . . 0.55 110.129 177.376 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.608 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -61.82 -42.18 98.71 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.609 0.719 . . . . 0.33 109.43 174.824 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 8.1 t-105 -58.48 -35.02 71.56 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.664 -1.153 . . . . 0.39 111.99 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 10.9 mtpp -91.36 12.99 18.68 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.301 0.482 . . . . 2.24 112.301 -173.766 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.419 ' ND1' ' HB2' ' A' ' 55' ' ' PHE . 15.3 t-80 -85.94 138.81 31.73 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.104 -0.332 . . . . 0.39 110.104 176.772 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.3 mm-40 -75.45 0.99 15.17 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.049 0.388 . . . . 1.91 112.049 -174.877 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.419 ' HB2' ' ND1' ' A' ' 53' ' ' HIS . 0.5 OUTLIER -111.56 -1.87 15.66 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.951 0.405 . . . . 0.93 110.638 178.238 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.449 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -100.95 16.31 25.7 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.014 0.435 . . . . 0.28 110.764 -178.826 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.539 ' CG ' ' HD3' ' A' ' 58' ' ' PRO . 63.7 p-90 -64.91 -36.34 16.12 Favored Pre-proline 0 CA--C 1.545 0.775 0 N-CA-C 113.742 1.016 . . . . 0.58 113.742 -174.204 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.539 ' HD3' ' CG ' ' A' ' 57' ' ' TRP . 60.5 Cg_endo -84.25 9.34 4.17 Favored 'Trans proline' 0 C--N 1.359 1.103 0 CA-C-N 120.873 1.347 . . . . 0.47 111.881 178.256 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -112.75 21.17 15.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.636 -0.711 . . . . 1.11 110.777 -177.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 18.2 m-30 -91.64 -16.68 26.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.481 -0.327 . . . . 0.63 111.482 -176.411 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.483 ' HB2' HD13 ' A' ' 68' ' ' LEU . 37.3 mt-30 -114.96 133.25 22.67 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 116.559 -0.291 . . . . 1.63 110.897 -173.949 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.618 ' HA ' ' OD1' ' A' ' 82' ' ' ASP . 27.3 Cg_endo -63.28 142.73 87.27 Favored 'Trans proline' 0 C--O 1.237 0.474 0 C-N-CA 122.539 2.16 . . . . 0.87 112.191 179.737 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 40.0 t -71.64 93.09 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 122.137 0.97 . . . . 0.88 110.466 178.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.42 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.0 OUTLIER -98.65 -3.08 36.87 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.653 -1.158 . . . . 1.85 108.978 175.272 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.42 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 81.38 -35.52 0.11 Allowed 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 114.155 -1.384 . . . . 1.29 111.703 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 42.9 mt -95.04 -48.52 12.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 120.676 0.274 . . . . 1.89 110.355 179.346 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.41 -38.04 58.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.736 -0.666 . . . . 2.99 112.074 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.483 HD13 ' HB2' ' A' ' 61' ' ' GLN . 6.8 tp -109.96 6.69 23.37 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.555 -0.293 . . . . 1.66 111.394 -175.459 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 59.24 51.45 6.87 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.265 0.555 . . . . 1.74 111.374 178.033 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 17.6 mt -126.97 71.7 75.59 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.83 -0.623 . . . . 1.61 110.402 179.829 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -72.47 -40.99 1.89 Allowed 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.338 2.025 . . . . 1.3 113.051 -174.446 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -92.41 26.29 2.66 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.31 0.576 . . . . 1.97 111.085 -176.016 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -70.04 -53.87 15.67 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.584 -0.734 . . . . 1.13 111.814 -178.855 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -73.96 4.99 4.6 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.796 -0.638 . . . . 0.91 112.252 -171.089 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.0 mttp -88.26 -21.82 24.27 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.591 -0.522 . . . . 2.86 109.591 179.191 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.502 HD13 ' CE1' ' A' ' 115' ' ' TYR . 2.7 mp -122.82 -48.33 2.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.692 -0.685 . . . . 1.0 110.443 -179.424 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.483 HD11 ' HB2' ' A' ' 115' ' ' TYR . 41.5 mm -83.26 124.42 39.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 120.898 0.38 . . . . 0.75 110.209 -179.698 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 10.9 mmtt -77.49 -44.88 27.36 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.88 -0.6 . . . . 1.99 110.903 -176.519 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 41.4 m-20 -113.39 97.76 44.34 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 116.197 -0.456 . . . . 2.05 110.284 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -75.12 79.4 2.7 Favored 'Trans proline' 0 CA--C 1.528 0.213 0 C-N-CA 122.9 2.4 . . . . 0.89 112.197 -178.778 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 4.0 mmt -119.25 151.57 38.17 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.281 0.562 . . . . 0.82 110.755 -177.326 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.618 ' OD1' ' HA ' ' A' ' 62' ' ' PRO . 3.2 p-10 -132.64 -112.84 0.23 Allowed 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 114.885 -1.052 . . . . 1.42 109.485 -174.094 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.6 ttm -131.66 -21.89 2.45 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 122.141 -0.349 . . . . 0.8 110.639 175.65 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -81.95 -33.08 27.74 Favored Glycine 0 N--CA 1.442 -0.902 0 N-CA-C 110.322 -1.111 . . . . 0.32 110.322 179.377 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -70.02 -35.08 74.07 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-O 121.134 0.492 . . . . 0.95 110.113 175.358 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.4 mm -56.28 -61.37 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.257 -0.883 . . . . 0.97 110.044 175.563 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.554 ' O ' ' HG3' ' A' ' 91' ' ' GLU . 0.3 OUTLIER -62.09 -28.68 69.79 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.428 -0.806 . . . . 1.15 111.609 -179.292 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 65.1 tttt -63.76 -42.65 97.78 Favored 'General case' 0 C--O 1.226 -0.154 0 C-N-CA 120.675 -0.41 . . . . 2.46 110.411 -179.349 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 6.5 mtm-85 -74.45 -24.27 59.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.93 0.395 . . . . 1.16 110.755 -177.75 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.481 HD11 ' SD ' ' A' ' 42' ' ' MET . 3.2 mt -75.32 -53.46 8.72 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.787 -0.642 . . . . 0.49 110.645 177.286 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.554 ' HG3' ' O ' ' A' ' 87' ' ' LYS . 13.2 mt-10 -69.56 -37.1 76.87 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.957 -0.565 . . . . 1.39 110.948 -176.876 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -78.55 -11.03 59.94 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.393 -0.367 . . . . 1.3 110.824 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 63.01 69.06 0.6 Allowed 'General case' 0 N--CA 1.462 0.172 0 O-C-N 123.844 0.715 . . . . 1.75 111.427 176.685 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -80.1 -47.32 14.99 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.818 -0.628 . . . . 0.96 111.145 179.737 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -117.42 -174.23 2.57 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.958 0.408 . . . . 1.28 110.999 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' TRP . . . . . 0.498 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 1.9 t-105 -67.07 -68.4 0.38 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.368 -0.833 . . . . 1.05 112.005 -175.82 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 75.3 m -121.2 168.18 11.88 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.002 -0.545 . . . . 1.0 111.582 -171.694 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.827 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -68.32 -16.87 64.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.763 -0.653 . . . . 0.66 111.352 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' SER . . . . . 0.462 ' O ' ' HB2' ' A' ' 102' ' ' MET . 0.3 OUTLIER -61.15 -26.37 67.64 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.265 -0.425 . . . . 0.85 110.993 179.409 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -38.65 64.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.208 0.528 . . . . 2.44 110.147 176.595 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.422 ' HB3' ' HE1' ' A' ' 42' ' ' MET . 0.0 OUTLIER -69.47 -21.52 63.7 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.488 -0.778 . . . . 0.95 110.367 179.679 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.805 ' HE1' HG22 ' A' ' 137' ' ' VAL . 8.5 mmt -57.23 -33.26 67.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.021 -0.536 . . . . 1.13 110.131 175.953 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 8.6 tm0? -72.52 -39.66 67.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.494 -0.776 . . . . 2.96 110.039 178.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -70.68 -38.06 73.71 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.856 -0.611 . . . . 1.87 110.323 -178.884 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.608 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -57.47 -48.53 78.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.661 -0.699 . . . . 0.38 109.919 174.26 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -59.69 -41.15 90.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.716 -0.674 . . . . 0.97 110.106 176.126 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 86.5 m -58.33 -45.97 87.11 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.672 -0.695 . . . . 0.43 111.455 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -54.47 -47.18 73.26 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.001 0.429 . . . . 0.88 110.738 176.092 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -66.19 -40.95 90.79 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.813 -0.631 . . . . 0.29 111.23 -177.723 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.82 -43.07 80.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.742 0.306 . . . . 0.66 110.247 178.457 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -49.85 -48.56 51.04 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.651 -0.704 . . . . 1.84 110.669 176.611 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 112' ' ' CYS . . . . . 0.428 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 1.5 t -62.48 -41.05 98.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.186 -0.461 . . . . 0.63 110.859 178.351 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' TYR . . . . . 0.452 ' HD1' HG22 ' A' ' 123' ' ' VAL . 12.1 m-85 -70.79 -27.11 63.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.413 -0.358 . . . . 0.81 111.625 -177.61 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 59.4 mt -85.22 -50.15 14.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 120.779 0.323 . . . . 0.55 111.395 -177.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' TYR . . . . . 0.502 ' CE1' HD13 ' A' ' 76' ' ' ILE . 1.1 t80 -86.25 36.25 0.68 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.416 0.627 . . . . 1.22 111.738 -174.867 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' ASN . . . . . 0.428 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 51.6 m-80 -157.59 -172.85 4.13 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.142 -0.936 . . . . 1.04 109.703 -179.078 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 2.5 mttp -96.39 150.06 36.64 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 109.539 -0.541 . . . . 3.47 109.539 174.276 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -59.68 -19.97 55.96 Favored 'Trans proline' 0 N--CA 1.475 0.389 0 C-N-CA 122.564 2.176 . . . . 0.96 112.798 -179.473 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -118.67 30.7 7.05 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.913 -0.585 . . . . 1.23 110.618 177.866 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' ASP . . . . . 0.429 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 1.5 t0 -84.24 173.36 11.06 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.055 0.455 . . . . 1.34 111.886 -175.425 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -67.23 -56.66 8.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.267 -0.879 . . . . 1.44 111.736 -173.195 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' ILE . . . . . 0.437 ' O ' HG13 ' A' ' 122' ' ' ILE . 1.0 OUTLIER -69.17 -29.37 42.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.978 0.418 . . . . 0.42 110.542 -179.546 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.452 HG22 ' HD1' ' A' ' 113' ' ' TYR . 2.1 t -64.44 -43.62 96.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.268 -0.424 . . . . 0.35 110.178 177.585 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.0 mt -56.28 -35.69 67.76 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 115.628 -0.715 . . . . 0.52 109.817 176.287 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' MET . . . . . 0.467 ' O ' HD13 ' A' ' 129' ' ' LEU . 30.7 mtt -73.38 -43.81 59.85 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.015 -0.993 . . . . 0.62 110.654 -178.884 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -55.1 -36.57 65.83 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.831 0.348 . . . . 0.31 111.048 178.166 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.53 -44.36 97.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.865 -0.607 . . . . 1.94 111.211 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.44 -35.29 60.96 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.082 0.468 . . . . 0.32 110.474 178.734 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.467 HD13 ' O ' ' A' ' 125' ' ' MET . 1.8 mp -62.27 -44.98 95.3 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.532 -0.758 . . . . 0.33 110.914 179.865 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -70.8 -22.28 62.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.48 -0.327 . . . . 1.47 111.727 -176.421 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 37.2 mttm -70.34 -41.73 72.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.812 0.339 . . . . 2.24 110.126 -177.813 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 129' ' ' LEU . 1.6 pt -79.88 -21.24 12.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.401 -0.363 . . . . 1.23 110.332 176.221 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.559 ' O ' HG23 ' A' ' 137' ' ' VAL . 25.1 t80 -61.58 -61.79 2.27 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.224 -0.444 . . . . 0.46 110.258 173.833 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.4 pp -64.38 -25.29 67.96 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 121.028 0.442 . . . . 0.64 110.462 -177.783 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.459 ' HB2' ' HA ' ' A' ' 132' ' ' ILE . 0.0 OUTLIER -55.75 -47.71 76.5 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.395 -0.82 . . . . 1.61 111.117 176.373 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 136' ' ' LYS . . . . . 0.691 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -82.44 -24.27 34.38 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.939 -0.573 . . . . 1.52 110.786 -178.112 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.805 HG22 ' HE1' ' A' ' 102' ' ' MET . 95.6 t -66.61 -35.87 75.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 121.299 0.571 . . . . 0.35 110.066 176.46 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.97 -17.58 64.48 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.808 -0.633 . . . . 0.5 110.606 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -101.82 3.82 39.73 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.969 -0.559 . . . . 1.76 110.811 178.876 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 140' ' ' MET . . . . . 0.472 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 24.0 mtp -72.84 146.07 87.45 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.343 -0.39 . . . . 0.86 109.973 175.876 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -68.1 116.29 4.25 Favored 'Trans proline' 0 N--CA 1.464 -0.255 0 C-N-CA 122.409 2.073 . . . . 0.67 112.291 -178.461 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -78.01 15.05 0.96 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.273 0.559 . . . . 2.91 110.615 177.971 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -99.74 -47.82 4.93 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-N 115.731 -0.668 . . . . 2.7 110.186 -178.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 61.99 89.13 0.08 Allowed 'General case' 0 C--O 1.237 0.395 0 CA-C-N 115.015 -0.993 . . . . 2.34 110.41 -174.743 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 145' ' ' VAL . . . . . 0.572 ' O ' ' HB3' ' A' ' 37' ' ' ASN . 2.8 t -104.4 115.3 46.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.461 -0.791 . . . . 0.99 109.654 178.806 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.695 ' HG3' HG22 ' A' ' 36' ' ' THR . 3.8 tt0 -68.4 147.15 52.48 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.546 -0.297 . . . . 1.53 110.887 -177.867 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 12.1 mt . . . . . 0 C--O 1.248 0.989 0 CA-C-O 118.186 -0.912 . . . . 1.57 110.922 -177.705 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.2 p . . . . . 0 N--CA 1.45 -0.431 0 CA-C-O 121.347 0.594 . . . . 0.93 109.956 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.6 m -165.78 147.59 7.21 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.31 -0.859 . . . . 1.61 109.415 179.288 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.524 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 23.0 t-20 -148.83 125.99 5.53 Favored Pre-proline 0 C--N 1.317 -0.824 0 CA-C-N 115.972 -0.558 . . . . 1.6 109.605 177.789 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -66.44 -43.32 8.23 Favored 'Trans proline' 0 N--CA 1.474 0.374 0 C-N-CA 123.375 2.717 . . . . 1.87 113.282 -175.892 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.0 m -75.4 -26.53 58.5 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-O 121.451 0.643 . . . . 2.18 110.468 -176.745 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.524 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 11.1 tttm -82.77 121.93 77.99 Favored Pre-proline 0 C--N 1.318 -0.775 0 CA-C-N 115.179 -0.918 . . . . 2.75 109.985 178.883 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.466 ' HB2' ' CZ3' ' A' ' 96' ' ' TRP . 23.1 Cg_endo -64.96 132.33 31.86 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.027 1.818 . . . . 1.38 112.116 -179.898 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -138.38 77.7 0.33 Allowed Glycine 0 N--CA 1.445 -0.707 0 CA-C-N 115.119 -0.946 . . . . 0.97 110.947 -178.162 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -85.98 148.96 25.51 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.02 0.438 . . . . 1.93 111.08 -173.992 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.79 102.56 14.78 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.955 -0.566 . . . . 2.64 110.045 176.274 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.587 HG22 ' HG3' ' A' ' 146' ' ' GLU . 1.3 p -110.51 167.23 10.37 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.911 0.386 . . . . 0.68 111.004 176.362 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.415 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 62.3 t30 -63.12 -39.92 96.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.806 -0.634 . . . . 1.47 111.264 -179.096 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.404 ' O ' ' HB3' ' A' ' 41' ' ' TYR . 9.2 tt0 -64.6 -42.86 95.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.559 -0.291 . . . . 1.04 110.521 178.262 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.479 ' O ' ' HG2' ' A' ' 43' ' ' GLN . 0.5 OUTLIER -59.01 -52.31 66.3 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.272 -0.422 . . . . 0.8 110.641 -179.754 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.442 ' O ' ' HG3' ' A' ' 43' ' ' GLN . 1.4 mt-30 -70.1 -19.98 63.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.04 -0.527 . . . . 1.75 111.186 -179.586 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.415 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 57.2 t80 -64.83 -63.34 1.14 Allowed 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.966 -0.561 . . . . 0.64 111.307 178.299 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.54 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -58.84 -34.84 72.02 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 111.879 0.326 . . . . 1.13 111.879 -170.922 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' A' ' 39' ' ' LEU . 0.5 OUTLIER -63.81 -49.59 72.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.208 0.528 . . . . 1.3 110.398 -176.192 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -85.46 -29.89 23.95 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.894 -0.594 . . . . 0.5 111.943 -177.852 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 87.8 t -89.37 -58.54 3.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 112.491 0.552 . . . . 0.3 112.491 -177.105 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.603 HG22 ' HB3' ' A' ' 136' ' ' LYS . 43.8 t -78.4 -66.06 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 120.645 0.26 . . . . 0.26 111.305 -172.055 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.491 HG13 ' O ' ' A' ' 42' ' ' MET . 2.0 m -64.17 -33.75 64.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.366 -0.379 . . . . 0.83 111.8 -173.83 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.5 mttp -69.5 -31.98 70.57 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.848 -0.341 . . . . 2.4 111.467 -178.653 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.1 m -77.22 -38.57 51.0 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.785 -0.366 . . . . 0.55 110.386 177.112 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.666 HD23 HD12 ' A' ' 132' ' ' ILE . 0.0 OUTLIER -64.43 -35.72 81.84 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 109.409 -0.589 . . . . 0.33 109.409 175.132 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 13.7 t-105 -62.79 -34.2 76.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.635 -0.711 . . . . 0.39 111.209 178.049 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.5 mttt -84.28 5.68 25.79 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.944 -0.302 . . . . 2.24 111.763 -175.554 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.481 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 14.3 t-80 -84.96 134.17 34.25 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.57 -0.53 . . . . 0.39 109.57 175.379 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -85.19 12.41 7.99 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.827 0.346 . . . . 1.91 111.829 -173.613 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.481 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.6 OUTLIER -111.97 -1.08 15.54 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.338 0.59 . . . . 0.93 109.42 172.364 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.65 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -100.9 20.21 15.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.647 -0.706 . . . . 0.28 110.534 179.45 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.559 ' CG ' ' HD3' ' A' ' 58' ' ' PRO . 40.5 p-90 -73.13 -35.41 2.76 Favored Pre-proline 0 CA--C 1.541 0.623 0 N-CA-C 113.025 0.75 . . . . 0.58 113.025 -175.835 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.559 ' HD3' ' CG ' ' A' ' 57' ' ' TRP . 2.9 Cg_exo -75.82 -1.13 11.01 Favored 'Trans proline' 0 C--N 1.361 1.208 0 C-N-CA 121.475 1.45 . . . . 0.47 110.703 174.49 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -102.98 -7.95 21.03 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 114.778 -1.101 . . . . 1.11 110.537 -178.225 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 9.0 m-30 -65.35 -50.67 64.71 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.947 -0.57 . . . . 0.63 111.365 -176.625 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.15 127.33 64.61 Favored Pre-proline 0 C--N 1.32 -0.686 0 CA-C-N 115.425 -0.807 . . . . 1.63 110.549 -174.919 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.61 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 37.8 Cg_endo -67.94 150.07 77.93 Favored 'Trans proline' 0 C--O 1.237 0.469 0 C-N-CA 122.766 2.311 . . . . 0.87 112.799 -177.355 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 4.0 t -72.02 97.97 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 122.19 0.995 . . . . 0.88 109.958 175.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -109.44 13.47 24.08 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.524 -1.217 . . . . 1.85 109.385 176.959 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.506 ' HB2' ' NE2' ' A' ' 74' ' ' HIS . . . 65.71 -73.77 0.06 Allowed 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 114.791 -1.095 . . . . 1.29 111.453 -175.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.5 mt -65.5 -39.91 86.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 120.8 0.333 . . . . 1.89 111.282 -174.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.1 -29.1 68.37 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.021 -0.536 . . . . 2.99 112.176 -177.74 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.446 HD13 ' HA ' ' A' ' 68' ' ' LEU . 0.2 OUTLIER -120.18 7.11 10.75 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.941 -0.304 . . . . 1.66 111.785 -176.47 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 66.1 t30 61.84 48.82 5.14 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.292 0.568 . . . . 1.74 111.04 -179.428 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 5.3 mt -126.04 71.4 69.18 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.047 -0.524 . . . . 1.61 111.673 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -75.7 -27.62 8.76 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 121.928 1.752 . . . . 1.3 111.83 176.183 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.0 -4.97 59.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.257 -0.429 . . . . 1.97 110.882 -179.0 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -59.53 -49.6 77.16 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.805 -0.634 . . . . 1.13 110.494 179.603 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' HIS . . . . . 0.557 ' HD1' ' HG3' ' A' ' 80' ' ' PRO . 72.1 m-70 -77.98 8.28 4.93 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.51 -0.768 . . . . 0.91 111.457 -175.311 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 24.3 mttt -99.3 -19.96 16.79 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.453 0.644 . . . . 2.86 109.595 177.269 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.0 mt -114.93 -50.31 4.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.731 -0.668 . . . . 1.0 109.99 177.494 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 24.0 mm -95.48 103.38 14.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.826 -0.625 . . . . 0.75 109.767 179.081 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.0 mttt -83.08 -11.78 57.7 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.954 -0.567 . . . . 1.99 110.48 -178.496 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 16.1 m-80 -123.93 73.05 55.0 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.67 -0.696 . . . . 2.05 109.756 174.781 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.557 ' HG3' ' HD1' ' A' ' 74' ' ' HIS . 73.4 Cg_endo -80.76 102.15 1.36 Allowed 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.534 2.156 . . . . 0.89 112.759 -175.053 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.5 mmt -130.64 152.93 49.47 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.953 -0.567 . . . . 0.82 110.292 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.61 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 1.1 p30 -139.36 -116.23 0.14 Allowed 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.061 -0.972 . . . . 1.42 109.607 -174.603 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -125.22 -27.09 3.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.053 0.454 . . . . 0.8 110.189 177.989 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.505 ' O ' ' HG3' ' A' ' 88' ' ' LYS . . . -84.28 -31.75 24.55 Favored Glycine 0 N--CA 1.441 -0.999 0 N-CA-C 110.799 -0.92 . . . . 0.32 110.799 -177.712 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -70.51 -40.85 73.29 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.928 0.394 . . . . 0.95 110.503 177.264 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.542 HG23 ' SG ' ' A' ' 101' ' ' CYS . 34.7 mt -63.81 -42.51 96.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.657 -0.701 . . . . 0.97 109.938 176.047 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.87 -33.14 72.62 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.034 -0.53 . . . . 1.15 111.147 178.081 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' A' ' 84' ' ' GLY . 35.8 mttt -62.09 -50.48 71.76 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-O 121.115 0.483 . . . . 2.46 110.628 179.766 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 16.3 mtp180 -69.69 -32.93 71.81 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.676 -0.693 . . . . 1.16 111.415 -176.587 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 8.7 mt -66.53 -54.34 24.89 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.175 -0.466 . . . . 0.49 111.316 -179.556 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -69.59 -23.33 63.52 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.258 -0.428 . . . . 1.39 111.642 -175.615 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.424 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 0.5 OUTLIER -89.37 -2.46 58.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.653 -0.249 . . . . 1.3 110.895 -179.01 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 59.73 54.41 4.43 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.242 0.544 . . . . 1.75 111.164 -179.345 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -80.35 -27.33 38.32 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.056 -0.52 . . . . 0.96 110.54 178.402 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.655 ' CD1' ' HB3' ' A' ' 100' ' ' GLU . 8.2 m-85 -96.88 178.32 5.33 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-O 121.844 0.831 . . . . 1.28 111.432 -178.496 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' TRP . . . . . 0.466 ' CZ3' ' HB2' ' A' ' 32' ' ' PRO . 2.2 t-105 -94.19 -56.12 2.95 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 113.703 -1.589 . . . . 1.05 108.872 170.372 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 67.3 m -129.19 167.98 16.83 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 114.919 -1.037 . . . . 1.0 109.597 -177.557 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -70.79 -12.29 61.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.774 0.321 . . . . 0.66 111.647 -177.229 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -21.49 66.31 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.068 -0.515 . . . . 0.85 110.591 177.995 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.655 ' HB3' ' CD1' ' A' ' 95' ' ' TYR . 2.0 tt0 -77.03 -33.22 57.41 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.054 -0.521 . . . . 2.44 109.922 179.445 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.542 ' SG ' HG23 ' A' ' 86' ' ' ILE . 0.1 OUTLIER -75.81 -22.08 56.7 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.383 -0.826 . . . . 0.95 110.724 -177.446 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 5.0 ttm -59.01 -30.95 68.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.084 -0.507 . . . . 1.13 110.454 178.083 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.07 -43.26 74.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.674 -0.694 . . . . 2.96 110.115 178.071 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -67.87 -43.39 79.51 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.756 -0.656 . . . . 1.87 110.82 -177.743 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.549 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.7 OUTLIER -60.42 -44.4 95.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.101 -0.5 . . . . 0.38 110.445 178.055 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 39.4 t30 -60.7 -39.64 89.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.048 -0.524 . . . . 0.97 110.301 177.438 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 85.3 m -68.53 -44.16 75.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.563 -0.744 . . . . 0.43 111.463 179.093 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.09 -44.09 70.91 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.174 -0.466 . . . . 0.88 111.08 178.29 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -70.3 -43.83 69.57 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.12 -0.491 . . . . 0.29 111.026 -177.313 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -66.33 -37.26 84.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.813 0.34 . . . . 0.66 110.665 -178.986 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -50.27 -51.58 43.59 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.481 -0.781 . . . . 1.84 110.901 176.785 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 2.0 t -60.86 -36.43 79.13 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.548 -0.296 . . . . 0.63 111.194 178.121 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -69.79 -27.65 65.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.434 -0.348 . . . . 0.81 111.536 -177.633 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 29.0 mt -92.13 -51.05 12.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.923 0.392 . . . . 0.55 111.618 -176.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -67.39 -38.25 84.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.28 0.562 . . . . 1.22 110.726 -177.152 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 38.8 m-20 -101.7 -172.12 2.1 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.88 -0.6 . . . . 1.04 109.669 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.31 147.28 51.82 Favored Pre-proline 0 C--N 1.32 -0.681 0 N-CA-C 110.213 -0.292 . . . . 3.47 110.213 -179.261 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 118' ' ' PRO . . . . . 0.821 ' HA ' HG11 ' A' ' 123' ' ' VAL . 52.0 Cg_exo -57.7 -20.13 41.29 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 123.013 2.475 . . . . 0.96 112.86 -179.452 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.0 21.11 2.83 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.802 -0.635 . . . . 1.23 111.687 -179.711 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -118.5 165.73 13.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.166 0.508 . . . . 1.34 111.763 177.658 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.49 -36.25 80.74 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.052 -0.976 . . . . 1.44 110.588 -179.683 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.1 tp -61.03 -40.56 86.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 CA-C-N 116.491 -0.322 . . . . 0.42 111.312 -177.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.821 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.2 t -70.18 -39.6 77.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 C-N-CA 120.57 -0.452 . . . . 0.35 110.011 177.729 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.0 -35.34 74.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.857 -0.61 . . . . 0.52 109.409 178.818 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 125' ' ' MET . . . . . 0.43 ' O ' HD13 ' A' ' 129' ' ' LEU . 38.0 mtt -68.67 -50.46 50.91 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.038 -0.983 . . . . 0.62 110.613 176.674 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -55.05 -38.57 68.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.361 -0.381 . . . . 0.31 111.106 179.299 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -60.35 -41.05 92.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.895 -0.593 . . . . 1.94 111.193 178.53 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -77.93 -39.17 43.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.997 0.427 . . . . 0.32 110.505 179.349 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.65 HD21 ' HA ' ' A' ' 56' ' ' ALA . 1.9 mp -58.99 -40.56 85.21 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.605 -0.725 . . . . 0.33 110.444 179.02 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -57.64 -29.71 64.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.294 -0.866 . . . . 1.47 111.996 -178.033 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.506 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -63.29 -39.34 94.32 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.829 0.347 . . . . 2.24 110.328 -176.778 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.666 HD12 HD23 ' A' ' 50' ' ' LEU . 11.1 mt -70.07 -28.31 35.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.981 -0.554 . . . . 1.23 110.851 -178.519 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.428 ' O ' HG23 ' A' ' 137' ' ' VAL . 26.9 t80 -62.48 -63.06 1.34 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.118 -0.492 . . . . 0.46 110.779 -179.374 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 134' ' ' LEU . . . . . 0.445 ' HG ' ' H ' ' A' ' 134' ' ' LEU . 0.0 OUTLIER -65.46 -26.53 67.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.172 0.511 . . . . 0.64 110.422 -179.102 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.506 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.94 -41.96 97.28 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.538 -0.756 . . . . 1.61 111.281 179.353 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 136' ' ' LYS . . . . . 0.603 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -92.82 -24.91 18.35 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.246 -0.434 . . . . 1.52 110.897 -177.41 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 133' ' ' PHE . 37.1 t -70.73 -33.64 53.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.316 -0.402 . . . . 0.35 110.833 -179.749 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -69.3 -12.55 61.76 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.13 0.491 . . . . 0.5 110.759 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -103.98 0.0 29.43 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.999 -0.546 . . . . 1.76 110.695 178.63 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 140' ' ' MET . . . . . 0.408 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 0.0 OUTLIER -59.89 146.84 80.88 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.109 -0.496 . . . . 0.86 110.812 178.465 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -74.47 94.61 0.92 Allowed 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 121.985 1.79 . . . . 0.67 111.034 178.848 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -84.77 31.86 0.53 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.456 0.646 . . . . 2.91 111.26 -175.495 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -116.41 -35.67 4.22 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 114.901 -1.045 . . . . 2.7 108.508 173.445 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 74.18 138.37 0.06 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 113.882 -1.508 . . . . 2.34 111.468 177.724 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 45.3 t -144.32 102.27 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.185 -0.916 . . . . 0.99 109.831 -177.705 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.587 ' HG3' HG22 ' A' ' 36' ' ' THR . 1.0 OUTLIER -67.15 138.29 56.92 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.665 -0.495 . . . . 1.53 109.665 176.576 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 6.5 mt . . . . . 0 C--O 1.251 1.135 0 CA-C-O 118.524 -0.75 . . . . 1.57 110.745 -176.786 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.2 p . . . . . 0 N--CA 1.453 -0.279 0 CA-C-O 121.671 0.748 . . . . 0.93 108.991 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 54.0 m -167.42 146.55 5.02 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.425 -1.261 . . . . 1.61 108.745 178.449 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.528 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 18.4 t-20 -135.49 129.72 18.69 Favored Pre-proline 0 C--N 1.317 -0.82 0 N-CA-C 108.879 -0.785 . . . . 1.6 108.879 176.709 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -59.79 -48.5 12.55 Favored 'Trans proline' 0 N--CA 1.472 0.264 0 C-N-CA 123.368 2.712 . . . . 1.87 113.361 -174.217 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.7 m -81.83 -28.31 33.16 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.854 0.359 . . . . 2.18 111.337 -174.454 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.528 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 0.4 OUTLIER -77.38 116.58 58.95 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.106 -0.497 . . . . 2.75 110.387 178.708 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.473 ' HB2' ' CZ3' ' A' ' 96' ' ' TRP . 6.8 Cg_exo -71.53 151.51 58.97 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.224 1.949 . . . . 1.38 112.18 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -148.66 77.69 0.23 Allowed Glycine 0 N--CA 1.444 -0.793 0 CA-C-N 115.345 -0.843 . . . . 0.97 111.111 178.884 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.3 mtm-85 -80.32 132.77 35.86 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.699 0.285 . . . . 1.93 110.247 -177.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -72.1 109.97 6.25 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.211 -0.449 . . . . 2.64 110.285 -177.6 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.963 HG22 ' HG3' ' A' ' 146' ' ' GLU . 5.3 p -107.81 166.86 10.38 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.661 -0.416 . . . . 0.68 110.513 177.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -60.26 -43.92 95.73 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 116.22 -0.446 . . . . 1.47 110.739 -179.368 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -58.53 -40.19 82.27 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.658 0.266 . . . . 1.04 110.973 -179.343 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.43 ' HB2' ' HA ' ' A' ' 97' ' ' SER . 0.6 OUTLIER -62.62 -57.57 10.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.081 -0.509 . . . . 0.8 110.956 -179.164 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -65.85 -29.61 70.1 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 115.986 -0.552 . . . . 1.75 110.848 -179.152 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 53.0 t80 -59.04 -63.89 1.14 Allowed 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.904 -0.589 . . . . 0.64 110.48 177.258 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.566 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -58.73 -33.77 70.6 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 121.124 -0.23 . . . . 1.13 110.755 -174.896 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -57.57 -55.38 35.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.006 0.431 . . . . 1.3 110.885 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 51.3 m-80 -85.99 -29.93 23.12 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.067 -0.515 . . . . 0.5 111.805 -176.76 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 99.1 t -88.4 -56.89 4.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 N-CA-C 112.284 0.476 . . . . 0.3 112.284 -174.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.704 HG22 ' HB3' ' A' ' 136' ' ' LYS . 41.5 t -82.22 -66.57 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 111.814 0.301 . . . . 0.26 111.814 -172.096 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.447 HG13 ' O ' ' A' ' 42' ' ' MET . 1.3 m -63.37 -34.62 68.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 N-CA-C 111.604 0.224 . . . . 0.83 111.604 -173.985 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.35 -36.26 81.04 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.752 -0.379 . . . . 2.4 111.496 -179.301 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.4 m -76.06 -36.77 58.89 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.782 -0.367 . . . . 0.55 110.467 177.583 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.601 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -62.13 -42.48 99.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.29 0.566 . . . . 0.33 109.547 174.451 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 22.1 t-105 -55.91 -36.14 67.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.984 -1.007 . . . . 0.39 111.292 178.215 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 9.8 mmtp -90.57 22.02 3.68 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 112.445 0.535 . . . . 2.24 112.445 -172.831 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 34.3 t-80 -88.57 148.25 24.19 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 110.077 -0.342 . . . . 0.39 110.077 174.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -73.25 -16.15 61.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.315 -0.402 . . . . 1.91 111.931 -175.092 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 19.1 m-30 -106.72 3.24 26.44 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.924 0.392 . . . . 0.93 110.764 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.664 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -92.43 5.45 50.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.136 0.493 . . . . 0.28 111.003 -178.143 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.525 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 56.3 p-90 -63.84 -36.0 18.94 Favored Pre-proline 0 CA--C 1.548 0.897 0 N-CA-C 114.214 1.19 . . . . 0.58 114.214 -173.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.525 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 19.4 Cg_endo -79.99 -9.6 14.18 Favored 'Trans proline' 0 C--N 1.359 1.097 0 CA-C-N 121.407 1.538 . . . . 0.47 112.289 -178.609 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -98.19 9.09 43.77 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.058 -0.519 . . . . 1.11 110.347 -179.349 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 5.3 m-30 -70.96 -37.37 72.78 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.751 -0.659 . . . . 0.63 111.36 -178.919 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -101.95 134.36 20.15 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.898 -0.592 . . . . 1.63 110.846 -172.497 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.65 ' HA ' ' OD1' ' A' ' 82' ' ' ASP . 34.8 Cg_exo -57.62 147.73 77.7 Favored 'Trans proline' 0 C--O 1.239 0.54 0 C-N-CA 122.674 2.249 . . . . 0.87 112.099 176.442 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 3.8 t -68.19 106.67 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 121.785 0.802 . . . . 0.88 111.307 -178.002 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -114.92 130.19 56.86 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.716 -1.129 . . . . 1.85 108.071 168.506 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.17 -2.17 14.97 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 112.265 0.468 . . . . 1.29 112.265 -171.624 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 12.1 mt -113.74 -52.0 5.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.495 0.188 . . . . 1.89 111.012 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.6 tttp -59.37 -51.06 71.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.929 0.395 . . . . 2.99 111.211 -179.195 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.25 -7.83 50.12 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.25 -0.432 . . . . 1.66 110.298 179.252 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 56.51 63.26 2.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.267 -0.879 . . . . 1.74 110.667 -176.802 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.425 HD12 ' HA ' ' A' ' 70' ' ' LEU . 0.3 OUTLIER -114.62 72.02 2.56 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 115.542 -0.754 . . . . 1.61 109.804 178.315 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -77.85 -51.09 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.467 2.111 . . . . 1.3 112.979 -173.666 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -72.87 -13.07 61.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.369 0.604 . . . . 1.97 110.538 -178.244 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -58.98 -39.99 83.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.084 -0.962 . . . . 1.13 110.899 178.529 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -75.27 -2.42 28.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.691 -0.686 . . . . 0.91 111.755 -175.152 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -104.59 -53.59 2.67 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.072 0.463 . . . . 2.86 110.443 -177.265 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.1 mp -76.55 -38.82 32.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.733 -0.667 . . . . 1.0 110.752 -177.506 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.474 HD11 ' HB2' ' A' ' 115' ' ' TYR . 47.8 mm -94.51 125.77 47.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 109.941 -0.392 . . . . 0.75 109.941 179.355 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.68 -28.24 33.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.278 -0.419 . . . . 1.99 111.128 -175.39 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 18.9 m-80 -132.83 81.07 59.38 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.433 -0.349 . . . . 2.05 110.431 178.328 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -68.65 95.34 0.46 Allowed 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 123.028 2.485 . . . . 0.89 111.863 179.56 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 5.8 mmt -127.46 160.82 30.31 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-O 121.39 0.614 . . . . 0.82 110.313 -178.364 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.65 ' OD1' ' HA ' ' A' ' 62' ' ' PRO . 2.5 p-10 -136.62 -134.27 0.14 Allowed 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 114.65 -1.159 . . . . 1.42 109.61 -170.472 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -123.36 -14.75 7.35 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.172 0.511 . . . . 0.8 109.849 -177.951 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -89.54 -32.39 10.34 Favored Glycine 0 N--CA 1.442 -0.916 0 N-CA-C 109.65 -1.38 . . . . 0.32 109.65 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 94.5 m -67.19 -42.33 84.36 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 114.916 -0.642 . . . . 0.95 110.823 174.729 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 43.4 mt -62.22 -45.79 97.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.031 0.443 . . . . 0.97 110.116 177.126 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.491 ' HG3' ' N ' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -64.81 -31.66 72.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.133 -0.485 . . . . 1.15 110.712 178.316 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.491 ' N ' ' HG3' ' A' ' 87' ' ' LYS . 16.5 tttp -63.62 -43.31 97.21 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 121.278 0.561 . . . . 2.46 110.755 179.232 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 10.2 mtp180 -76.22 -31.03 58.17 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.812 -0.631 . . . . 1.16 111.1 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 4.5 mt -64.8 -51.46 62.05 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.028 -0.533 . . . . 0.49 111.011 177.669 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -66.83 -31.25 71.74 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.873 -0.603 . . . . 1.39 111.597 -177.109 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -92.68 5.08 52.35 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.923 -0.311 . . . . 1.3 111.455 -177.875 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 60.41 55.13 3.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.906 -0.588 . . . . 1.75 111.8 175.54 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -82.08 -22.39 36.32 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.338 0.59 . . . . 0.96 110.133 175.509 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' TYR . . . . . 0.6 ' CD1' ' HB3' ' A' ' 100' ' ' GLU . 46.5 m-85 -99.02 169.52 9.36 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.723 0.773 . . . . 1.28 112.151 -174.62 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' TRP . . . . . 0.473 ' CZ3' ' HB2' ' A' ' 32' ' ' PRO . 2.0 t90 -96.72 -38.1 10.04 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-N 113.994 -1.457 . . . . 1.05 108.688 169.51 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.43 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 8.6 t -155.88 168.54 26.88 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 115.544 -0.753 . . . . 1.0 110.166 -175.711 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -72.67 -9.4 58.58 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.481 -0.327 . . . . 0.66 111.634 -175.322 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.15 -21.76 65.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.1 0.476 . . . . 0.85 109.89 175.094 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.6 ' HB3' ' CD1' ' A' ' 95' ' ' TYR . 1.0 OUTLIER -78.16 -42.57 31.27 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.757 -0.831 . . . . 2.44 108.757 175.341 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 29.9 m -61.91 -34.84 76.79 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.054 -0.975 . . . . 0.95 110.627 177.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 3.2 ttm -58.35 -35.27 71.68 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.604 -0.725 . . . . 1.13 110.582 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -70.73 -41.21 72.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.884 -0.598 . . . . 2.96 110.123 179.251 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -68.83 -43.73 74.91 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.753 -0.658 . . . . 1.87 110.47 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.601 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.6 OUTLIER -58.31 -46.04 86.89 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.026 -0.534 . . . . 0.38 110.058 176.421 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 14.6 t30 -56.71 -45.25 81.98 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.682 -0.69 . . . . 0.97 110.018 176.259 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 91.4 m -64.77 -45.99 84.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.974 -0.557 . . . . 0.43 111.504 179.42 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.06 -42.68 77.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.85 0.357 . . . . 0.88 110.66 178.233 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -72.89 -50.31 24.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.021 -0.536 . . . . 0.29 110.526 -178.013 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' THR . . . . . 0.41 ' O ' HG13 ' A' ' 114' ' ' ILE . 5.0 p -59.86 -35.98 75.91 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 116.373 -0.376 . . . . 0.66 111.047 -178.175 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -52.65 -42.9 65.1 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.136 -0.484 . . . . 1.84 110.679 178.571 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 112' ' ' CYS . . . . . 0.611 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 0.0 OUTLIER -73.81 -26.9 60.85 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.869 -0.605 . . . . 0.63 110.875 -179.207 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -85.47 -15.87 41.49 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.862 0.363 . . . . 0.81 111.194 -179.615 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' ILE . . . . . 0.41 HG13 ' O ' ' A' ' 110' ' ' THR . 70.0 mt -89.19 -57.66 4.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.211 -0.45 . . . . 0.55 110.744 178.816 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 115' ' ' TYR . . . . . 0.474 ' HB2' HD11 ' A' ' 77' ' ' ILE . 45.4 t80 -67.55 -51.59 48.87 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.853 -0.612 . . . . 1.22 110.563 -176.948 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' ASN . . . . . 0.611 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 28.6 m120 -79.59 176.3 9.83 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.592 -0.731 . . . . 1.04 110.707 -178.194 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 117' ' ' LYS . . . . . 0.422 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 0.0 OUTLIER -101.1 153.24 37.87 Favored Pre-proline 0 C--N 1.321 -0.654 0 N-CA-C 109.329 -0.619 . . . . 3.47 109.329 177.786 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 118' ' ' PRO . . . . . 0.583 ' HA ' HG11 ' A' ' 123' ' ' VAL . 28.7 Cg_endo -64.44 2.74 1.06 Allowed 'Trans proline' 0 CA--C 1.535 0.548 0 C-N-CA 122.584 2.189 . . . . 0.96 112.686 178.168 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.31 5.03 13.51 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.165 -0.47 . . . . 1.23 110.609 177.299 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 120' ' ' ASP . . . . . 0.422 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 0.9 OUTLIER -75.5 164.08 26.73 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.215 0.531 . . . . 1.34 111.923 -173.407 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.7 -55.52 22.74 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.994 -1.003 . . . . 1.44 110.603 -178.134 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' ILE . . . . . 0.406 ' H ' HG22 ' A' ' 122' ' ' ILE . 0.9 OUTLIER -62.78 -34.48 65.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.569 -0.741 . . . . 0.42 111.114 -179.627 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.583 HG11 ' HA ' ' A' ' 118' ' ' PRO . 1.5 t -64.75 -40.07 87.8 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-O 121.004 0.431 . . . . 0.35 110.312 178.763 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.1 -29.39 68.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.292 0.567 . . . . 0.52 110.055 176.736 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 125' ' ' MET . . . . . 0.44 ' O ' HD13 ' A' ' 129' ' ' LEU . 10.4 mtt -80.4 -48.04 13.5 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.591 -0.731 . . . . 0.62 110.438 178.563 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -53.91 -39.08 65.5 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.151 -0.477 . . . . 0.31 111.387 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -56.72 -42.87 79.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.31 -0.405 . . . . 1.94 111.301 178.077 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.99 -41.79 50.17 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.023 -0.535 . . . . 0.32 110.95 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.664 HD21 ' HA ' ' A' ' 56' ' ' ALA . 8.5 mp -57.88 -44.51 86.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.649 -0.705 . . . . 0.33 110.41 177.636 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -57.78 -26.96 62.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.116 -0.947 . . . . 1.47 111.902 -177.377 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.452 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -68.24 -41.46 81.16 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.648 -0.251 . . . . 2.24 110.479 -176.878 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 15.5 mt -69.24 -31.99 51.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.884 0.373 . . . . 1.23 110.17 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.413 ' O ' HG23 ' A' ' 137' ' ' VAL . 39.4 t80 -60.28 -61.94 2.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.776 -0.647 . . . . 0.46 110.599 178.347 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.8 pp -64.87 -28.12 69.33 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.907 0.384 . . . . 0.64 110.638 -177.725 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.452 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.7 OUTLIER -59.73 -56.58 20.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.688 -0.687 . . . . 1.61 110.778 178.726 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 136' ' ' LYS . . . . . 0.704 ' HB3' HG22 ' A' ' 46' ' ' VAL . 1.2 mptp? -76.75 -20.46 56.46 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.768 -0.651 . . . . 1.52 111.138 -176.793 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.513 ' HA ' ' HG3' ' A' ' 140' ' ' MET . 23.1 t -73.97 -32.27 32.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.848 0.356 . . . . 0.35 110.289 178.445 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -65.13 -20.28 66.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.093 0.473 . . . . 0.5 110.14 176.757 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -97.24 -0.64 46.37 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.767 -0.651 . . . . 1.76 110.954 -178.323 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 140' ' ' MET . . . . . 0.513 ' HG3' ' HA ' ' A' ' 137' ' ' VAL . 0.6 OUTLIER -68.54 151.31 97.31 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.258 -0.428 . . . . 0.86 111.397 -178.967 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -72.87 106.56 2.16 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.583 2.189 . . . . 0.67 111.207 177.814 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.45 27.52 1.08 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.196 0.522 . . . . 2.91 111.726 -173.331 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -115.2 -38.93 3.72 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 115.383 -0.826 . . . . 2.7 109.536 176.398 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 71.78 95.76 0.07 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 114.986 -1.007 . . . . 2.34 111.106 176.61 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 1.7 t -112.4 139.09 38.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.847 -0.615 . . . . 0.99 109.959 178.787 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.963 ' HG3' HG22 ' A' ' 36' ' ' THR . 1.2 mt-10 -80.06 146.45 31.93 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.791 0.329 . . . . 1.53 110.825 179.192 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 51.3 mt . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.575 -0.726 . . . . 1.57 110.689 -178.736 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.448 -0.559 0 CA-C-O 121.093 0.473 . . . . 0.93 110.165 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.3 m -166.3 135.61 3.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.624 -0.717 . . . . 1.61 110.086 -179.137 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -140.69 123.7 9.98 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 115.782 -0.645 . . . . 1.6 110.019 -179.008 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -79.91 -30.05 2.44 Favored 'Trans proline' 0 N--CA 1.475 0.41 0 C-N-CA 123.354 2.703 . . . . 1.87 112.8 177.951 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.4 t -76.43 -20.69 56.82 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.465 0.65 . . . . 2.18 109.571 -178.355 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.4 tttm -105.26 136.17 19.23 Favored Pre-proline 0 C--N 1.316 -0.865 0 CA-C-N 115.165 -0.925 . . . . 2.75 109.345 177.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.467 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 19.7 Cg_endo -60.21 137.87 77.78 Favored 'Trans proline' 0 C--O 1.239 0.53 0 C-N-CA 122.417 2.078 . . . . 1.38 112.274 178.873 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -141.12 78.04 0.29 Allowed Glycine 0 N--CA 1.446 -0.685 0 CA-C-N 115.089 -0.959 . . . . 0.97 110.869 -179.584 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.502 ' HG3' ' CE2' ' A' ' 96' ' ' TRP . 0.3 OUTLIER -93.86 174.26 7.26 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 110.291 -0.263 . . . . 1.93 110.291 -177.04 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.4 ttpp -120.53 107.02 12.35 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.821 0.344 . . . . 2.64 110.507 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.456 ' HB ' ' O ' ' A' ' 145' ' ' VAL . 7.3 p -107.5 165.39 11.44 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.689 -0.404 . . . . 0.68 110.232 177.188 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.474 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 62.5 t30 -58.15 -38.93 77.54 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.917 -0.583 . . . . 1.47 110.684 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -65.14 -39.53 93.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.03 -0.532 . . . . 1.04 110.996 -178.729 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.475 ' HB2' ' HA ' ' A' ' 97' ' ' SER . 0.9 OUTLIER -60.19 -58.84 6.78 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.216 -0.447 . . . . 0.8 110.809 -178.89 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 20.8 mt-30 -66.82 -26.51 66.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.961 -0.563 . . . . 1.75 110.981 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.474 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 56.6 t80 -60.25 -63.69 1.21 Allowed 'General case' 0 C--O 1.22 -0.498 0 CA-C-N 116.182 -0.463 . . . . 0.64 110.378 176.216 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.52 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -60.24 -28.56 68.13 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 116.593 -0.276 . . . . 1.13 111.0 -174.47 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.481 ' O ' HG13 ' A' ' 47' ' ' VAL . 6.0 tt0 -62.71 -55.9 22.51 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.034 0.445 . . . . 1.3 111.288 177.687 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -86.56 -26.44 24.5 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.857 0.361 . . . . 0.5 111.963 -176.514 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 94.7 t -88.8 -57.59 4.12 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 N-CA-C 111.928 0.344 . . . . 0.3 111.928 -177.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.708 HG22 ' HB3' ' A' ' 136' ' ' LYS . 58.5 t -81.97 -64.45 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 112.33 0.493 . . . . 0.26 112.33 -169.243 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' VAL . . . . . 0.481 HG13 ' O ' ' A' ' 43' ' ' GLN . 0.7 OUTLIER -66.81 -30.81 50.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 C-N-CA 120.21 -0.596 . . . . 0.83 110.967 -175.162 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -62.37 -42.25 99.27 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 120.919 -0.312 . . . . 2.4 111.304 177.555 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.441 HG21 ' HE2' ' A' ' 136' ' ' LYS . 2.8 p -69.42 -33.57 73.17 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 120.807 0.337 . . . . 0.55 110.876 179.513 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.611 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.2 OUTLIER -67.8 -41.48 83.11 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.997 -0.547 . . . . 0.33 109.698 176.439 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 15.0 t-105 -59.02 -36.78 75.54 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.153 -0.931 . . . . 0.39 111.538 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.8 mttm -82.98 7.69 14.86 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.025 0.38 . . . . 2.24 112.025 -174.745 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.444 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 13.1 t-80 -89.12 131.53 35.22 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.927 -0.397 . . . . 0.39 109.927 176.386 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -80.1 21.58 0.57 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.289 -0.414 . . . . 1.91 111.702 -175.257 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.444 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.2 OUTLIER -126.07 -6.43 6.64 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.3 0.571 . . . . 0.93 109.629 174.432 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.669 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -97.61 10.63 39.42 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.456 0.646 . . . . 0.28 110.264 179.514 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.467 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 57.4 p-90 -68.67 -31.68 3.14 Favored Pre-proline 0 CA--C 1.545 0.78 0 N-CA-C 113.954 1.094 . . . . 0.58 113.954 -175.608 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' PRO . . . . . 0.467 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 16.7 Cg_exo -68.52 -13.19 36.8 Favored 'Trans proline' 0 C--N 1.363 1.335 0 CA-C-N 121.193 1.462 . . . . 0.47 112.103 178.246 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.479 ' CE2' HD11 ' A' ' 122' ' ' ILE . 2.4 m-85 -104.19 11.64 34.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.272 -0.422 . . . . 1.11 110.964 -178.546 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.417 ' CD1' ' HA ' ' A' ' 57' ' ' TRP . 2.6 m-30 -66.08 -43.91 85.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.089 -0.505 . . . . 0.63 111.433 -178.839 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -95.7 133.49 25.51 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.873 -0.603 . . . . 1.63 110.432 -175.611 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.456 ' HA ' ' OD1' ' A' ' 82' ' ' ASP . 18.3 Cg_endo -61.11 133.33 46.38 Favored 'Trans proline' 0 C--O 1.237 0.448 0 C-N-CA 122.783 2.322 . . . . 0.87 112.232 -179.755 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 1.7 t -68.65 113.16 4.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.868 0.842 . . . . 0.88 110.784 179.34 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.434 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.3 OUTLIER -109.97 -0.88 17.97 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.803 -1.09 . . . . 1.85 109.39 177.216 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.434 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 78.03 -72.99 0.08 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 114.631 -1.168 . . . . 1.29 110.054 -171.189 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 31.1 mm -68.22 -44.64 83.93 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 116.577 -0.283 . . . . 1.89 111.585 -173.069 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 3.2 tptp -63.51 -19.9 65.16 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.307 0.484 . . . . 2.99 112.307 -176.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.458 ' HB3' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -114.02 10.16 17.47 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 122.19 -0.318 . . . . 1.66 111.173 -179.684 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 61.23 42.53 11.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.611 0.72 . . . . 1.74 110.637 179.241 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.458 HD22 ' HB3' ' A' ' 68' ' ' LEU . 0.2 OUTLIER -119.51 73.93 16.27 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 114.943 -1.026 . . . . 1.61 110.555 -175.618 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -79.51 -34.48 1.03 Allowed 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 121.731 1.621 . . . . 1.3 112.967 -176.5 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -89.71 1.86 55.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.345 0.593 . . . . 1.97 110.785 -176.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.451 ' HB2' ' HB3' ' A' ' 70' ' ' LEU . 8.7 t80 -61.85 -50.47 72.12 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.473 -0.785 . . . . 1.13 111.029 -178.803 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -75.75 2.9 10.91 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.536 -0.757 . . . . 0.91 111.529 -174.581 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.7 mttt -89.91 -25.23 21.06 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.317 0.58 . . . . 2.86 110.015 178.947 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.5 mt -111.91 -45.86 5.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.574 -0.739 . . . . 1.0 110.292 -178.571 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 35.1 mm -94.66 121.84 45.6 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-N 116.005 -0.543 . . . . 0.75 110.257 -178.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.513 ' O ' ' HD3' ' A' ' 80' ' ' PRO . 0.0 OUTLIER -88.87 -26.12 21.79 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.956 -0.565 . . . . 1.99 110.553 -177.654 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -113.18 84.72 7.54 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 115.953 -0.567 . . . . 2.05 109.922 177.726 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' PRO . . . . . 0.513 ' HD3' ' O ' ' A' ' 78' ' ' LYS . 6.4 Cg_exo -73.32 94.17 0.83 Allowed 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.98 2.453 . . . . 0.89 112.137 -177.188 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -130.62 155.79 45.97 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.274 0.559 . . . . 0.82 110.739 -178.655 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.456 ' OD1' ' HA ' ' A' ' 62' ' ' PRO . 1.7 p-10 -140.61 -119.78 0.12 Allowed 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.876 -1.057 . . . . 1.42 109.098 -175.793 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 5.2 ttp -130.21 -20.0 3.09 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.912 0.387 . . . . 0.8 110.547 177.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -85.63 -30.25 24.64 Favored Glycine 0 N--CA 1.44 -1.068 0 N-CA-C 110.442 -1.063 . . . . 0.32 110.442 -179.36 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.77 -47.44 62.93 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.504 -0.348 . . . . 0.95 110.363 175.868 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.543 HG23 ' SG ' ' A' ' 101' ' ' CYS . 58.4 mt -56.3 -46.97 81.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.61 -0.723 . . . . 0.97 110.126 176.652 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.466 ' O ' ' HG2' ' A' ' 91' ' ' GLU . 0.0 OUTLIER -67.74 -34.89 77.73 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 115.772 -0.649 . . . . 1.15 110.614 -178.508 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.431 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 21.3 tptt -67.05 -34.77 78.39 Favored 'General case' 0 C--N 1.339 0.124 0 CA-C-O 120.828 0.347 . . . . 2.46 110.544 -178.567 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 7.4 mtp180 -73.25 -33.5 65.31 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.032 0.444 . . . . 1.16 110.468 177.324 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 9.3 mt -68.0 -51.34 48.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.901 -0.591 . . . . 0.49 111.239 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 0.5 OUTLIER -66.13 -26.03 67.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.934 0.397 . . . . 1.39 111.101 -178.089 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ASN . . . . . 0.431 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 1.7 m-80 -90.95 5.98 46.54 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.261 -0.427 . . . . 1.3 111.012 -179.022 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 49.7 51.67 16.05 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 121.381 0.61 . . . . 1.75 111.351 -178.843 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -74.32 -21.96 59.47 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.429 0.633 . . . . 0.96 110.657 177.87 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -102.7 170.24 8.13 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.862 0.839 . . . . 1.28 112.017 -174.125 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' TRP . . . . . 0.502 ' CE2' ' HG3' ' A' ' 34' ' ' ARG . 2.1 t90 -85.73 -42.11 14.52 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 113.538 -1.664 . . . . 1.05 108.805 168.411 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.475 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 23.2 t -155.79 176.3 12.81 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.754 -1.112 . . . . 1.0 109.944 -171.782 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.26 -15.37 61.42 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.869 0.366 . . . . 0.66 110.793 -177.87 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.48 -30.91 69.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.131 0.491 . . . . 0.85 110.508 176.12 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -75.88 -30.83 58.98 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.541 -0.754 . . . . 2.44 109.883 -179.32 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' CYS . . . . . 0.543 ' SG ' HG23 ' A' ' 86' ' ' ILE . 0.5 OUTLIER -81.81 -22.11 37.28 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.596 -0.729 . . . . 0.95 110.43 -177.994 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 7.5 mmt -53.33 -35.29 60.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.655 -0.702 . . . . 1.13 110.617 177.558 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.13 -50.32 48.99 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.552 -0.749 . . . . 2.96 110.072 -178.738 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -64.53 -40.44 95.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.946 -0.57 . . . . 1.87 110.809 -176.772 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.611 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -61.8 -44.93 95.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.464 . . . . 0.38 110.629 177.791 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.13 -41.32 99.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.129 -0.487 . . . . 0.97 110.202 177.709 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 54.9 m -63.38 -47.68 81.04 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.722 -0.672 . . . . 0.43 111.71 -178.322 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.416 ' HG3' ' N ' ' A' ' 109' ' ' PHE . 0.0 OUTLIER -58.85 -35.72 73.39 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.601 0.239 . . . . 0.88 111.206 -177.907 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 109' ' ' PHE . . . . . 0.416 ' N ' ' HG3' ' A' ' 108' ' ' MET . 6.1 m-85 -72.3 -49.22 36.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.022 0.439 . . . . 0.29 110.802 -178.094 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -67.93 -33.36 74.53 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.099 -0.501 . . . . 0.66 110.792 -177.748 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -53.01 -42.79 65.97 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.382 -0.826 . . . . 1.84 111.023 177.582 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -67.61 -40.06 84.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.08 0.466 . . . . 0.63 110.419 179.806 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -69.38 -19.06 63.83 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.239 -0.437 . . . . 0.81 111.269 -178.497 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 69.5 mt -92.18 -49.64 12.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.26 -0.427 . . . . 0.55 110.847 179.604 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -68.55 -38.44 80.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.922 -0.581 . . . . 1.22 110.831 -176.889 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' ASN . . . . . 0.42 ' HB2' HG23 ' A' ' 123' ' ' VAL . 18.3 m120 -99.99 177.9 4.96 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.033 -0.531 . . . . 1.04 110.812 -176.611 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -104.37 158.33 32.18 Favored Pre-proline 0 C--N 1.322 -0.623 0 N-CA-C 109.252 -0.647 . . . . 3.47 109.252 175.527 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 118' ' ' PRO . . . . . 0.77 ' HA ' HG11 ' A' ' 123' ' ' VAL . 22.7 Cg_exo -63.11 -7.54 12.03 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.365 2.043 . . . . 0.96 112.681 178.718 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.56 5.37 47.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.048 -0.523 . . . . 1.23 111.284 177.855 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -91.54 146.99 23.34 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.088 0.47 . . . . 1.34 111.367 -174.877 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -57.34 -46.72 83.0 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.075 -0.966 . . . . 1.44 111.282 -176.922 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' ILE . . . . . 0.479 HD11 ' CE2' ' A' ' 59' ' ' PHE . 0.9 OUTLIER -65.67 -32.16 56.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.132 -0.485 . . . . 0.42 111.075 -177.473 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.77 HG11 ' HA ' ' A' ' 118' ' ' PRO . 1.0 OUTLIER -66.1 -44.07 92.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.194 0.521 . . . . 0.35 109.686 176.192 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.81 -32.04 71.41 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.519 -0.764 . . . . 0.52 109.91 178.328 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 125' ' ' MET . . . . . 0.423 ' O ' HD13 ' A' ' 129' ' ' LEU . 23.3 mtt -73.13 -45.32 57.53 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.471 -0.786 . . . . 0.62 110.57 179.171 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.04 -36.1 67.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.894 0.378 . . . . 0.31 111.236 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' GLN . . . . . 0.418 ' O ' ' HD2' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.21 -49.17 78.69 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.063 -0.517 . . . . 1.94 111.099 178.618 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -70.57 -37.1 73.91 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.08 0.467 . . . . 0.32 110.516 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.669 HD21 ' HA ' ' A' ' 56' ' ' ALA . 1.8 mp -59.55 -45.49 91.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.352 -0.84 . . . . 0.33 111.247 -179.138 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -65.95 -22.05 66.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.287 -0.415 . . . . 1.47 111.917 -174.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' LYS . . . . . 0.508 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.6 OUTLIER -64.67 -39.81 94.32 Favored 'General case' 0 CA--C 1.518 -0.255 0 N-CA-C 109.789 -0.449 . . . . 2.24 109.789 179.858 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 132' ' ' ILE . . . . . 0.449 HD12 HD23 ' A' ' 50' ' ' LEU . 2.7 mt -73.74 -34.0 39.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.701 -0.682 . . . . 1.23 110.023 177.811 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 133' ' ' PHE . . . . . 0.512 ' O ' HG23 ' A' ' 137' ' ' VAL . 37.0 t80 -57.92 -62.19 1.99 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.627 -0.715 . . . . 0.46 110.556 178.619 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.36 -28.19 69.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.8 0.334 . . . . 0.64 110.755 -177.554 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.508 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.65 -51.24 70.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.793 -0.639 . . . . 1.61 111.337 178.055 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 136' ' ' LYS . . . . . 0.708 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -76.16 -29.01 57.59 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.912 -0.586 . . . . 1.52 110.786 -178.417 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 133' ' ' PHE . 53.9 t -70.8 -29.38 37.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.118 -0.492 . . . . 0.35 110.753 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -69.25 -17.57 63.77 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.095 0.474 . . . . 0.5 110.549 177.614 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -106.18 6.47 30.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.118 -0.492 . . . . 1.76 110.949 179.683 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 140' ' ' MET . . . . . 0.512 ' HG3' ' HA ' ' A' ' 137' ' ' VAL . 0.4 OUTLIER -70.15 149.33 96.11 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.082 -0.508 . . . . 0.86 110.322 177.214 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 141' ' ' PRO . . . . . 0.459 ' C ' ' H ' ' A' ' 143' ' ' GLU . 71.8 Cg_endo -75.9 102.96 1.66 Allowed 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 121.959 1.772 . . . . 0.67 111.753 -178.375 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -78.12 25.33 0.22 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.389 0.614 . . . . 2.91 110.39 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 143' ' ' GLU . . . . . 0.459 ' H ' ' C ' ' A' ' 141' ' ' PRO . 3.4 mm-40 -101.4 -34.17 9.7 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 115.085 -0.961 . . . . 2.7 108.822 176.892 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 60.15 74.81 0.43 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 114.275 -1.329 . . . . 2.34 110.029 -178.682 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 145' ' ' VAL . . . . . 0.456 ' O ' ' HB ' ' A' ' 36' ' ' THR . 21.9 t -97.14 139.48 19.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.364 -0.834 . . . . 0.99 109.055 -176.221 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 146' ' ' GLU . . . . . 0.443 ' HA ' ' HA ' ' A' ' 36' ' ' THR . 11.8 tt0 -86.1 153.15 22.3 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 120.593 -0.443 . . . . 1.53 110.253 179.038 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 147' ' ' LEU . . . . . 0.453 HD11 ' HA ' ' A' ' 37' ' ' ASN . 89.5 mt . . . . . 0 C--O 1.251 1.168 0 CA-C-O 118.474 -0.774 . . . . 1.57 110.86 -176.481 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo . . . . . 0 N--CA 1.479 0.66 0 N-CA-C 110.198 -0.732 . . . . 6.18 110.198 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.35 84.94 3.78 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.355 0.598 . . . . 5.71 109.888 175.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 150.9 -79.5 0.2 Allowed Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 110.613 -0.995 . . . . 3.45 110.613 -177.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 11.8 p -78.73 138.33 38.2 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.777 -0.453 . . . . 2.44 109.777 173.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.73 172.73 6.66 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.776 0.798 . . . . 1.64 111.945 -174.38 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 9.2 p -122.77 -14.39 6.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-N 114.349 -1.296 . . . . 0.93 108.853 175.403 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -147.8 132.7 18.08 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 114.504 -1.225 . . . . 1.61 109.06 177.218 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.415 ' O ' ' HE3' ' A' ' 31' ' ' LYS . 23.8 t-20 -153.05 125.85 4.05 Favored Pre-proline 0 C--N 1.316 -0.876 0 CA-C-N 116.037 -0.529 . . . . 1.6 109.933 -178.252 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -65.85 -46.44 4.92 Favored 'Trans proline' 0 N--CA 1.474 0.378 0 C-N-CA 123.421 2.747 . . . . 1.87 113.271 -176.187 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.8 m -66.11 -32.53 74.04 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.293 0.568 . . . . 2.18 110.535 -177.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.415 ' HE3' ' O ' ' A' ' 28' ' ' ASN . 0.8 OUTLIER -78.52 123.66 85.55 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 115.379 -0.828 . . . . 2.75 109.73 178.215 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -48.16 136.25 24.38 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.811 2.341 . . . . 1.38 112.97 178.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.449 ' HA2' ' O ' ' A' ' 95' ' ' TYR . . . -162.64 62.32 0.27 Allowed Glycine 0 N--CA 1.444 -0.809 0 N-CA-C 110.816 -0.914 . . . . 0.97 110.816 179.624 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -80.09 167.9 19.81 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.006 0.431 . . . . 1.93 110.488 -177.468 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.514 ' HB3' HD12 ' A' ' 147' ' ' LEU . 4.8 mmtm -102.95 108.44 19.63 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 116.332 -0.395 . . . . 2.64 110.048 178.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.673 HG22 ' HG3' ' A' ' 146' ' ' GLU . 5.7 p -109.0 171.65 7.31 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 120.774 -0.37 . . . . 0.68 110.826 174.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -61.69 -50.51 72.19 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.801 -0.636 . . . . 1.47 110.937 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.584 ' HG2' ' SD ' ' A' ' 140' ' ' MET . 1.3 mt-30 -56.68 -44.37 81.38 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.714 0.292 . . . . 1.04 110.983 179.115 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.445 ' HB2' ' HA ' ' A' ' 97' ' ' SER . 0.8 OUTLIER -59.42 -56.0 27.52 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.088 -0.505 . . . . 0.8 111.13 -178.53 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -65.54 -33.48 76.02 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.013 -0.539 . . . . 1.75 110.48 -179.034 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.658 ' CE1' ' HG2' ' A' ' 140' ' ' MET . 61.2 t80 -58.17 -63.89 1.1 Allowed 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.758 -0.656 . . . . 0.64 110.858 178.841 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.473 ' O ' HG12 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -62.65 -29.61 70.75 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.721 -0.392 . . . . 1.13 110.932 -171.961 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.484 ' HA ' HD13 ' A' ' 90' ' ' LEU . 4.5 tt0 -62.16 -55.83 24.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.778 -0.646 . . . . 1.3 110.874 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -87.2 -29.63 21.6 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.928 0.394 . . . . 0.5 111.91 -177.148 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.419 HG11 ' CZ ' ' A' ' 41' ' ' TYR . 93.7 t -88.39 -57.66 4.07 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 N-CA-C 112.443 0.534 . . . . 0.3 112.443 -174.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.483 HG22 ' HB3' ' A' ' 136' ' ' LYS . 81.7 t -79.24 -66.27 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 C-N-CA 120.782 -0.367 . . . . 0.26 111.953 -170.212 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.473 HG12 ' O ' ' A' ' 42' ' ' MET . 2.2 p -67.72 -35.43 72.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 C-N-CA 120.518 -0.473 . . . . 0.83 111.498 -174.375 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.8 mttt -67.31 -31.31 71.52 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 122.013 -0.43 . . . . 2.4 111.619 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 48.1 m -81.34 -36.88 29.16 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.84 -0.344 . . . . 0.55 110.634 176.319 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.633 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -55.45 -40.46 71.6 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 108.703 -0.851 . . . . 0.33 108.703 171.326 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 10.5 t-105 -60.14 -37.69 80.84 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.441 -1.254 . . . . 0.39 111.912 178.064 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -77.23 -5.15 48.21 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.212 0.449 . . . . 2.24 112.212 -172.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -72.62 130.41 40.51 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.672 -0.492 . . . . 0.39 109.672 176.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -75.55 -4.76 41.73 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.284 -0.416 . . . . 1.91 111.214 -174.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -100.06 -3.71 31.4 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.203 0.525 . . . . 0.93 109.866 175.01 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.792 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -93.81 10.06 34.67 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.856 -0.611 . . . . 0.28 110.913 -178.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.551 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 48.9 p-90 -65.46 -33.01 6.89 Favored Pre-proline 0 CA--C 1.548 0.889 0 N-CA-C 113.57 0.952 . . . . 0.58 113.57 -175.471 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.551 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 12.7 Cg_exo -71.54 -6.93 20.2 Favored 'Trans proline' 0 C--N 1.365 1.44 0 CA-C-N 121.088 1.424 . . . . 0.47 112.104 177.669 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -105.97 14.2 28.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.125 0.488 . . . . 1.11 110.137 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 10.4 m-30 -82.0 -11.21 58.95 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.839 -0.618 . . . . 0.63 110.714 179.154 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -122.19 125.09 26.7 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 116.281 -0.418 . . . . 1.63 111.06 -175.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.609 ' HA ' ' OD1' ' A' ' 82' ' ' ASP . 50.3 Cg_endo -71.07 150.93 61.06 Favored 'Trans proline' 0 C--O 1.236 0.422 0 C-N-CA 122.795 2.33 . . . . 0.87 112.49 -179.116 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 38.3 t -73.34 92.24 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 122.061 0.934 . . . . 0.88 110.395 176.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -87.11 -10.18 53.5 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.683 -1.144 . . . . 1.85 109.229 175.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 76.18 -45.26 0.51 Allowed 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 114.573 -1.194 . . . . 1.29 111.745 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 41.5 mm -80.04 -53.01 13.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 120.751 0.31 . . . . 1.89 110.639 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -53.28 -52.86 57.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.742 -0.663 . . . . 2.99 112.328 -177.627 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.524 HD23 HD11 ' A' ' 70' ' ' LEU . 2.2 tp -90.66 0.24 57.46 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.26 -0.427 . . . . 1.66 111.108 -177.332 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 57.23 56.6 5.05 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.688 -0.687 . . . . 1.74 112.083 178.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.524 HD11 HD23 ' A' ' 68' ' ' LEU . 7.5 mt -121.21 79.05 34.87 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 115.664 -0.698 . . . . 1.61 110.357 178.075 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -78.63 -37.52 0.65 Allowed 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.575 2.183 . . . . 1.3 113.131 -175.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.3 p-10 -86.62 -3.96 59.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.284 0.564 . . . . 1.97 110.604 -178.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -58.83 -39.34 80.94 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.328 -0.851 . . . . 1.13 110.496 175.765 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.413 ' ND1' ' HG2' ' A' ' 80' ' ' PRO . 3.2 m-70 -76.94 0.77 19.82 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.228 -0.896 . . . . 0.91 111.417 -176.584 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.9 mttt -109.81 -41.38 4.53 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.448 -0.342 . . . . 2.86 111.099 -178.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.2 mt -86.43 -49.85 14.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 120.901 0.381 . . . . 1.0 111.082 -178.556 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.482 HD11 ' HB2' ' A' ' 115' ' ' TYR . 20.0 mm -80.57 131.8 33.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.329 -0.396 . . . . 0.75 110.324 -177.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.4 -56.68 8.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.029 -0.532 . . . . 1.99 111.214 -175.152 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.776 ' HB2' HG21 ' A' ' 107' ' ' THR . 0.3 OUTLIER -122.27 89.75 49.05 Favored Pre-proline 0 C--N 1.324 -0.538 0 N-CA-C 110.067 -0.345 . . . . 2.05 110.067 178.432 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.413 ' HG2' ' ND1' ' A' ' 74' ' ' HIS . 32.4 Cg_exo -60.99 91.97 0.1 OUTLIER 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 123.038 2.492 . . . . 0.89 112.345 177.617 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 1.7 mmt -134.05 167.29 20.9 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.736 -0.665 . . . . 0.82 109.763 -179.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.609 ' OD1' ' HA ' ' A' ' 62' ' ' PRO . 5.6 p-10 -143.05 -116.71 0.1 Allowed 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.289 -0.869 . . . . 1.42 109.696 -173.386 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -128.33 -22.95 3.31 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.954 0.407 . . . . 0.8 110.337 177.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -82.75 -23.12 56.77 Favored Glycine 0 N--CA 1.441 -1.026 0 N-CA-C 110.738 -0.945 . . . . 0.32 110.738 -178.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.85 -41.66 22.82 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.304 -0.448 . . . . 0.95 110.552 177.305 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.425 HD12 ' O ' ' A' ' 82' ' ' ASP . 47.0 mt -58.42 -51.0 76.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.827 -0.624 . . . . 0.97 110.153 175.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.53 -24.68 66.42 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.903 -0.59 . . . . 1.15 111.185 -178.69 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.35 -45.42 76.41 Favored 'General case' 0 C--O 1.23 0.045 0 CA-C-O 120.772 0.32 . . . . 2.46 110.752 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.588 ' HD2' ' CD2' ' A' ' 94' ' ' TYR . 6.3 mtm180 -69.31 -30.54 68.62 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.345 -0.388 . . . . 1.16 110.757 177.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.484 HD13 ' HA ' ' A' ' 43' ' ' GLN . 12.6 mt -70.54 -49.62 46.24 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.441 -0.345 . . . . 0.49 111.284 179.798 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -70.04 -21.53 63.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.812 0.339 . . . . 1.39 111.174 -177.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -96.53 5.66 50.33 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.181 -0.463 . . . . 1.3 110.618 179.206 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 53.36 54.25 10.46 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.84 -0.618 . . . . 1.75 111.478 178.295 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' TYR . . . . . 0.588 ' CD2' ' HD2' ' A' ' 89' ' ' ARG . 8.5 t80 -70.67 -44.19 67.56 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.292 -0.413 . . . . 0.96 111.786 -178.448 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.458 ' CD1' ' HB3' ' A' ' 100' ' ' GLU . 0.3 OUTLIER -91.7 -172.35 3.19 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.67 0.748 . . . . 1.28 111.39 -179.272 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -94.59 -42.81 8.61 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 114.132 -1.395 . . . . 1.05 108.898 175.322 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.445 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 9.4 t -145.95 170.66 16.16 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.014 -0.994 . . . . 1.0 109.619 -176.776 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -69.16 -12.12 61.4 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.978 0.362 . . . . 0.66 111.978 -174.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.27 -26.76 68.93 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.845 0.355 . . . . 0.85 111.094 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.458 ' HB3' ' CD1' ' A' ' 95' ' ' TYR . 4.4 tp10 -82.13 -22.92 35.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.014 0.435 . . . . 2.44 110.37 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.407 ' SG ' HG23 ' A' ' 86' ' ' ILE . 1.6 t -76.65 -21.76 55.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.75 -0.659 . . . . 0.95 110.112 178.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -21.18 59.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.798 -0.637 . . . . 1.13 110.778 178.402 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -73.64 -57.18 4.17 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 116.022 -0.536 . . . . 2.96 110.602 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.99 -36.98 80.94 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.042 -0.526 . . . . 1.87 111.005 -176.007 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.633 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -61.19 -39.59 90.74 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.062 0.458 . . . . 0.38 110.847 177.021 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -67.46 -39.37 85.31 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.921 -0.581 . . . . 0.97 110.709 -178.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.776 HG21 ' HB2' ' A' ' 79' ' ' ASN . 47.5 m -70.69 -39.74 73.3 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.236 -0.438 . . . . 0.43 111.675 -177.444 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.511 ' HG3' ' N ' ' A' ' 109' ' ' PHE . 0.0 OUTLIER -54.05 -37.86 64.59 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.745 0.307 . . . . 0.88 111.278 -178.913 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.511 ' N ' ' HG3' ' A' ' 108' ' ' MET . 7.3 m-85 -76.95 -43.73 34.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.362 -0.381 . . . . 0.29 110.98 -178.218 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -67.19 -39.96 86.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.042 0.449 . . . . 0.66 110.716 -177.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -49.85 -46.53 51.45 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.246 -0.888 . . . . 1.84 111.139 177.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.76 -39.98 91.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.325 -0.398 . . . . 0.63 110.773 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -67.14 -29.85 69.69 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.339 -0.391 . . . . 0.81 111.25 -177.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 37.0 mt -84.64 -54.95 7.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.174 -0.466 . . . . 0.55 111.739 -176.415 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.482 ' HB2' HD11 ' A' ' 77' ' ' ILE . 45.0 t80 -67.4 -40.04 85.58 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.763 0.316 . . . . 1.22 110.849 -176.099 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -97.56 152.74 18.72 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.132 -0.486 . . . . 1.04 110.592 -176.554 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.52 151.71 85.22 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 116.228 -0.442 . . . . 3.47 110.264 179.282 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' PRO . . . . . 0.568 ' HA ' HG11 ' A' ' 123' ' ' VAL . 29.7 Cg_endo -64.49 -7.15 13.52 Favored 'Trans proline' 0 CA--C 1.533 0.435 0 C-N-CA 122.978 2.452 . . . . 0.96 113.068 -177.719 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -102.46 5.51 39.58 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.793 0.33 . . . . 1.23 111.281 178.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -82.93 155.4 24.06 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.098 0.475 . . . . 1.34 110.851 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.82 -40.54 88.05 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.458 -0.792 . . . . 1.44 110.423 -177.342 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.3 tp -62.04 -36.95 77.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.99 -0.55 . . . . 0.42 110.67 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.568 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.3 t -67.72 -46.38 82.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 109.877 -0.416 . . . . 0.35 109.877 177.607 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.37 -38.38 74.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.541 -0.754 . . . . 0.52 110.031 178.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' MET . . . . . 0.488 ' O ' HD13 ' A' ' 129' ' ' LEU . 25.9 mtt -69.78 -48.81 57.81 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.309 -0.86 . . . . 0.62 110.785 178.775 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.27 -40.46 67.85 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.274 -0.421 . . . . 0.31 111.372 -179.303 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -58.23 -42.54 86.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.021 -0.536 . . . . 1.94 111.039 179.395 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -77.58 -38.26 48.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.985 0.422 . . . . 0.32 110.66 -179.548 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.792 HD21 ' HA ' ' A' ' 56' ' ' ALA . 4.6 mp -56.48 -38.1 71.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.52 -0.764 . . . . 0.33 110.676 177.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -62.23 -23.78 66.86 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.423 -0.808 . . . . 1.47 111.953 -178.165 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.42 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 1.3 mptt -68.18 -47.57 67.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.69 0.281 . . . . 2.24 110.46 -176.102 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.5 HD12 ' HA ' ' A' ' 50' ' ' LEU . 0.1 OUTLIER -71.98 -23.2 21.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.308 -0.405 . . . . 1.23 110.467 179.601 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.423 ' O ' HG23 ' A' ' 137' ' ' VAL . 24.7 t80 -61.56 -62.02 2.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.091 -0.504 . . . . 0.46 110.213 175.136 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 2.2 pp -65.98 -28.41 68.88 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.928 0.394 . . . . 0.64 110.818 -178.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.445 ' HB2' ' HA ' ' A' ' 132' ' ' ILE . 0.1 OUTLIER -54.62 -50.93 66.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.571 -0.741 . . . . 1.61 111.383 178.997 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 136' ' ' LYS . . . . . 0.483 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.2 OUTLIER -82.28 -24.42 34.71 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.47 -0.786 . . . . 1.52 110.981 -176.236 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.478 ' O ' ' HB2' ' A' ' 140' ' ' MET . 41.1 t -74.01 -36.4 44.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.809 -0.632 . . . . 0.35 110.852 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.19 -19.29 65.54 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.081 0.467 . . . . 0.5 110.238 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -100.42 6.04 44.36 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.55 -0.75 . . . . 1.76 110.447 -178.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' MET . . . . . 0.658 ' HG2' ' CE1' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -61.18 150.38 79.43 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 115.865 -0.607 . . . . 0.86 110.898 177.218 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -61.23 103.22 0.24 Allowed 'Trans proline' 0 N--CA 1.461 -0.426 0 C-N-CA 122.161 1.907 . . . . 0.67 110.88 173.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -73.4 3.2 6.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.899 -0.591 . . . . 2.91 112.122 -173.308 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.408 ' O ' ' HB3' ' A' ' 144' ' ' GLU . 0.9 OUTLIER -112.44 -36.72 5.18 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 116.049 -0.523 . . . . 2.7 110.949 -176.148 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.57 ' OE2' ' HB2' ' A' ' 38' ' ' GLN . 5.9 tp10 74.28 135.37 0.05 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 114.991 -1.004 . . . . 2.34 110.845 -178.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 39.5 t -139.39 108.6 3.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.23 -0.896 . . . . 0.99 109.268 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.673 ' HG3' HG22 ' A' ' 36' ' ' THR . 3.4 tt0 -67.27 130.92 44.64 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.464 -0.569 . . . . 1.53 109.464 177.206 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.514 HD12 ' HB3' ' A' ' 35' ' ' LYS . 11.1 mt . . . . . 0 C--O 1.252 1.216 0 CA-C-O 118.493 -0.765 . . . . 1.57 110.27 -175.145 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.779 0 N-CA-C 111.655 -0.578 . . . . 2.17 111.655 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 141.67 76.3 0.04 OUTLIER Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.924 -0.655 . . . . 1.97 112.19 -179.03 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt 61.55 84.02 0.14 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.377 0.608 . . . . 3.58 111.622 176.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 1.2 ptpm? . . . . . 0 C--O 1.244 0.805 0 CA-C-O 118.428 -0.796 . . . . 4.6 110.38 -179.515 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo . . . . . 0 N--CA 1.477 0.529 0 N-CA-C 110.548 -0.597 . . . . 6.18 110.548 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 30.1 tp -100.76 151.94 21.08 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.131 -0.322 . . . . 5.71 110.131 178.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 90.73 -47.77 3.01 Favored Glycine 0 N--CA 1.45 -0.387 0 N-CA-C 111.464 -0.654 . . . . 3.45 111.464 -178.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.8 p -81.47 156.17 25.45 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 110.145 -0.317 . . . . 2.44 110.145 175.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.562 ' HG3' ' CE1' ' A' ' 94' ' ' TYR . 12.0 pt-20 -132.13 165.93 22.93 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.5 0.667 . . . . 1.64 110.878 -179.158 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 7.9 p -127.54 -7.48 4.26 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 115.225 -0.898 . . . . 0.93 108.994 176.333 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -151.47 145.31 25.12 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 114.713 -1.131 . . . . 1.61 108.997 178.574 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.439 ' HB3' ' CB ' ' A' ' 31' ' ' LYS . 11.9 t-20 -156.15 125.52 3.13 Favored Pre-proline 0 C--N 1.314 -0.935 0 CA-C-N 116.568 -0.287 . . . . 1.6 110.41 176.759 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -73.94 -39.96 1.55 Allowed 'Trans proline' 0 N--CA 1.473 0.308 0 C-N-CA 123.23 2.62 . . . . 1.87 113.231 -178.227 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.5 m -80.25 -21.03 43.23 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.208 0.528 . . . . 2.18 110.529 -175.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.439 ' CB ' ' HB3' ' A' ' 28' ' ' ASN . 9.2 tttp -74.46 135.45 75.56 Favored Pre-proline 0 C--N 1.319 -0.734 0 CA-C-N 114.917 -1.038 . . . . 2.75 111.027 179.34 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -57.97 137.21 79.74 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.142 1.895 . . . . 1.38 111.49 169.419 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -173.17 90.93 0.09 OUTLIER Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 111.221 -0.752 . . . . 0.97 111.221 -176.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -110.35 177.9 4.55 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.923 0.392 . . . . 1.93 110.434 -177.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.439 ' HA ' HD22 ' A' ' 39' ' ' LEU . 7.4 mtpp -108.1 104.38 13.79 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.219 -0.446 . . . . 2.64 110.276 179.117 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.6 p -99.11 168.52 10.02 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.821 0.343 . . . . 0.68 110.466 177.107 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.496 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 3.6 t-20 -62.08 -40.0 94.32 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 115.932 -0.576 . . . . 1.47 110.35 178.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -67.71 -40.6 84.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.764 0.316 . . . . 1.04 110.883 -178.796 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.551 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.5 OUTLIER -62.34 -49.83 74.01 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.117 0.484 . . . . 0.8 110.541 179.461 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 21.7 mm100 -70.38 -28.84 65.41 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.739 -0.664 . . . . 1.75 110.587 179.494 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.496 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 52.7 t80 -59.83 -63.9 1.14 Allowed 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.754 -0.657 . . . . 0.64 110.762 176.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.544 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -59.33 -31.9 69.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.579 0.228 . . . . 1.13 110.462 -174.901 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.468 ' O ' HG13 ' A' ' 47' ' ' VAL . 9.9 tt0 -56.12 -58.7 6.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.604 -0.726 . . . . 1.3 111.087 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -87.11 -27.19 23.25 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.105 -0.498 . . . . 0.5 112.323 -177.376 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 97.0 t -89.12 -57.59 4.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 112.347 0.499 . . . . 0.3 112.347 -175.423 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.544 HG23 ' HA ' ' A' ' 42' ' ' MET . 60.7 t -80.12 -65.93 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 C-N-CA 120.931 -0.308 . . . . 0.26 111.637 -170.597 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.468 HG13 ' O ' ' A' ' 43' ' ' GLN . 0.2 OUTLIER -66.1 -37.09 79.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.284 0 C-N-CA 120.7 -0.4 . . . . 0.83 111.266 -174.535 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -36.34 82.94 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.751 0.278 . . . . 2.4 111.751 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.442 HG21 ' HE2' ' A' ' 136' ' ' LYS . 9.9 m -79.05 -33.44 44.69 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.835 -0.346 . . . . 0.55 110.87 178.756 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.655 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -64.59 -36.17 83.36 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 121.486 0.66 . . . . 0.33 109.371 174.046 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 12.4 t-105 -61.96 -28.12 69.33 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.127 -0.942 . . . . 0.39 111.272 177.29 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 37.5 mtpt -92.41 28.81 1.85 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.104 0.478 . . . . 2.24 111.439 -176.139 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.517 ' HD2' HD11 ' A' ' 132' ' ' ILE . 14.5 t-80 -103.11 133.87 47.49 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.212 -0.449 . . . . 0.39 110.054 176.1 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -70.69 -11.4 60.92 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.306 -0.406 . . . . 1.91 111.789 -176.085 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.492 ' CG ' ' HG2' ' A' ' 125' ' ' MET . 0.2 OUTLIER -101.97 -4.46 26.08 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.912 0.387 . . . . 0.93 110.407 178.799 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.57 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -94.58 16.39 15.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.201 0.524 . . . . 0.28 110.802 -179.257 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.591 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 42.1 p-90 -70.44 -30.89 1.99 Allowed Pre-proline 0 CA--C 1.545 0.766 0 N-CA-C 113.706 1.002 . . . . 0.58 113.706 -174.801 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.591 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 6.4 Cg_exo -76.17 -4.92 15.71 Favored 'Trans proline' 0 C--N 1.359 1.108 0 C-N-CA 121.273 1.315 . . . . 0.47 111.252 172.578 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -109.15 45.81 1.03 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.246 -0.888 . . . . 1.11 109.893 -176.633 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.47 ' CE2' ' HA ' ' A' ' 57' ' ' TRP . 11.2 m-30 -120.99 -12.48 8.74 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.502 -0.772 . . . . 0.63 110.987 -176.799 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.424 ' HA ' ' HD2' ' A' ' 62' ' ' PRO . 1.1 mt-30 -123.28 113.37 29.48 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 116.252 -0.431 . . . . 1.63 110.816 -169.805 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.424 ' HD2' ' HA ' ' A' ' 61' ' ' GLN . 12.0 Cg_endo -56.45 129.81 36.72 Favored 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.418 2.079 . . . . 0.87 111.608 -178.698 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 20.5 t -65.02 103.39 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.708 0.766 . . . . 0.88 111.188 -176.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -110.21 30.54 6.66 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.029 -0.987 . . . . 1.85 109.283 174.16 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 55.68 -88.29 0.02 OUTLIER 'General case' 0 C--O 1.226 -0.18 0 CA-C-N 114.687 -1.142 . . . . 1.29 111.716 -178.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 40.7 mm -62.78 -34.47 65.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.475 -0.33 . . . . 1.89 111.397 -173.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -57.81 -29.83 65.23 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.952 -0.567 . . . . 2.99 112.025 -177.138 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.7 tp -128.06 14.91 6.81 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.864 0.364 . . . . 1.66 110.825 -177.279 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 61.26 56.08 2.78 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.474 -0.785 . . . . 1.74 111.351 179.161 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.63 HD21 ' HD2' ' B' ' 312' ' ' ALY . 0.2 OUTLIER -120.15 71.4 16.68 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 115.959 -0.564 . . . . 1.61 110.564 174.948 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -84.43 -39.87 0.1 Allowed 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.638 2.225 . . . . 1.3 112.218 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -81.25 -14.69 57.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.337 0.589 . . . . 1.97 109.962 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.423 ' HE2' ' HA ' ' A' ' 80' ' ' PRO . 44.7 t80 -58.74 -40.51 84.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.139 -0.937 . . . . 1.13 110.593 177.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -77.72 1.9 18.53 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.49 -0.777 . . . . 0.91 111.557 -175.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -91.13 -47.42 7.54 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.397 0.618 . . . . 2.86 109.415 178.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.5 mp -88.92 -43.87 15.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.14 -0.936 . . . . 1.0 110.608 -177.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 35.2 mm -87.46 126.78 41.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.027 -0.533 . . . . 0.75 110.449 -178.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.9 mtmt -89.97 -23.34 21.57 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.725 -0.67 . . . . 1.99 110.948 -177.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -123.24 90.47 50.42 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 116.14 -0.482 . . . . 2.05 109.975 179.09 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.423 ' HA ' ' HE2' ' A' ' 73' ' ' TYR . 36.0 Cg_endo -67.19 93.44 0.34 Allowed 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.614 2.21 . . . . 0.89 112.5 -177.475 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 22.4 mmt -125.96 169.59 12.54 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.392 0.615 . . . . 0.82 111.036 -177.52 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.517 ' CG ' ' H ' ' A' ' 83' ' ' MET . 23.0 t70 -151.06 -142.15 0.12 Allowed 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.18 -1.373 . . . . 1.42 107.349 -177.16 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' MET . . . . . 0.517 ' H ' ' CG ' ' A' ' 82' ' ' ASP . 0.1 OUTLIER -115.64 -15.17 11.42 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 108.3 -1.0 . . . . 0.8 108.3 176.177 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -80.04 -24.49 59.58 Favored Glycine 0 N--CA 1.441 -0.967 0 N-CA-C 109.653 -1.379 . . . . 0.32 109.653 178.472 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.99 -34.82 43.8 Favored 'General case' 0 N--CA 1.44 -0.953 0 CA-C-N 114.81 -0.695 . . . . 0.95 110.421 176.306 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 36.4 mm -58.3 -56.76 14.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.325 -0.852 . . . . 0.97 109.996 175.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.25 -34.49 66.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.247 -0.888 . . . . 1.15 110.891 177.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.608 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 0.1 OUTLIER -63.19 -52.98 60.16 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-O 120.599 0.238 . . . . 2.46 111.121 -176.868 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 8.0 mmm-85 -64.4 -32.98 74.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.516 -0.311 . . . . 1.16 111.135 -178.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 10.1 mt -69.81 -52.27 26.53 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.275 -0.42 . . . . 0.49 111.162 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -71.78 -26.23 62.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.911 0.386 . . . . 1.39 110.711 -177.542 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.608 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 1.2 t30 -76.14 -15.6 60.04 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.375 -0.375 . . . . 1.3 110.509 176.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 59.31 54.79 4.56 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 115.544 -0.753 . . . . 1.75 109.712 -176.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' TYR . . . . . 0.562 ' CE1' ' HG3' ' A' ' 25' ' ' GLU . 25.1 t80 -74.72 -46.58 36.65 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.194 -0.912 . . . . 0.96 111.486 -176.138 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -107.17 -176.89 3.2 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.212 0.53 . . . . 1.28 111.208 -179.65 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -77.66 -43.34 31.63 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.228 -0.896 . . . . 1.05 111.307 -176.458 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -147.05 170.12 17.8 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-O 121.154 0.502 . . . . 1.0 111.825 -168.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.551 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -74.54 -10.55 59.66 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.788 -0.642 . . . . 0.66 111.527 -178.193 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 48.9 m -64.75 -24.09 67.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.273 0.559 . . . . 0.85 110.045 177.139 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -80.77 -38.56 28.35 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.785 -0.643 . . . . 2.44 110.195 175.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.424 ' HB3' ' HE3' ' A' ' 42' ' ' MET . 0.5 OUTLIER -69.11 -23.4 63.99 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.623 -0.717 . . . . 0.95 111.029 -178.05 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.4 ttm -61.29 -29.9 70.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.195 -0.457 . . . . 1.13 110.282 177.132 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -73.96 -34.69 64.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.868 -0.605 . . . . 2.96 109.935 178.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -71.78 -47.05 56.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.806 -0.634 . . . . 1.87 110.317 -179.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.655 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -55.3 -46.73 76.22 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.808 -0.633 . . . . 0.38 110.634 177.573 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -59.21 -44.95 92.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.747 -0.661 . . . . 0.97 110.611 178.321 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 80.9 m -62.2 -46.76 87.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.941 -0.572 . . . . 0.43 111.112 179.279 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.63 -41.09 69.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.19 -0.459 . . . . 0.88 111.108 178.573 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -73.06 -45.42 57.52 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.357 -0.383 . . . . 0.29 111.219 -177.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.1 p -67.45 -33.25 74.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.351 -0.386 . . . . 0.66 111.067 -177.395 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 -49.31 -47.41 47.09 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.643 -0.708 . . . . 1.84 111.192 178.122 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -65.69 -38.1 88.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.803 -0.635 . . . . 0.63 110.792 -178.782 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -72.6 -25.83 61.47 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.112 -0.494 . . . . 0.81 111.202 -177.109 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 62.0 mt -88.32 -50.82 13.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.059 0.457 . . . . 0.55 111.18 -179.156 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.404 ' CE1' ' HA ' ' A' ' 73' ' ' TYR . 63.8 t80 -70.9 -34.87 71.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.136 -0.484 . . . . 1.22 111.495 -175.537 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -110.85 157.81 19.42 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.891 0.377 . . . . 1.04 111.542 -172.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.541 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 0.2 OUTLIER -74.3 149.8 87.02 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 115.771 -0.65 . . . . 3.47 110.767 -177.468 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 118' ' ' PRO . . . . . 0.439 ' HA ' HG11 ' A' ' 123' ' ' VAL . 24.6 Cg_endo -62.24 -16.64 52.33 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.933 2.422 . . . . 0.96 112.976 -178.612 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.52 6.42 48.14 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.994 0.426 . . . . 1.23 111.25 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ASP . . . . . 0.541 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 0.5 OUTLIER -78.56 157.39 28.8 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 116.162 -0.472 . . . . 1.34 110.618 -178.414 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -67.5 -42.16 83.33 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.598 -0.728 . . . . 1.44 110.345 -177.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 5.5 tp -60.29 -35.84 64.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.972 -0.558 . . . . 0.42 111.009 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.439 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.4 t -68.97 -45.76 79.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.963 -0.384 . . . . 0.35 109.963 178.302 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.82 -29.69 67.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.906 -0.588 . . . . 0.52 110.13 177.617 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' MET . . . . . 0.495 ' O ' HD13 ' A' ' 129' ' ' LEU . 32.8 mtt -76.42 -42.21 44.97 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.376 -0.829 . . . . 0.62 110.654 178.485 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.38 -45.17 72.77 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.073 -0.512 . . . . 0.31 112.095 -177.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' GLN . . . . . 0.431 ' HG3' ' H ' ' A' ' 127' ' ' GLN . 0.0 OUTLIER -59.44 -44.18 92.97 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.913 0.387 . . . . 1.94 110.86 179.888 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -68.38 -37.69 80.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 0.32 110.627 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.57 HD21 ' HA ' ' A' ' 56' ' ' ALA . 5.0 mp -64.83 -40.93 95.99 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.394 -0.821 . . . . 0.33 110.734 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -59.27 -24.75 63.51 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.662 -0.699 . . . . 1.47 111.849 -176.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.553 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -62.66 -44.0 97.37 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 110.158 -0.312 . . . . 2.24 110.158 -177.895 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.517 HD11 ' HD2' ' A' ' 53' ' ' HIS . 22.1 mt -66.96 -35.61 75.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.128 -0.487 . . . . 1.23 110.343 -179.804 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.468 ' O ' HG23 ' A' ' 137' ' ' VAL . 36.1 t80 -59.89 -62.71 1.67 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.819 -0.628 . . . . 0.46 110.77 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 2.0 pp -64.74 -28.38 69.55 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.954 0.407 . . . . 0.64 110.782 -177.346 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.553 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.3 OUTLIER -60.82 -51.72 68.14 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.673 -0.694 . . . . 1.61 111.024 178.992 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 136' ' ' LYS . . . . . 0.535 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -81.36 -26.51 35.47 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.852 -0.613 . . . . 1.52 110.885 -175.718 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 133' ' ' PHE . 52.4 t -68.86 -29.7 44.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.128 0.489 . . . . 0.35 110.262 176.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.51 -14.77 63.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.162 -0.472 . . . . 0.5 110.531 177.35 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -106.88 -0.57 23.17 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.895 -0.593 . . . . 1.76 110.325 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' MET . . . . . 0.493 ' HG2' ' CE1' ' A' ' 41' ' ' TYR . 0.3 OUTLIER -70.07 147.29 95.63 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 115.874 -0.603 . . . . 0.86 110.752 -178.287 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.434 ' C ' ' H ' ' A' ' 143' ' ' GLU . 50.6 Cg_endo -86.18 79.95 1.85 Allowed 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 122.308 2.005 . . . . 0.67 111.324 178.118 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -76.08 21.39 0.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.273 0.558 . . . . 2.91 111.234 -177.63 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.434 ' H ' ' C ' ' A' ' 141' ' ' PRO . 2.4 mt-10 -90.62 -32.92 16.06 Favored 'General case' 0 N--CA 1.439 -0.982 0 N-CA-C 108.218 -1.031 . . . . 2.7 108.218 170.41 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 75.18 113.03 0.07 Allowed 'General case' 0 C--O 1.228 -0.064 0 CA-C-N 113.569 -1.651 . . . . 2.34 111.227 176.21 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 15.3 t -125.83 116.73 47.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.825 -0.625 . . . . 0.99 109.613 176.666 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -73.62 147.11 44.11 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.724 0.297 . . . . 1.53 110.499 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 64.6 mt . . . . . 0 C--O 1.247 0.931 0 CA-C-O 118.834 -0.603 . . . . 1.57 109.991 179.521 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.758 0 N-CA-C 112.173 -0.371 . . . . 2.17 112.173 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 312' ' ' ALY . . . . . 0.63 ' HD2' HD21 ' A' ' 70' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . -175.96 -80.98 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.511 0 N-CA-C 111.064 -0.814 . . . . 1.97 111.064 178.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 8.0 tmtm? -93.02 127.56 38.59 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.783 -0.821 . . . . 3.58 108.783 172.291 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 315' ' ' ALY . . . . . 0.458 ' HE2' ' CH2' ' A' ' 57' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.152 -0.928 . . . . 4.6 109.639 -177.187 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo . . . . . 0 N--CA 1.482 0.816 0 N-CA-C 110.506 -0.613 . . . . 6.18 110.506 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -101.98 42.91 1.1 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.796 0.331 . . . . 5.71 110.342 -178.5 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.9 60.89 3.02 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.492 -0.861 . . . . 3.45 111.083 -174.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.3 p 58.55 176.77 0.07 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.378 0.671 . . . . 2.44 111.8 -173.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.732 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 4.1 mt-10 -53.56 123.72 12.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.177 -0.465 . . . . 1.64 111.236 174.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.4 p -99.9 -14.48 7.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 121.216 0.531 . . . . 0.93 110.387 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -178.44 154.01 0.77 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.341 -0.845 . . . . 1.61 109.661 177.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.544 ' HB3' ' HB2' ' A' ' 31' ' ' LYS . 42.8 t-20 -160.53 124.38 2.0 Allowed Pre-proline 0 C--N 1.318 -0.779 0 CA-C-N 115.846 -0.616 . . . . 1.6 109.52 -179.397 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -65.06 -33.87 48.96 Favored 'Trans proline' 0 N--CA 1.48 0.729 0 C-N-CA 123.407 2.738 . . . . 1.87 112.994 -177.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.4 t -74.3 -20.7 60.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.577 0.703 . . . . 2.18 109.678 -179.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.544 ' HB2' ' HB3' ' A' ' 28' ' ' ASN . 2.1 tttp -87.11 134.75 36.03 Favored Pre-proline 0 C--N 1.319 -0.736 0 CA-C-N 115.0 -1.0 . . . . 2.75 109.755 178.464 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.509 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 35.9 Cg_endo -65.66 137.72 51.14 Favored 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.256 1.971 . . . . 1.38 112.317 177.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -153.88 109.27 0.4 Allowed Glycine 0 N--CA 1.442 -0.939 0 N-CA-C 110.788 -0.925 . . . . 0.97 110.788 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -123.81 155.77 37.36 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.789 0.328 . . . . 1.93 110.57 -176.312 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.489 ' HA ' HD22 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -92.62 84.36 5.04 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.191 0.52 . . . . 2.64 110.292 176.486 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.634 HG22 ' HG3' ' A' ' 146' ' ' GLU . 1.2 p -92.02 165.55 13.13 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.228 -0.442 . . . . 0.68 110.826 -179.225 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.446 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 64.0 t30 -63.99 -40.88 97.38 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.282 -0.417 . . . . 1.47 110.591 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -64.51 -38.97 92.86 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 110.203 -0.295 . . . . 1.04 110.203 177.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.783 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.7 OUTLIER -63.52 -55.68 22.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.916 -0.584 . . . . 0.8 110.501 178.838 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.48 ' HA ' ' OE1' ' A' ' 43' ' ' GLN . 1.2 mm100 -63.81 -31.53 72.73 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.966 -0.561 . . . . 1.75 110.891 -179.166 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.446 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 63.8 t80 -53.57 -62.68 1.5 Allowed 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.52 -0.764 . . . . 0.64 110.922 176.692 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.529 ' HA ' HG23 ' A' ' 46' ' ' VAL . 3.5 ttm -59.07 -29.98 67.73 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.428 -0.351 . . . . 1.13 111.645 -173.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.577 ' HG2' HD22 ' A' ' 90' ' ' LEU . 24.9 mt-30 -60.12 -58.56 7.98 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.097 0.475 . . . . 1.3 110.502 178.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -84.27 -29.7 26.23 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.702 -0.681 . . . . 0.5 111.534 -174.326 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 97.9 t -87.9 -56.63 5.02 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 N-CA-C 112.336 0.495 . . . . 0.3 112.336 -175.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.529 HG23 ' HA ' ' A' ' 42' ' ' MET . 53.6 t -83.03 -67.26 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 112.076 0.399 . . . . 0.26 112.076 -171.404 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.452 HG12 ' O ' ' A' ' 42' ' ' MET . 2.5 p -72.76 -34.13 46.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 C-N-CA 120.822 -0.351 . . . . 0.83 111.7 -171.689 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 43' ' ' GLN . 0.0 OUTLIER -61.48 -35.4 77.55 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.778 0.323 . . . . 2.4 110.779 179.196 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.419 HG21 ' HE3' ' A' ' 136' ' ' LYS . 27.3 m -80.75 -37.77 29.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.454 -0.339 . . . . 0.55 110.878 178.203 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.691 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -61.47 -40.78 95.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.903 0.383 . . . . 0.33 110.03 177.417 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 23.2 t-105 -64.73 -31.63 72.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.932 -0.576 . . . . 0.39 111.385 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.6 mttt -79.74 -9.83 59.7 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 111.815 0.302 . . . . 2.24 111.815 -175.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 10.5 t-80 -69.1 129.67 40.56 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.588 -0.523 . . . . 0.39 109.588 176.234 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -81.34 9.4 7.23 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.938 0.399 . . . . 1.91 111.658 -173.133 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -110.45 -3.52 16.02 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.303 0.573 . . . . 0.93 109.626 173.275 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.744 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -92.79 9.11 36.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.607 -0.724 . . . . 0.28 110.642 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.471 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 55.9 p-90 -64.31 -31.43 5.93 Favored Pre-proline 0 CA--C 1.546 0.803 0 N-CA-C 113.954 1.094 . . . . 0.58 113.954 -175.313 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.471 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 10.8 Cg_exo -73.11 -4.4 15.35 Favored 'Trans proline' 0 C--N 1.363 1.324 0 CA-C-N 121.151 1.447 . . . . 0.47 111.946 176.447 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -110.19 19.38 18.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.173 0.511 . . . . 1.11 110.008 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -85.84 -8.86 57.81 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.722 -0.672 . . . . 0.63 110.434 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.09 131.42 19.78 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.282 -0.417 . . . . 1.63 110.877 -172.474 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -67.58 154.74 72.68 Favored 'Trans proline' 0 C--O 1.236 0.398 0 C-N-CA 122.689 2.26 . . . . 0.87 113.044 -178.214 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 9.4 t -97.61 101.94 12.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.672 -0.694 . . . . 0.88 109.491 -178.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.444 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.0 OUTLIER -108.48 7.33 26.83 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.619 -0.719 . . . . 1.85 110.84 -178.26 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 86.05 -21.62 0.21 Allowed 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 114.737 -1.12 . . . . 1.29 112.29 178.219 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.7 mt -113.11 -42.69 4.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 O-C-N 122.224 -0.297 . . . . 1.89 111.105 -178.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 53.7 tptt -52.91 -54.61 32.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.14 -0.482 . . . . 2.99 110.975 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.405 ' HB3' HD22 ' A' ' 70' ' ' LEU . 9.4 tp -93.48 2.01 56.6 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.263 -0.426 . . . . 1.66 110.605 178.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 56.29 71.78 0.54 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.618 -0.719 . . . . 1.74 110.648 -177.54 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.538 ' HG ' ' CD1' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -132.35 75.01 74.98 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.168 -0.924 . . . . 1.61 109.921 -175.614 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -73.17 -37.06 3.65 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.561 2.174 . . . . 1.3 113.416 -173.258 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -91.48 -0.91 57.67 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.244 0.545 . . . . 1.97 110.937 -176.062 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.538 ' CD1' ' HG ' ' A' ' 70' ' ' LEU . 0.9 OUTLIER -65.71 -43.34 89.44 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.491 -0.777 . . . . 1.13 110.768 179.369 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -76.86 10.41 2.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.664 -0.698 . . . . 0.91 112.006 -173.573 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.6 mmtt -97.87 -47.85 5.4 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.125 -0.694 . . . . 2.86 109.125 176.289 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.7 mp -89.09 -52.63 10.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.322 -0.854 . . . . 1.0 110.608 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.9 mm -91.01 97.43 7.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.043 0.449 . . . . 0.75 109.879 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.3 mtmt -75.04 -11.19 60.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.887 -0.597 . . . . 1.99 111.13 -177.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -122.13 82.67 44.64 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 115.985 -0.552 . . . . 2.05 110.212 177.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -76.71 72.7 5.57 Favored 'Trans proline' 0 CA--C 1.53 0.28 0 C-N-CA 122.91 2.406 . . . . 0.89 112.016 -178.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -110.06 154.39 23.29 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.49 0.662 . . . . 0.82 110.924 -175.487 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.433 ' O ' HG12 ' A' ' 86' ' ' ILE . 13.9 p-10 -133.61 -129.21 0.17 Allowed 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 114.635 -1.166 . . . . 1.42 109.23 -173.677 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -120.44 -18.21 7.94 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.514 -0.55 . . . . 0.8 109.514 177.322 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -78.41 -35.59 32.79 Favored Glycine 0 N--CA 1.439 -1.13 0 N-CA-C 109.642 -1.383 . . . . 0.32 109.642 177.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 23.4 m -71.68 -35.54 70.31 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.254 -0.473 . . . . 0.95 110.63 174.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.433 HG12 ' O ' ' A' ' 82' ' ' ASP . 0.2 OUTLIER -62.83 -52.88 53.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.256 -0.646 . . . . 0.97 109.256 176.914 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.68 -25.5 67.36 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.945 -0.57 . . . . 1.15 111.104 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.477 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 14.9 tttp -68.54 -51.43 42.97 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 120.518 0.199 . . . . 2.46 110.65 179.386 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 11.4 mtp180 -66.54 -28.8 68.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.911 0.386 . . . . 1.16 110.683 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.717 ' HG ' ' SG ' ' A' ' 101' ' ' CYS . 5.6 mt -66.44 -58.55 5.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.936 -0.574 . . . . 0.49 110.96 173.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -68.19 -22.94 64.79 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.204 -0.453 . . . . 1.39 111.384 -176.02 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.477 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 7.6 t30 -89.38 -7.32 55.48 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.294 -0.412 . . . . 1.3 110.715 178.571 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 56.76 67.0 1.05 Allowed 'General case' 0 N--CA 1.464 0.251 0 O-C-N 123.648 0.593 . . . . 1.75 110.713 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' TYR . . . . . 0.732 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 14.1 t80 -77.87 -32.25 51.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.556 -0.747 . . . . 0.96 111.664 -178.536 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.424 ' CE2' ' HD2' ' A' ' 94' ' ' TYR . 0.0 OUTLIER -127.68 -172.72 2.74 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.612 0.72 . . . . 1.28 111.717 -175.897 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 96' ' ' TRP . . . . . 0.509 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 2.2 t-105 -76.17 -59.8 2.61 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 114.236 -1.347 . . . . 1.05 111.087 -177.283 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 8.2 m -128.31 166.37 18.75 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.999 0.428 . . . . 1.0 111.567 -172.054 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.783 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -70.5 -12.56 61.65 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.297 -0.411 . . . . 0.66 111.358 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' SER . . . . . 0.4 ' HA ' ' SD ' ' A' ' 102' ' ' MET . 0.1 OUTLIER -62.13 -22.79 66.13 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.387 0.613 . . . . 0.85 109.887 174.499 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -81.14 -44.95 17.15 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.411 -0.813 . . . . 2.44 110.348 176.303 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.717 ' SG ' ' HG ' ' A' ' 90' ' ' LEU . 1.6 t -69.49 -25.21 63.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.106 -0.497 . . . . 0.95 111.53 -176.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.4 ' SD ' ' HA ' ' A' ' 99' ' ' SER . 1.1 ptm -66.74 -16.75 64.46 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.637 -0.425 . . . . 1.13 110.292 177.269 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -78.5 -44.01 25.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 2.96 110.594 177.461 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ASP . . . . . 0.571 ' OD1' ' HA ' ' A' ' 101' ' ' CYS . 0.4 OUTLIER -75.07 -31.27 61.21 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.847 -0.427 . . . . 1.87 109.847 177.95 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.691 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -54.71 -51.54 65.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.807 -0.633 . . . . 0.38 109.945 170.336 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 -60.43 -46.01 91.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.398 -0.819 . . . . 0.97 110.026 176.139 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 63.3 m -54.69 -45.97 74.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.595 -0.73 . . . . 0.43 111.742 -177.423 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -54.26 -45.68 72.48 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 120.769 0.318 . . . . 0.88 110.73 176.094 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -64.94 -47.3 78.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.834 -0.621 . . . . 0.29 111.049 -178.272 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.31 -41.29 96.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.944 0.402 . . . . 0.66 110.686 -178.644 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -52.06 -46.05 64.98 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.374 -0.83 . . . . 1.84 110.547 177.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' CYS . . . . . 0.475 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 0.0 OUTLIER -70.32 -37.74 74.78 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.92 -0.582 . . . . 0.63 110.855 -178.68 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -71.7 -32.77 68.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.625 -0.261 . . . . 0.81 111.353 -177.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 76.9 mt -73.32 -57.98 5.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.531 -0.304 . . . . 0.55 111.33 -177.604 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -70.32 -41.55 73.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.381 -0.372 . . . . 1.22 111.318 -174.202 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ASN . . . . . 0.475 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 71.7 m-80 -86.28 168.14 14.18 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.926 0.393 . . . . 1.04 111.031 -174.273 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.04 147.27 83.4 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.984 -0.553 . . . . 3.47 110.397 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_endo -60.35 -21.24 66.52 Favored 'Trans proline' 0 C--N 1.343 0.241 0 C-N-CA 122.447 2.098 . . . . 0.96 111.959 177.395 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.15 34.82 4.79 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.059 -0.519 . . . . 1.23 110.638 176.786 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ASP . . . . . 0.512 ' OD1' ' HA2' ' B' ' 313' ' ' GLY . 2.3 t70 -83.84 167.48 17.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.882 -0.599 . . . . 1.34 110.673 179.569 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -67.28 -49.67 63.4 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.868 -0.605 . . . . 1.44 110.49 -177.285 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -64.3 -40.05 87.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.046 -0.525 . . . . 0.42 110.655 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 6.6 t -65.45 -38.68 83.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.057 0.456 . . . . 0.35 110.681 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.31 -28.29 68.0 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.029 -0.532 . . . . 0.52 110.276 177.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' MET . . . . . 0.472 ' O ' HD13 ' A' ' 129' ' ' LEU . 3.1 mtt -82.52 -44.98 15.26 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.764 -0.653 . . . . 0.62 110.582 177.311 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.41 -33.24 58.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.679 -0.691 . . . . 0.31 111.697 -179.21 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -59.21 -45.87 89.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.373 -0.376 . . . . 1.94 110.986 178.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -73.86 -35.5 64.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.104 -0.498 . . . . 0.32 110.509 179.307 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.744 HD21 ' HA ' ' A' ' 56' ' ' ALA . 5.6 mp -61.37 -46.14 91.44 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.42 -0.809 . . . . 0.33 110.615 179.132 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -62.7 -23.87 67.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.321 -0.854 . . . . 1.47 111.831 -176.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.536 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -62.97 -49.63 73.97 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 109.914 -0.402 . . . . 2.24 109.914 -176.77 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.528 HD12 HD23 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -68.94 -30.09 45.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.953 -0.567 . . . . 1.23 110.481 179.577 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.484 ' O ' HG23 ' A' ' 137' ' ' VAL . 34.8 t80 -61.72 -62.88 1.49 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.984 -0.553 . . . . 0.46 110.99 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.8 pp -66.62 -29.91 70.05 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.821 0.343 . . . . 0.64 110.534 -175.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.536 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.3 OUTLIER -63.39 -48.79 76.41 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.623 -0.717 . . . . 1.61 111.203 -179.549 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 136' ' ' LYS . . . . . 0.419 ' HE3' HG21 ' A' ' 49' ' ' THR . 2.8 mttm -80.89 -14.03 58.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.403 -0.362 . . . . 1.52 111.285 -177.359 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 133' ' ' PHE . 30.9 t -82.53 -34.99 12.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.052 0.453 . . . . 0.35 109.882 178.025 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -66.44 -19.38 65.78 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.197 0.522 . . . . 0.5 110.432 178.373 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -100.05 10.61 41.01 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.991 -0.55 . . . . 1.76 111.172 -179.375 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -61.21 152.08 73.46 Favored Pre-proline 0 N--CA 1.466 0.341 0 CA-C-N 116.267 -0.424 . . . . 0.86 111.055 175.167 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -68.61 121.38 8.3 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.384 2.056 . . . . 0.67 112.074 179.265 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -71.97 1.95 6.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.32 -0.4 . . . . 2.91 112.065 -176.311 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.441 ' HB2' HG23 ' A' ' 145' ' ' VAL . 1.2 mt-10 -97.69 -41.3 8.17 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 116.387 -0.37 . . . . 2.7 111.678 -171.675 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 60.55 65.7 1.02 Allowed 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.66 0.6 . . . . 2.34 109.979 -175.553 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 145' ' ' VAL . . . . . 0.441 HG23 ' HB2' ' A' ' 143' ' ' GLU . 16.6 t -98.21 127.78 50.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.699 -0.682 . . . . 0.99 110.294 -177.524 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.634 ' HG3' HG22 ' A' ' 36' ' ' THR . 8.8 tt0 -71.24 138.86 49.79 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.892 -0.41 . . . . 1.53 109.892 175.65 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 40.7 mt . . . . . 0 C--O 1.247 0.953 0 CA-C-O 118.395 -0.812 . . . . 1.57 110.516 -176.146 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.564 0 N-CA-C 111.453 -0.659 . . . . 2.17 111.453 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 313' ' ' GLY . . . . . 0.512 ' HA2' ' OD1' ' A' ' 120' ' ' ASP . . . 97.39 -5.51 62.77 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.705 -0.759 . . . . 1.97 112.897 178.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -143.12 125.83 15.98 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.654 0.264 . . . . 3.58 110.626 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.178 0 CA-C-N 115.421 -0.808 . . . . 4.6 110.653 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo . . . . . 0 N--CA 1.481 0.747 0 N-CA-C 109.919 -0.839 . . . . 6.18 109.919 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.92 144.17 33.03 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.978 -0.379 . . . . 5.71 109.978 177.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 145.89 -115.7 0.84 Allowed Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.926 -0.654 . . . . 3.45 111.743 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -144.96 173.3 11.99 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.919 -0.4 . . . . 2.44 109.919 178.074 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.601 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 3.5 mt-10 -55.3 122.82 11.96 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 121.066 0.46 . . . . 1.64 111.555 175.566 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.7 p -106.98 -18.57 7.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.653 -0.703 . . . . 0.93 110.158 177.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 73.1 m -166.95 142.57 4.26 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.551 -0.749 . . . . 1.61 109.347 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.463 ' HB3' ' CB ' ' A' ' 31' ' ' LYS . 34.8 t-20 -145.97 127.91 7.73 Favored Pre-proline 0 C--N 1.319 -0.754 0 N-CA-C 109.663 -0.495 . . . . 1.6 109.663 178.366 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -63.42 -36.12 57.06 Favored 'Trans proline' 0 N--CA 1.478 0.587 0 C-N-CA 123.224 2.616 . . . . 1.87 112.783 -177.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.5 m -80.35 -19.68 45.89 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 115.576 -0.738 . . . . 2.18 110.324 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.463 ' CB ' ' HB3' ' A' ' 28' ' ' ASN . 11.1 tttp -90.33 129.27 46.02 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.114 -0.948 . . . . 2.75 110.254 179.324 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.455 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 35.6 Cg_endo -69.17 135.72 32.63 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 121.96 1.773 . . . . 1.38 112.284 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -145.46 86.05 0.18 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.317 -0.856 . . . . 0.97 111.002 -178.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.498 ' HG3' ' CE2' ' A' ' 96' ' ' TRP . 1.7 mmm180 -97.97 163.38 12.8 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.879 0.371 . . . . 1.93 110.498 -176.161 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.424 ' HA ' HD22 ' A' ' 39' ' ' LEU . 4.3 mtmt -104.93 108.92 20.69 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.084 -0.507 . . . . 2.64 110.121 178.809 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.447 HG22 ' HG3' ' A' ' 146' ' ' GLU . 1.3 p -111.94 166.89 10.82 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.889 0.376 . . . . 0.68 110.864 176.227 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.544 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 60.3 t30 -59.75 -37.41 78.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.928 -0.578 . . . . 1.47 110.893 178.249 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -71.07 -37.47 72.48 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.854 0.359 . . . . 1.04 110.409 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.424 HD22 ' HA ' ' A' ' 35' ' ' LYS . 0.6 OUTLIER -63.18 -53.27 55.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.117 -0.492 . . . . 0.8 110.557 178.507 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -69.48 -21.43 63.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.093 -0.503 . . . . 1.75 110.81 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.544 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 52.8 t80 -64.36 -63.41 1.15 Allowed 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.003 -0.544 . . . . 0.64 110.868 178.307 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.609 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.5 OUTLIER -57.91 -31.45 66.79 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.534 -0.303 . . . . 1.13 110.867 -174.633 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -59.69 -55.24 36.83 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.909 -0.587 . . . . 1.3 111.209 178.097 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -86.56 -28.89 23.04 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 112.28 0.474 . . . . 0.5 112.28 -176.582 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 95.1 t -89.23 -57.51 4.19 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 N-CA-C 112.479 0.548 . . . . 0.3 112.479 -175.599 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.609 HG23 ' HA ' ' A' ' 42' ' ' MET . 39.7 t -81.47 -65.63 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 111.739 0.274 . . . . 0.26 111.739 -169.794 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.459 HG12 ' O ' ' A' ' 42' ' ' MET . 2.6 p -67.53 -34.26 67.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 C-N-CA 120.851 -0.34 . . . . 0.83 111.548 -174.253 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.4 mmtt -60.03 -39.5 86.08 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 122.243 -0.285 . . . . 2.4 111.574 177.646 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.3 m -75.97 -36.12 59.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.67 0.272 . . . . 0.55 110.713 178.6 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.597 HD23 HD12 ' A' ' 132' ' ' ILE . 0.1 OUTLIER -59.88 -37.51 79.58 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.406 0.622 . . . . 0.33 109.541 174.312 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 16.7 t-105 -63.9 -27.36 69.1 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.041 -0.982 . . . . 0.39 112.096 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.1 mtpt -88.97 0.79 56.34 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.038 0.384 . . . . 2.24 112.038 -174.014 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.449 ' CD2' HD11 ' A' ' 132' ' ' ILE . 8.7 t-80 -76.76 134.51 39.13 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.893 -0.41 . . . . 0.39 109.893 177.028 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 40.1 mm-40 -72.42 -13.39 61.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.417 -0.356 . . . . 1.91 111.743 -175.144 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.424 ' HB2' ' ND1' ' A' ' 53' ' ' HIS . 3.1 m-85 -96.08 -1.79 47.97 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.152 0.501 . . . . 0.93 110.341 178.556 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.594 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -97.28 13.9 27.91 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.411 0.624 . . . . 0.28 110.311 -179.185 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.623 ' HA ' ' CE2' ' A' ' 60' ' ' TYR . 54.3 p-90 -65.91 -33.6 7.45 Favored Pre-proline 0 CA--C 1.545 0.775 0 N-CA-C 113.787 1.032 . . . . 0.58 113.787 -174.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.477 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 1.3 Cg_endo -85.13 12.0 3.2 Favored 'Trans proline' 0 C--N 1.359 1.115 0 C-N-CA 121.695 1.597 . . . . 0.47 111.325 176.682 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -110.57 -0.39 17.32 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.389 -0.823 . . . . 1.11 110.781 -177.241 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.623 ' CE2' ' HA ' ' A' ' 57' ' ' TRP . 16.3 m-30 -82.21 -23.24 35.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.878 0.37 . . . . 0.63 111.179 -178.318 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.98 127.53 27.82 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.214 -0.448 . . . . 1.63 110.717 -174.373 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -69.79 158.22 57.65 Favored 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 122.835 2.357 . . . . 0.87 112.843 -177.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 41.7 t -77.07 94.45 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.618 0.723 . . . . 0.88 110.167 178.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.408 ' CG ' ' H ' ' A' ' 67' ' ' LYS . 0.4 OUTLIER -91.82 -10.24 40.54 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.103 -0.953 . . . . 1.85 110.507 178.499 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 80.37 -32.27 0.12 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.882 0.873 . . . . 1.29 112.646 176.85 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 24.0 mt -99.94 -57.24 4.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 O-C-N 122.122 -0.361 . . . . 1.89 111.724 -175.755 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.408 ' H ' ' CG ' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -66.99 -33.46 75.62 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.98 0.419 . . . . 2.99 110.92 -176.701 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.448 HD12 ' HA ' ' A' ' 68' ' ' LEU . 2.8 tp -90.27 -5.85 55.84 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.121 -0.49 . . . . 1.66 110.843 177.452 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 57.44 57.15 4.55 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.843 -0.617 . . . . 1.74 111.242 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.423 ' O ' ' HB2' ' A' ' 73' ' ' TYR . 25.9 mt -129.07 64.51 71.07 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.564 -0.744 . . . . 1.61 110.812 176.486 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -77.23 -27.74 6.37 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.322 2.015 . . . . 1.3 111.891 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -84.52 2.98 38.65 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.653 -0.703 . . . . 1.97 110.114 -179.453 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.442 ' HA ' ' CE1' ' A' ' 115' ' ' TYR . 1.5 t80 -65.19 -45.46 84.71 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.418 -0.81 . . . . 1.13 110.929 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -78.45 5.97 9.54 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.595 -0.73 . . . . 0.91 111.59 -172.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.0 mmmt -89.77 -22.84 21.95 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 108.989 -0.745 . . . . 2.86 108.989 178.244 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 53.6 mt -118.3 -56.09 3.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 CA-C-N 115.257 -0.883 . . . . 1.0 110.332 179.307 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 37.5 mm -88.83 107.46 17.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.959 -0.564 . . . . 0.75 110.564 -177.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.95 -10.43 59.27 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.895 -0.593 . . . . 1.99 110.889 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -117.58 82.94 16.45 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.004 -0.544 . . . . 2.05 110.109 176.204 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -76.32 91.05 1.14 Allowed 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.755 2.304 . . . . 0.89 112.0 -176.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -129.94 171.22 12.99 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.457 0.646 . . . . 0.82 111.245 -175.016 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.424 ' O ' HG12 ' A' ' 86' ' ' ILE . 12.9 p-10 -153.98 -134.81 0.05 OUTLIER 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.519 -1.219 . . . . 1.42 108.248 -174.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.2 ttm -113.25 -19.92 11.6 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.123 -0.695 . . . . 0.8 109.123 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.425 ' O ' ' HB2' ' A' ' 88' ' ' LYS . . . -79.81 -30.88 41.84 Favored Glycine 0 N--CA 1.44 -1.093 0 N-CA-C 109.863 -1.295 . . . . 0.32 109.863 178.006 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 28.5 m -77.14 -29.83 54.82 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.441 -0.379 . . . . 0.95 111.047 174.316 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.539 HD12 ' HB2' ' A' ' 104' ' ' ASP . 0.2 OUTLIER -65.52 -51.7 60.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 109.305 -0.628 . . . . 0.97 109.305 177.076 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.539 ' O ' ' HG2' ' A' ' 91' ' ' GLU . 0.0 OUTLIER -63.91 -27.35 69.09 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.156 -0.474 . . . . 1.15 110.164 177.548 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.558 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 0.8 OUTLIER -63.09 -52.27 63.31 Favored 'General case' 0 C--O 1.227 -0.09 0 CA-C-N 116.129 -0.487 . . . . 2.46 110.616 177.454 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.2 mmm-85 -63.91 -33.88 76.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.748 0.309 . . . . 1.16 110.724 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.8 mt -66.58 -57.89 6.31 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.936 -0.575 . . . . 0.49 111.598 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 11.4 pt-20 -78.55 -14.99 59.07 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.197 0.443 . . . . 1.39 112.197 -173.309 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.558 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 1.0 OUTLIER -90.41 -4.02 57.3 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 110.058 -0.349 . . . . 1.3 110.058 174.977 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.49 58.99 2.75 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.408 -0.815 . . . . 1.75 111.347 179.361 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' TYR . . . . . 0.601 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 24.7 t80 -71.85 -45.12 62.46 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.999 0.428 . . . . 0.96 110.773 179.349 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -108.59 -171.71 1.91 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.9 -0.591 . . . . 1.28 110.896 -175.263 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' TRP . . . . . 0.498 ' CE2' ' HG3' ' A' ' 34' ' ' ARG . 2.0 t90 -86.9 -41.59 13.86 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.556 -0.747 . . . . 1.05 110.394 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 28.6 t -148.96 175.67 11.09 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.255 0.55 . . . . 1.0 111.62 -172.336 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.41 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -75.0 -10.93 59.94 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.618 -0.719 . . . . 0.66 110.653 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.66 -33.25 72.54 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.792 0.806 . . . . 0.85 109.493 173.348 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -82.19 -35.31 28.46 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 114.647 -1.16 . . . . 2.44 110.144 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.511 ' HA ' ' OD1' ' A' ' 104' ' ' ASP . 48.5 t -64.76 -24.61 67.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.984 -0.553 . . . . 0.95 110.709 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.5 mtt -59.73 -25.9 65.2 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.079 -0.509 . . . . 1.13 110.282 176.735 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.404 ' OE1' ' HA ' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -75.61 -47.36 26.92 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.025 -0.534 . . . . 2.96 110.896 179.981 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ASP . . . . . 0.539 ' HB2' HD12 ' A' ' 86' ' ' ILE . 0.2 OUTLIER -70.77 -37.21 73.36 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.806 -0.357 . . . . 1.87 110.472 -179.367 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.573 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -56.09 -48.22 76.53 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.153 0.502 . . . . 0.38 110.043 173.543 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -64.54 -47.29 79.33 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.619 -0.719 . . . . 0.97 110.508 177.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 90.1 m -52.27 -45.4 65.44 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.372 -0.376 . . . . 0.43 111.332 -178.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 6.2 ttp -54.64 -38.97 67.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.348 -0.387 . . . . 0.88 111.453 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -78.78 -51.82 9.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.739 0.304 . . . . 0.29 110.605 -175.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.45 -39.72 73.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.171 -0.468 . . . . 0.66 111.165 178.267 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -53.82 -49.3 68.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.073 -0.512 . . . . 1.84 110.964 178.235 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.46 -38.16 90.04 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 116.391 -0.368 . . . . 0.63 110.612 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' TYR . . . . . 0.414 ' HD1' HG22 ' A' ' 123' ' ' VAL . 15.2 m-85 -67.85 -33.19 74.28 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.288 -0.414 . . . . 0.81 111.135 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 70.0 mt -80.79 -50.65 16.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.36 -0.382 . . . . 0.55 111.971 -176.696 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.442 ' CE1' ' HA ' ' A' ' 73' ' ' TYR . 64.3 t80 -68.3 -34.37 76.02 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.862 0.363 . . . . 1.22 111.154 -175.491 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 -98.7 -163.73 1.07 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.991 -0.549 . . . . 1.04 110.892 -175.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.67 156.51 44.72 Favored Pre-proline 0 C--N 1.325 -0.464 0 N-CA-C 109.999 -0.371 . . . . 3.47 109.999 179.545 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -59.41 -21.64 62.16 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.333 2.022 . . . . 0.96 111.99 176.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.94 8.64 42.17 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.55 -0.75 . . . . 1.23 111.56 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ASP . . . . . 0.548 ' OD2' ' HA2' ' B' ' 313' ' ' GLY . 3.3 t70 -76.04 155.98 34.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.186 0.517 . . . . 1.34 111.401 -175.679 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.47 -42.73 74.45 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.144 -0.935 . . . . 1.44 109.889 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ILE . . . . . 0.531 HG22 ' OD1' ' A' ' 120' ' ' ASP . 2.4 tp -66.17 -33.75 65.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 115.977 -0.556 . . . . 0.42 110.535 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.414 HG22 ' HD1' ' A' ' 113' ' ' TYR . 2.8 t -69.94 -41.4 79.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.128 0.49 . . . . 0.35 110.131 177.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.29 -33.52 71.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.92 -0.582 . . . . 0.52 109.968 177.347 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' MET . . . . . 0.462 ' O ' HD13 ' A' ' 129' ' ' LEU . 21.5 mtt -76.49 -46.6 26.0 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.524 -0.762 . . . . 0.62 110.746 178.348 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -52.83 -36.71 59.02 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.284 -0.416 . . . . 0.31 111.634 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -60.73 -39.11 87.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.132 -0.486 . . . . 1.94 111.272 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.91 -36.9 35.76 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.153 0.501 . . . . 0.32 110.438 178.227 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.594 HD21 ' HA ' ' A' ' 56' ' ' ALA . 5.2 mp -60.46 -40.2 90.33 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.46 -0.791 . . . . 0.33 110.697 179.329 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -60.52 -24.54 65.43 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.943 -0.571 . . . . 1.47 111.961 -178.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.475 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -65.15 -39.41 92.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.681 0.277 . . . . 2.24 110.41 -177.521 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.597 HD12 HD23 ' A' ' 50' ' ' LEU . 11.3 mt -67.47 -28.55 42.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 1.23 110.846 -178.765 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.438 ' O ' HG23 ' A' ' 137' ' ' VAL . 33.3 t80 -61.46 -63.05 1.41 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.955 -0.566 . . . . 0.46 110.487 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.3 pp -65.89 -25.3 67.1 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.334 0.588 . . . . 0.64 110.51 -178.787 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.475 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -63.95 -34.15 77.33 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.484 -0.78 . . . . 1.61 111.446 -179.339 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 136' ' ' LYS . . . . . 0.577 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -102.13 -21.98 14.31 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.891 0.377 . . . . 1.52 111.036 -178.459 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 133' ' ' PHE . 40.9 t -73.13 -31.28 34.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.078 0.466 . . . . 0.35 110.518 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -72.25 -6.35 42.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.322 0.582 . . . . 0.5 110.36 178.453 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -111.55 2.79 17.58 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.541 -0.754 . . . . 1.76 110.117 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' MET . . . . . 0.424 ' HG3' ' HA ' ' A' ' 137' ' ' VAL . 0.1 OUTLIER -65.54 149.85 96.73 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 115.941 -0.572 . . . . 0.86 111.623 -179.736 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -84.84 87.26 1.07 Allowed 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.435 2.09 . . . . 0.67 111.165 177.576 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 6.6 mm-40 -70.47 11.03 0.39 Allowed 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.407 0.521 . . . . 2.91 112.407 -174.179 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -83.76 -39.6 19.86 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 108.85 -0.796 . . . . 2.7 108.85 173.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 67.82 98.55 0.05 Allowed 'General case' 0 C--O 1.231 0.115 0 CA-C-N 114.263 -1.335 . . . . 2.34 111.017 -177.493 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 9.4 t -100.55 107.47 21.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.746 -0.661 . . . . 0.99 109.304 175.419 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.447 ' HG3' HG22 ' A' ' 36' ' ' THR . 5.7 tt0 -66.21 140.13 58.15 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.741 -0.466 . . . . 1.53 109.741 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 11.1 mt . . . . . 0 C--O 1.246 0.906 0 CA-C-O 118.661 -0.685 . . . . 1.57 110.205 -177.308 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.695 0 N-CA-C 111.687 -0.565 . . . . 2.17 111.687 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 313' ' ' GLY . . . . . 0.548 ' HA2' ' OD2' ' A' ' 120' ' ' ASP . . . 99.71 -38.34 3.16 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.796 -0.716 . . . . 1.97 112.115 -179.113 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -128.8 79.29 1.9 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.214 0.531 . . . . 3.58 110.446 179.185 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.645 -0.693 . . . . 4.6 110.273 -177.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo . . . . . 0 N--CA 1.482 0.813 0 N-CA-C 109.99 -0.812 . . . . 6.18 109.99 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.17 138.81 37.71 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.428 -0.582 . . . . 5.71 109.428 177.656 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.77 -32.79 5.78 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 110.703 -0.959 . . . . 3.45 110.703 -174.032 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 92.6 p -78.46 177.35 8.59 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.632 -0.784 . . . . 2.44 109.942 173.395 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.506 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 9.6 mt-10 -57.28 127.35 31.56 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.255 0.55 . . . . 1.64 112.125 177.731 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.456 ' O ' ' HB2' ' A' ' 94' ' ' TYR . 4.4 p -123.49 -13.12 6.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.118 -0.946 . . . . 0.93 109.157 172.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.7 m -173.66 116.4 0.25 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 114.976 -1.011 . . . . 1.61 108.855 -179.252 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.469 ' OD1' ' HD2' ' A' ' 29' ' ' PRO . 20.3 t30 -140.5 132.69 14.39 Favored Pre-proline 0 C--N 1.319 -0.734 0 C-N-CA 120.918 -0.313 . . . . 1.6 110.75 -173.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.469 ' HD2' ' OD1' ' A' ' 28' ' ' ASN . 70.7 Cg_endo -69.42 -38.76 8.08 Favored 'Trans proline' 0 N--CA 1.474 0.368 0 C-N-CA 123.044 2.496 . . . . 1.87 112.002 177.332 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 7.2 m -71.65 -17.22 62.27 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.392 -0.822 . . . . 2.18 110.571 -179.499 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.8 tmtm? -101.55 110.29 61.39 Favored Pre-proline 0 C--N 1.318 -0.802 0 CA-C-N 115.348 -0.842 . . . . 2.75 109.453 175.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.633 ' HB2' ' CZ3' ' A' ' 96' ' ' TRP . 24.5 Cg_endo -63.54 133.95 42.2 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 121.549 1.5 . . . . 1.38 111.978 -179.01 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -160.18 80.67 0.15 Allowed Glycine 0 N--CA 1.44 -1.099 0 CA-C-N 115.023 -0.989 . . . . 0.97 110.917 -177.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.1 mtm180 -73.92 -117.09 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.95 0.405 . . . . 1.93 110.186 -179.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -175.06 129.04 0.29 Allowed 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.447 -0.575 . . . . 2.64 109.447 178.413 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.779 HG22 ' HG3' ' A' ' 146' ' ' GLU . 4.1 p -118.94 159.76 23.22 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 109.841 -0.429 . . . . 0.68 109.841 174.002 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -57.71 -36.47 72.06 Favored 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 110.091 -0.337 . . . . 1.47 110.091 178.165 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.429 ' OE1' ' HB3' ' A' ' 140' ' ' MET . 0.9 OUTLIER -57.05 -44.09 82.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.696 -0.683 . . . . 1.04 110.922 178.32 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.515 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.4 OUTLIER -63.41 -55.63 22.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.059 -0.518 . . . . 0.8 110.822 -179.052 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -62.98 -33.98 76.55 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.849 -0.614 . . . . 1.75 110.516 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -57.74 -63.38 1.26 Allowed 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 115.973 -0.558 . . . . 0.64 110.388 176.145 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.561 ' HB2' ' SD ' ' A' ' 140' ' ' MET . 8.6 ttp -59.81 -30.66 69.07 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.41 -0.359 . . . . 1.13 110.54 -175.656 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.552 ' HB2' HD22 ' A' ' 90' ' ' LEU . 3.0 tt0 -61.5 -55.92 25.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.665 -0.698 . . . . 1.3 111.101 178.247 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 62.6 m-80 -85.72 -27.24 25.41 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.092 0.404 . . . . 0.5 112.092 -176.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 94.9 t -89.36 -57.73 4.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 N-CA-C 112.305 0.483 . . . . 0.3 112.305 -177.085 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.668 HG22 ' HB3' ' A' ' 136' ' ' LYS . 48.0 t -82.15 -66.66 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 112.143 0.423 . . . . 0.26 112.143 -169.864 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.462 HG12 ' O ' ' A' ' 42' ' ' MET . 0.9 OUTLIER -65.97 -37.18 79.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 C-N-CA 120.707 -0.397 . . . . 0.83 111.248 -174.248 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.533 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 0.2 OUTLIER -56.7 -39.95 74.76 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.544 0.212 . . . . 2.4 111.164 178.702 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 12.2 m -77.47 -35.78 53.44 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 121.131 -0.228 . . . . 0.55 111.158 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.684 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -62.02 -39.05 90.95 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.269 0.557 . . . . 0.33 109.581 175.012 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 33.1 t-105 -62.74 -29.35 70.62 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.549 -0.751 . . . . 0.39 111.235 177.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.533 ' HG3' ' O ' ' A' ' 48' ' ' LYS . 12.7 mtpt -82.5 -5.54 58.78 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 111.949 0.352 . . . . 2.24 111.949 -175.394 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.525 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 4.7 t-80 -74.71 128.19 34.95 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.01 0.433 . . . . 0.39 110.028 177.414 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -82.61 15.7 2.47 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.247 -0.433 . . . . 1.91 111.445 -176.197 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.525 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.4 OUTLIER -112.15 -7.42 14.05 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.175 -0.676 . . . . 0.93 109.175 171.296 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.597 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -96.24 11.42 34.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.63 -0.713 . . . . 0.28 110.498 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.489 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 42.9 p-90 -63.27 -33.33 10.32 Favored Pre-proline 0 CA--C 1.545 0.778 0 N-CA-C 113.849 1.055 . . . . 0.58 113.849 -175.64 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.489 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 10.3 Cg_exo -73.37 -13.76 25.35 Favored 'Trans proline' 0 C--N 1.356 0.956 0 C-N-CA 121.423 1.415 . . . . 0.47 111.88 176.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -94.91 -0.89 53.58 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.986 -0.552 . . . . 1.11 110.665 -178.502 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 12.5 m-30 -66.64 -34.53 78.07 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.017 -0.538 . . . . 0.63 110.987 -179.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -94.68 138.35 22.26 Favored Pre-proline 0 C--N 1.325 -0.479 0 CA-C-N 115.857 -0.611 . . . . 1.63 110.663 -175.797 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.617 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 41.2 Cg_endo -69.38 141.95 48.23 Favored 'Trans proline' 0 C--O 1.237 0.468 0 C-N-CA 122.523 2.149 . . . . 0.87 112.65 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.414 HG11 ' CD2' ' A' ' 73' ' ' TYR . 53.1 t -77.32 87.93 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.798 0.809 . . . . 0.88 109.319 177.243 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.45 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.0 OUTLIER -102.98 1.92 34.29 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.286 -0.87 . . . . 1.85 110.41 -178.015 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.45 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 85.72 -21.31 0.22 Allowed 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 114.804 -1.089 . . . . 1.29 112.186 177.091 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 35.0 mm -112.26 -49.37 5.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 120.859 0.361 . . . . 1.89 111.002 -178.086 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.43 -36.32 73.46 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.004 -0.544 . . . . 2.99 111.699 -178.395 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -108.58 4.8 24.43 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.328 -0.396 . . . . 1.66 110.456 178.607 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 55.33 52.27 11.69 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.349 -0.842 . . . . 1.74 111.597 -179.068 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 19.2 mt -127.05 64.9 62.37 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 116.058 -0.519 . . . . 1.61 111.61 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' PRO . . . . . 0.42 ' HA ' ' HB1' ' A' ' 65' ' ' ALA . 64.6 Cg_endo -75.76 -20.23 15.59 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 121.956 1.771 . . . . 1.3 110.865 176.667 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -75.78 -19.8 58.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.958 -1.019 . . . . 1.97 110.361 179.023 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.469 ' OH ' ' HB3' ' A' ' 111' ' ' ASN . 0.5 OUTLIER -64.77 -39.07 93.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.336 -0.847 . . . . 1.13 110.299 178.98 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.414 ' HE1' HG12 ' A' ' 63' ' ' VAL . 0.3 OUTLIER -78.29 6.28 8.59 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.507 -0.769 . . . . 0.91 111.456 -174.44 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -97.36 -53.99 3.29 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.096 0.474 . . . . 2.86 109.727 -179.291 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.9 mp -90.53 -47.02 14.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.563 -0.744 . . . . 1.0 110.878 -178.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 26.8 mm -78.18 114.83 19.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.964 -0.562 . . . . 0.75 110.353 -177.187 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.9 mtmm -72.86 -27.01 61.67 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.677 -0.692 . . . . 1.99 111.441 -176.015 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -127.13 81.78 69.32 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 116.276 -0.42 . . . . 2.05 110.817 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -65.95 93.63 0.27 Allowed 'Trans proline' 0 C--O 1.236 0.392 0 C-N-CA 122.601 2.201 . . . . 0.89 111.94 178.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 1.6 mmt -126.26 157.55 38.02 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.893 -0.594 . . . . 0.82 110.335 -178.012 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.617 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 1.2 p-10 -139.65 -121.72 0.12 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.023 -0.989 . . . . 1.42 109.427 -172.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' MET . . . . . 0.422 ' SD ' HD13 ' A' ' 50' ' ' LEU . 3.6 ttp -130.72 -17.31 3.23 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.033 0.444 . . . . 0.8 110.434 178.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -88.71 -27.76 23.44 Favored Glycine 0 N--CA 1.442 -0.944 0 N-CA-C 110.235 -1.146 . . . . 0.32 110.235 -179.241 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -74.23 -36.0 63.9 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.271 -0.464 . . . . 0.95 110.655 176.138 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.438 HG23 ' SG ' ' A' ' 101' ' ' CYS . 75.5 mt -61.73 -53.05 53.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.796 -0.638 . . . . 0.97 110.093 175.03 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.526 ' O ' ' HG2' ' A' ' 91' ' ' GLU . 0.2 OUTLIER -63.08 -28.18 69.9 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.157 -0.474 . . . . 1.15 111.247 178.843 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.409 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 2.3 tptt -64.36 -47.18 80.3 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.894 0.378 . . . . 2.46 110.581 178.755 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.505 ' HB3' ' CE2' ' A' ' 95' ' ' TYR . 6.9 mtp180 -65.33 -29.71 70.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.008 -0.542 . . . . 1.16 110.447 178.222 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.552 HD22 ' HB2' ' A' ' 43' ' ' GLN . 12.4 mt -73.22 -54.92 7.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.759 -0.655 . . . . 0.49 111.674 -179.139 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.526 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 2.6 pt-20 -66.77 -31.56 72.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.432 -0.349 . . . . 1.39 111.215 -175.75 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.409 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 0.7 OUTLIER -81.32 -4.78 56.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.33 -0.395 . . . . 1.3 110.507 178.877 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.5 t30 56.82 58.56 4.0 Favored 'General case' 0 CA--C 1.522 -0.097 0 CA-C-N 115.731 -0.668 . . . . 1.75 111.363 -179.258 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' TYR . . . . . 0.506 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 62.1 t80 -87.54 -35.2 18.28 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.31 -0.404 . . . . 0.96 111.067 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.505 ' CE2' ' HB3' ' A' ' 89' ' ' ARG . 54.1 m-85 -77.71 168.8 19.36 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-O 121.823 0.821 . . . . 1.28 111.624 -176.031 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' TRP . . . . . 0.633 ' CZ3' ' HB2' ' A' ' 32' ' ' PRO . 2.0 t90 -87.48 -44.25 11.45 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 114.116 -1.402 . . . . 1.05 109.432 168.166 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.479 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 3.3 t -153.22 170.89 19.45 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 114.949 -1.023 . . . . 1.0 110.265 -170.756 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.515 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -65.43 -23.43 66.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.746 0.308 . . . . 0.66 111.121 -177.77 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.3 -25.25 67.76 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.09 -0.505 . . . . 0.85 111.03 178.268 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.406 ' HB3' ' CD1' ' A' ' 95' ' ' TYR . 16.6 tt0 -83.86 -29.5 27.19 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.227 0.537 . . . . 2.44 109.653 179.419 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.438 ' SG ' HG23 ' A' ' 86' ' ' ILE . 5.2 t -82.45 -30.98 29.7 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.715 -0.675 . . . . 0.95 111.076 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.02 -30.96 69.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.258 -0.428 . . . . 1.13 110.775 -179.533 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -63.59 -43.07 98.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.13 -0.486 . . . . 2.96 110.261 175.593 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -68.31 -43.16 78.23 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.036 -0.529 . . . . 1.87 109.715 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.684 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -54.92 -52.18 63.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.478 -0.783 . . . . 0.38 110.508 176.138 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -59.78 -40.65 88.98 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.838 -0.619 . . . . 0.97 110.67 178.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.433 ' HA ' ' OG1' ' A' ' 110' ' ' THR . 97.3 m -63.34 -43.71 96.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.118 -0.492 . . . . 0.43 111.276 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.49 -44.3 68.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.987 0.422 . . . . 0.88 110.82 177.024 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -71.63 -41.08 69.29 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.124 -0.489 . . . . 0.29 111.24 -179.014 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.433 ' OG1' ' HA ' ' A' ' 107' ' ' THR . 0.1 OUTLIER -65.0 -42.15 94.73 Favored 'General case' 0 CA--C 1.52 -0.21 0 C-N-CA 120.88 -0.328 . . . . 0.66 110.623 -179.851 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ASN . . . . . 0.469 ' HB3' ' OH ' ' A' ' 73' ' ' TYR . 59.6 m-20 -48.75 -52.55 23.1 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.656 -0.702 . . . . 1.84 111.114 178.513 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 1.8 t -56.26 -46.42 79.68 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.694 -0.684 . . . . 0.63 111.573 177.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -73.58 -20.81 60.52 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.83 0.307 . . . . 0.81 111.83 -174.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 89.0 mt -91.8 -55.93 5.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.653 0.263 . . . . 0.55 111.301 -176.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -76.19 -39.98 53.48 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.823 0.344 . . . . 1.22 110.905 -175.156 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -93.01 150.9 20.22 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.339 -0.391 . . . . 1.04 110.414 -176.232 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 2.9 ttpp -64.98 142.03 98.55 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.859 -0.609 . . . . 3.47 110.195 178.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' PRO . . . . . 0.44 ' HA ' HG11 ' A' ' 123' ' ' VAL . 16.7 Cg_endo -59.46 -13.1 19.31 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.832 2.355 . . . . 0.96 112.376 178.179 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -111.45 26.91 10.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.119 -0.491 . . . . 1.23 110.811 178.286 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ASP . . . . . 0.412 ' OD1' HG22 ' A' ' 122' ' ' ILE . 6.2 t70 -88.09 158.7 18.5 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.178 -0.465 . . . . 1.34 110.76 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ASP . . . . . 0.429 ' HB3' ' HG3' ' B' ' 315' ' ' ALY . 0.3 OUTLIER -61.81 -43.66 98.41 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.153 -0.93 . . . . 1.44 110.611 -179.313 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ILE . . . . . 0.578 HG21 ' HD2' ' B' ' 312' ' ' ALY . 1.0 OUTLIER -69.16 -36.65 74.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-O 120.998 0.428 . . . . 0.42 110.872 -178.688 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.44 HG11 ' HA ' ' A' ' 118' ' ' PRO . 3.1 t -67.66 -36.52 76.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.075 0.464 . . . . 0.35 110.302 -179.187 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.34 -33.78 71.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.812 -0.631 . . . . 0.52 110.112 178.414 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' MET . . . . . 0.421 ' O ' HD13 ' A' ' 129' ' ' LEU . 16.9 mtt -79.61 -42.93 23.86 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.819 -0.628 . . . . 0.62 110.677 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.94 -36.79 65.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.042 -0.526 . . . . 0.31 111.755 -178.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -62.43 -40.91 98.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.471 . . . . 1.94 111.055 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.04 -37.71 61.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.078 0.466 . . . . 0.32 110.523 179.108 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.597 HD21 ' HA ' ' A' ' 56' ' ' ALA . 1.6 mp -58.85 -39.59 81.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.416 -0.811 . . . . 0.33 110.536 179.037 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -61.47 -25.12 67.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.517 -0.765 . . . . 1.47 112.075 -177.091 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.517 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -66.45 -39.45 88.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.777 0.322 . . . . 2.24 110.433 -176.924 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.573 HD12 HD23 ' A' ' 50' ' ' LEU . 8.9 mt -70.06 -30.9 45.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.069 -0.514 . . . . 1.23 110.416 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.54 ' O ' HG23 ' A' ' 137' ' ' VAL . 61.5 t80 -59.78 -62.87 1.55 Allowed 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.835 -0.621 . . . . 0.46 110.491 179.447 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.61 -30.26 71.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.937 0.398 . . . . 0.64 110.665 -177.593 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.517 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -57.16 -47.42 81.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.491 -0.777 . . . . 1.61 111.267 179.724 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 136' ' ' LYS . . . . . 0.668 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -89.18 -18.55 26.91 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.91 -0.587 . . . . 1.52 111.139 -176.304 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 133' ' ' PHE . 40.5 t -72.34 -31.79 40.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 109.77 -0.455 . . . . 0.35 109.77 177.174 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -60.3 -27.38 67.26 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.48 -0.782 . . . . 0.5 110.588 175.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -91.02 -8.86 47.89 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.054 -0.975 . . . . 1.76 111.123 -173.365 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' MET . . . . . 0.561 ' SD ' ' HB2' ' A' ' 42' ' ' MET . 0.9 OUTLIER -64.81 144.59 98.93 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.11 -0.495 . . . . 0.86 111.171 -178.208 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.435 ' C ' ' H ' ' A' ' 143' ' ' GLU . 57.9 Cg_endo -70.34 107.38 1.96 Allowed 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.453 2.102 . . . . 0.67 111.324 178.347 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.78 29.45 0.11 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.273 0.559 . . . . 2.91 111.759 -173.366 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.435 ' H ' ' C ' ' A' ' 141' ' ' PRO . 22.3 mt-10 -105.33 -39.71 6.07 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.782 -0.644 . . . . 2.7 109.631 174.649 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 63.27 73.27 0.46 Allowed 'General case' 0 C--N 1.334 -0.089 0 CA-C-N 114.788 -1.096 . . . . 2.34 109.829 -174.402 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 1.5 t -89.62 122.01 40.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.698 -0.683 . . . . 0.99 109.734 -176.043 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.779 ' HG3' HG22 ' A' ' 36' ' ' THR . 7.9 tt0 -70.71 147.58 48.91 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.758 0.313 . . . . 1.53 110.698 -179.291 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 64.9 mt . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.584 -0.722 . . . . 1.57 110.239 -178.856 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.578 0 N-CA-C 111.769 -0.533 . . . . 2.17 111.769 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 312' ' ' ALY . . . . . 0.578 ' HD2' HG21 ' A' ' 122' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 120.96 -33.72 4.3 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.987 -0.625 . . . . 1.97 111.766 -179.362 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -142.89 127.48 17.99 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.884 -0.413 . . . . 3.58 109.884 178.047 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 315' ' ' ALY . . . . . 0.429 ' HG3' ' HB3' ' A' ' 121' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 316' ' ' LYS . . . . . 0.407 ' HD2' ' HA ' ' B' ' 316' ' ' LYS . 26.2 mmmt . . . . . 0 C--O 1.251 1.137 0 O-C-N 124.253 0.971 . . . . 4.6 112.507 179.501 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo . . . . . 0 N--CA 1.477 0.558 0 N-CA-C 109.952 -0.826 . . . . 6.18 109.952 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.1 mt -149.67 -178.78 6.64 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.862 -0.421 . . . . 5.71 109.862 177.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.76 -73.09 2.72 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.786 -0.721 . . . . 3.45 112.38 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.3 p -124.72 178.19 5.59 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.86 0.362 . . . . 2.44 110.791 -178.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -69.4 151.25 46.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.933 -0.576 . . . . 1.64 111.177 174.623 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.5 p -120.15 -14.99 7.93 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 115.556 -0.747 . . . . 0.93 109.48 171.715 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.2 m -177.11 138.78 0.25 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-N 114.957 -1.02 . . . . 1.61 109.827 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.5 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 35.3 t-20 -135.34 127.17 17.73 Favored Pre-proline 0 C--N 1.322 -0.625 0 N-CA-C 109.472 -0.566 . . . . 1.6 109.472 178.313 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -61.46 -38.3 64.55 Favored 'Trans proline' 0 N--CA 1.475 0.426 0 C-N-CA 123.239 2.626 . . . . 1.87 113.034 -178.038 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.1 m -80.34 -19.65 46.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.216 0.531 . . . . 2.18 110.49 -178.312 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.5 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 5.6 tttp -96.61 107.07 34.15 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.522 -0.763 . . . . 2.75 110.502 178.432 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.461 ' HB2' ' CZ3' ' A' ' 96' ' ' TRP . 3.2 Cg_exo -72.85 149.02 46.99 Favored 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 122.413 2.075 . . . . 1.38 112.391 -178.119 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -145.92 85.68 0.18 Allowed Glycine 0 N--CA 1.442 -0.965 0 N-CA-C 110.746 -0.941 . . . . 0.97 110.746 178.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -74.54 159.25 32.44 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.15 0.5 . . . . 1.93 110.976 -175.81 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.59 104.74 17.19 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.241 -0.436 . . . . 2.64 109.886 179.382 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.589 HG22 ' HG3' ' A' ' 146' ' ' GLU . 1.5 p -104.36 164.29 11.84 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.048 -0.524 . . . . 0.68 110.513 178.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -60.46 -41.37 93.99 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.268 -0.424 . . . . 1.47 110.551 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -61.92 -44.66 96.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.238 -0.437 . . . . 1.04 110.565 178.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.16 -52.96 63.11 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.824 -0.625 . . . . 0.8 111.092 -178.8 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 20.7 mm100 -69.26 -28.25 66.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.042 -0.526 . . . . 1.75 110.919 -179.094 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.466 ' CE1' ' HG2' ' A' ' 140' ' ' MET . 53.2 t80 -61.23 -63.84 1.15 Allowed 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.994 -0.548 . . . . 0.64 110.137 177.102 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.517 ' O ' HG12 ' A' ' 47' ' ' VAL . 0.3 OUTLIER -61.52 -30.52 70.68 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.946 -0.301 . . . . 1.13 110.611 -173.091 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 33.0 tt0 -58.71 -59.18 5.81 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.684 -0.689 . . . . 1.3 111.245 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 63.4 m-80 -87.81 -25.95 23.09 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 112.231 0.456 . . . . 0.5 112.231 -177.016 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.404 HG11 ' CZ ' ' A' ' 41' ' ' TYR . 97.4 t -89.1 -57.97 3.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 112.386 0.513 . . . . 0.3 112.386 -175.846 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.475 HG23 ' HA ' ' A' ' 42' ' ' MET . 59.6 t -81.97 -66.25 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 111.941 0.348 . . . . 0.26 111.941 -170.06 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.517 HG12 ' O ' ' A' ' 42' ' ' MET . 2.1 p -66.99 -32.7 59.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 C-N-CA 120.925 -0.31 . . . . 0.83 111.345 -174.002 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.2 -34.0 75.63 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.775 -0.37 . . . . 2.4 111.001 176.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 38.2 m -79.89 -36.59 36.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.725 0.297 . . . . 0.55 110.302 177.537 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.653 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -60.5 -44.7 95.7 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.169 -0.469 . . . . 0.33 109.768 175.399 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 17.6 t-105 -62.76 -30.43 71.44 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.457 -0.792 . . . . 0.39 111.556 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.9 mtpp -90.7 7.62 38.6 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.018 0.377 . . . . 2.24 112.018 -174.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.493 ' HB3' ' HB2' ' A' ' 56' ' ' ALA . 41.3 t-80 -75.61 143.55 42.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.913 0.387 . . . . 0.39 110.133 177.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -69.12 -25.09 64.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.166 -0.47 . . . . 1.91 112.205 -175.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.568 ' HB3' ' HB2' ' A' ' 125' ' ' MET . 21.7 m-85 -105.23 8.42 33.96 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.065 0.459 . . . . 0.93 110.619 -178.819 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.609 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -93.15 8.13 41.4 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.135 0.493 . . . . 0.28 110.837 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.419 ' CG ' ' HD3' ' A' ' 58' ' ' PRO . 62.3 p-90 -62.44 -34.47 15.06 Favored Pre-proline 0 CA--C 1.548 0.872 0 N-CA-C 113.873 1.064 . . . . 0.58 113.873 -175.577 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.643 ' HG2' ' SD ' ' A' ' 125' ' ' MET . 5.6 Cg_exo -80.14 3.66 7.44 Favored 'Trans proline' 0 C--N 1.36 1.173 0 C-N-CA 121.636 1.557 . . . . 0.47 112.221 179.219 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 31.4 m-85 -113.9 47.05 1.23 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.702 0.763 . . . . 1.11 109.166 178.315 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -114.18 -13.61 12.38 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.146 -0.934 . . . . 0.63 109.903 -178.581 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.76 117.0 24.43 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 115.268 -0.878 . . . . 1.63 110.602 -169.377 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.32 143.23 93.55 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 122.337 2.024 . . . . 0.87 112.196 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.479 HG11 ' CD2' ' A' ' 73' ' ' TYR . 2.9 t -67.5 106.09 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-O 121.715 0.769 . . . . 0.88 110.047 178.226 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.404 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.0 OUTLIER -107.51 0.93 23.06 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.859 -1.064 . . . . 1.85 109.379 178.774 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.404 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 77.31 -55.73 0.53 Allowed 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 114.274 -1.33 . . . . 1.29 111.595 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.0 mt -77.77 -49.41 21.99 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.817 0 N-CA-C 111.635 0.235 . . . . 1.89 111.635 -173.15 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.71 -19.73 64.38 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.805 0.298 . . . . 2.99 111.805 -175.801 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.46 HD12 ' HA ' ' A' ' 68' ' ' LEU . 1.4 tp -109.84 -0.86 18.17 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.888 -0.325 . . . . 1.66 111.288 179.257 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 61.88 42.78 9.98 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.711 -0.677 . . . . 1.74 112.129 178.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -126.51 68.37 67.74 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 115.969 -0.56 . . . . 1.61 110.683 176.864 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -72.1 -26.0 18.61 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.093 1.862 . . . . 1.3 111.869 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 -84.28 -4.14 58.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.741 -0.663 . . . . 1.97 110.484 -178.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.479 ' CD2' HG11 ' A' ' 63' ' ' VAL . 27.0 t80 -65.29 -30.89 71.79 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.699 -0.682 . . . . 1.13 110.307 178.621 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -80.89 2.93 24.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.548 -0.751 . . . . 0.91 111.613 -171.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.7 mtpt -96.75 -51.08 4.43 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.078 0.466 . . . . 2.86 109.859 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.7 mp -81.58 -45.0 20.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.865 -0.607 . . . . 1.0 110.539 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 45.0 mm -89.56 123.32 41.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.192 -0.458 . . . . 0.75 110.019 -178.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.468 ' O ' ' HD3' ' A' ' 80' ' ' PRO . 0.9 OUTLIER -86.44 -36.12 19.29 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.263 -0.426 . . . . 1.99 111.295 -175.235 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -112.33 90.4 14.15 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 109.708 -0.479 . . . . 2.05 109.708 176.598 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.468 ' HD3' ' O ' ' A' ' 78' ' ' LYS . 13.1 Cg_exo -69.11 87.11 0.47 Allowed 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.996 2.464 . . . . 0.89 111.937 -178.78 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.0 mmt -124.0 164.38 19.47 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.888 -0.596 . . . . 0.82 110.766 -176.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.46 ' CG ' ' H ' ' A' ' 83' ' ' MET . 19.9 t70 -143.18 -144.64 0.16 Allowed 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 106.755 -1.572 . . . . 1.42 106.755 -177.105 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' MET . . . . . 0.46 ' H ' ' CG ' ' A' ' 82' ' ' ASP . 0.5 OUTLIER -107.84 -18.06 13.91 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 107.924 -1.139 . . . . 0.8 107.924 177.758 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -74.98 -26.26 67.16 Favored Glycine 0 N--CA 1.439 -1.135 0 N-CA-C 109.398 -1.481 . . . . 0.32 109.398 177.364 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -83.9 -37.22 22.65 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 114.868 -0.666 . . . . 0.95 111.079 177.324 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -61.11 -49.96 82.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.003 -0.544 . . . . 0.97 109.719 178.095 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.415 ' HG3' ' N ' ' A' ' 88' ' ' LYS . 0.1 OUTLIER -66.58 -26.44 67.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.863 -0.608 . . . . 1.15 111.001 179.957 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.415 ' N ' ' HG3' ' A' ' 87' ' ' LYS . 1.2 tptt -67.47 -51.36 52.26 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-O 120.688 0.28 . . . . 2.46 110.703 -179.327 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.453 HH22 ' CG ' ' A' ' 104' ' ' ASP . 10.0 mtm-85 -67.66 -24.05 65.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.944 0.402 . . . . 1.16 110.81 -179.153 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 4.0 mt -73.33 -59.52 2.67 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.957 -0.565 . . . . 0.49 111.041 177.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 19.9 pt-20 -66.63 -36.73 83.29 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.738 -0.665 . . . . 1.39 111.114 -175.019 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -79.26 -4.41 50.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.384 -0.371 . . . . 1.3 110.6 -179.05 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 58.25 72.04 0.55 Allowed 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.428 0.632 . . . . 1.75 110.731 176.291 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -93.97 -49.94 5.56 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.002 -0.544 . . . . 0.96 110.98 179.301 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.438 ' CE1' ' HB2' ' A' ' 101' ' ' CYS . 0.2 OUTLIER -96.07 -179.67 4.76 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.846 0.355 . . . . 1.28 110.94 -177.933 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 96' ' ' TRP . . . . . 0.461 ' CZ3' ' HB2' ' A' ' 32' ' ' PRO . 2.1 t-105 -82.58 -46.52 13.23 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.74 -0.664 . . . . 1.05 111.878 -174.055 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.4 t -144.93 172.3 13.24 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 120.424 -0.511 . . . . 1.0 110.929 -173.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -68.16 -17.88 64.46 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.081 -0.508 . . . . 0.66 111.458 -176.255 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.06 -33.81 73.91 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 121.019 0.437 . . . . 0.85 109.976 175.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.4 -37.35 63.4 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.877 -0.601 . . . . 2.44 109.571 177.179 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.438 ' HB2' ' CE1' ' A' ' 95' ' ' TYR . 41.3 t -68.01 -39.49 83.17 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.565 -0.743 . . . . 0.95 111.322 -178.774 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.23 -22.99 67.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.359 -0.382 . . . . 1.13 110.912 -177.029 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -67.2 -44.29 79.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.064 0.459 . . . . 2.96 110.466 175.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ASP . . . . . 0.453 ' CG ' HH22 ' A' ' 89' ' ' ARG . 0.6 OUTLIER -78.76 -29.97 45.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.36 -0.382 . . . . 1.87 110.194 -179.348 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.653 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -60.84 -40.72 93.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.77 -0.65 . . . . 0.38 109.647 173.145 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -68.72 -34.52 75.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.771 -0.65 . . . . 0.97 110.126 174.601 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 86.3 m -63.02 -51.93 64.86 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.891 -0.595 . . . . 0.43 111.265 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 10.7 ptm -59.57 -32.75 70.65 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.783 0.325 . . . . 0.88 111.291 -178.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -73.13 -47.51 43.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.509 -0.314 . . . . 0.29 110.764 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.1 p -64.84 -38.97 92.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.756 0.312 . . . . 0.66 110.589 179.048 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.0 m-20 -47.83 -53.08 16.65 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.529 -0.759 . . . . 1.84 110.731 177.077 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 10.6 t -60.84 -43.81 97.78 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.312 -0.858 . . . . 0.63 111.02 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -66.14 -33.98 77.02 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.492 -0.322 . . . . 0.81 111.541 -177.229 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 70.6 mt -80.32 -55.46 8.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.575 -0.284 . . . . 0.55 111.622 -176.1 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.475 ' CE1' ' HA ' ' A' ' 73' ' ' TYR . 57.6 t80 -68.3 -35.87 78.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.908 0.385 . . . . 1.22 111.43 -174.048 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 63.6 m-80 -94.23 -170.23 2.24 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.137 -0.483 . . . . 1.04 110.725 -175.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.31 154.5 40.54 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 116.32 -0.4 . . . . 3.47 110.363 -177.563 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -61.9 -25.54 78.21 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.415 2.076 . . . . 0.96 111.67 176.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.26 22.07 12.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.787 -0.642 . . . . 1.23 111.018 178.273 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ASP . . . . . 0.41 ' OD1' HG22 ' A' ' 122' ' ' ILE . 3.8 t70 -87.23 155.57 20.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 1.34 110.341 179.431 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ASP . . . . . 0.506 ' HB3' ' HB3' ' B' ' 315' ' ' ALY . 42.8 m-20 -68.83 -42.36 77.31 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.728 -0.669 . . . . 1.44 110.244 -178.292 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ILE . . . . . 0.707 ' HA ' ' SD ' ' A' ' 125' ' ' MET . 1.4 tp -65.21 -32.81 59.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.853 -0.612 . . . . 0.42 110.743 -177.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 2.7 t -74.09 -37.71 47.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.145 0.498 . . . . 0.35 110.105 178.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.14 -38.45 79.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.681 -0.691 . . . . 0.52 110.515 -178.495 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' MET . . . . . 0.707 ' SD ' ' HA ' ' A' ' 122' ' ' ILE . 0.0 OUTLIER -82.5 -39.28 22.67 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.325 -0.398 . . . . 0.62 111.311 177.991 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.23 -32.24 64.26 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.753 0.311 . . . . 0.31 111.566 -178.462 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -63.98 -44.39 92.84 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.17 -0.468 . . . . 1.94 110.692 177.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.63 -41.23 84.23 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.236 -0.438 . . . . 0.32 110.565 177.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.609 HD21 ' HA ' ' A' ' 56' ' ' ALA . 9.3 mp -56.73 -45.34 82.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.81 -0.632 . . . . 0.33 110.549 177.599 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -65.05 -23.32 67.15 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.649 -0.705 . . . . 1.47 111.551 -177.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.2 -49.16 53.07 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 110.17 -0.308 . . . . 2.24 110.17 -177.11 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.442 HG13 ' O ' ' A' ' 129' ' ' LEU . 1.0 OUTLIER -72.41 -24.92 22.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.41 -0.359 . . . . 1.23 110.324 178.07 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -60.76 -62.07 2.12 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.97 -0.559 . . . . 0.46 110.406 174.597 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.82 -25.58 67.28 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.897 0.379 . . . . 0.64 110.629 -177.685 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -60.84 -44.06 97.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.68 -0.691 . . . . 1.61 111.042 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 30.6 mttm -91.73 -13.0 32.36 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.955 0.407 . . . . 1.52 111.017 -177.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 19.5 t -81.73 -29.12 10.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.207 0.527 . . . . 0.35 110.04 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -71.76 -7.76 50.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.436 0.636 . . . . 0.5 110.324 176.738 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -107.68 2.87 24.12 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.237 -0.892 . . . . 1.76 110.378 179.488 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' MET . . . . . 0.466 ' HG2' ' CE1' ' A' ' 41' ' ' TYR . 0.6 OUTLIER -61.77 149.51 84.85 Favored Pre-proline 0 C--O 1.232 0.182 0 CA-C-N 115.669 -0.696 . . . . 0.86 110.676 177.022 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -74.02 90.68 0.96 Allowed 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 121.902 1.734 . . . . 0.67 110.832 175.259 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -63.79 -4.15 2.94 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.996 -0.547 . . . . 2.91 111.736 -175.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -79.06 -34.77 43.42 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.771 -0.649 . . . . 2.7 110.066 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 67.68 93.26 0.08 Allowed 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 114.813 -1.085 . . . . 2.34 109.524 -177.024 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -113.04 118.73 58.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.818 -0.628 . . . . 0.99 110.142 -176.245 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.589 ' HG3' HG22 ' A' ' 36' ' ' THR . 2.4 tt0 -74.28 132.59 42.23 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.676 -0.49 . . . . 1.53 109.676 178.291 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 34.3 mt . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.744 -0.646 . . . . 1.57 110.133 -177.062 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.692 0 N-CA-C 111.648 -0.581 . . . . 2.17 111.648 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 123.09 -38.29 2.54 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.864 -0.684 . . . . 1.97 111.716 -177.045 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.88 136.13 26.72 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.793 -0.447 . . . . 3.58 109.793 175.768 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 315' ' ' ALY . . . . . 0.506 ' HB3' ' HB3' ' A' ' 121' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 3.9 pttt . . . . . 0 C--O 1.247 0.963 0 CA-C-O 118.812 -0.613 . . . . 4.6 110.122 175.785 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_endo . . . . . 0 N--CA 1.477 0.547 0 N-CA-C 110.729 -0.527 . . . . 6.18 110.729 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -152.88 91.35 1.54 Allowed 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.381 -0.6 . . . . 5.71 109.381 178.347 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.77 40.73 5.85 Favored Glycine 0 N--CA 1.449 -0.485 0 N-CA-C 110.059 -1.216 . . . . 3.45 110.059 -170.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.77 158.45 30.89 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 114.892 -0.654 . . . . 2.44 111.808 -175.451 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.543 ' HG3' ' CE1' ' A' ' 94' ' ' TYR . 11.1 pt-20 -99.76 165.62 11.5 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.757 -0.656 . . . . 1.64 109.511 174.527 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 7.9 p -126.63 -10.35 4.64 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.103 0 CA-C-O 121.897 0.856 . . . . 0.93 108.696 173.075 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -146.43 138.42 24.88 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 114.32 -1.309 . . . . 1.61 108.416 177.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.527 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 16.4 t-20 -143.01 122.33 7.6 Favored Pre-proline 0 C--N 1.313 -0.98 0 C-N-CA 120.786 -0.366 . . . . 1.6 110.459 176.595 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -67.39 -46.29 2.97 Favored 'Trans proline' 0 N--CA 1.475 0.439 0 C-N-CA 123.43 2.753 . . . . 1.87 113.351 -177.146 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.8 m -71.81 -39.52 69.79 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.975 -0.557 . . . . 2.18 110.502 -175.147 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.527 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 0.2 OUTLIER -66.38 130.37 94.2 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.338 -0.846 . . . . 2.75 110.005 179.638 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -60.97 156.79 42.11 Favored 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.7 2.267 . . . . 1.38 112.554 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -160.67 63.11 0.29 Allowed Glycine 0 N--CA 1.446 -0.667 0 N-CA-C 110.658 -0.977 . . . . 0.97 110.658 -179.588 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.461 ' HG3' ' CZ2' ' A' ' 96' ' ' TRP . 5.8 mtm-85 -79.53 132.54 36.34 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.848 0.356 . . . . 1.93 110.142 -174.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.4 ttmt -80.33 119.75 23.47 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.104 -0.498 . . . . 2.64 110.438 -173.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.758 HG22 ' HG3' ' A' ' 146' ' ' GLU . 0.6 OUTLIER -112.76 160.34 18.06 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.815 -0.354 . . . . 0.68 111.154 178.421 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.486 ' OD1' ' HG3' ' A' ' 141' ' ' PRO . 5.4 t-20 -55.51 -46.56 76.96 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 115.786 -0.643 . . . . 1.47 110.321 176.384 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -54.32 -46.31 72.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.648 -0.706 . . . . 1.04 110.925 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.0 -57.96 10.75 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.643 -0.708 . . . . 0.8 111.561 -177.409 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -70.86 -25.29 62.74 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.066 -0.515 . . . . 1.75 110.79 -176.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.584 ' CE1' ' HG2' ' A' ' 140' ' ' MET . 54.0 t80 -61.85 -62.39 1.83 Allowed 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 116.064 -0.516 . . . . 0.64 110.345 175.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.578 ' O ' HG13 ' A' ' 47' ' ' VAL . 0.1 OUTLIER -59.15 -35.22 73.14 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 120.792 0.33 . . . . 1.13 110.15 -175.329 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -56.75 -54.66 43.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.567 -0.742 . . . . 1.3 111.159 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.454 ' O ' ' HB2' ' A' ' 48' ' ' LYS . 69.5 m-80 -87.02 -28.62 22.51 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.362 0.504 . . . . 0.5 112.362 -177.217 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 74.8 t -89.19 -58.24 3.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 112.3 0.482 . . . . 0.3 112.3 -175.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.697 HG22 ' HB3' ' A' ' 136' ' ' LYS . 43.3 t -79.52 -62.67 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 116.482 -0.326 . . . . 0.26 111.359 -170.755 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.578 HG13 ' O ' ' A' ' 42' ' ' MET . 1.5 m -62.92 -33.22 59.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 111.669 0.248 . . . . 0.83 111.669 -175.146 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -67.48 -35.24 78.79 Favored 'General case' 0 CA--C 1.528 0.118 0 C-N-CA 120.936 -0.305 . . . . 2.4 111.488 179.275 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.4 m -74.24 -37.76 63.7 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.78 -0.368 . . . . 0.55 110.51 178.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.716 HD23 HD12 ' A' ' 132' ' ' ILE . 0.1 OUTLIER -66.59 -37.61 85.27 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.255 0.55 . . . . 0.33 109.844 175.253 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 9.7 t-105 -65.41 -25.72 67.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.47 -0.786 . . . . 0.39 111.623 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -89.74 3.16 53.65 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 120.61 -0.436 . . . . 2.24 111.665 -177.107 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.525 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 15.7 t-80 -89.1 129.96 35.63 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.647 -0.501 . . . . 0.39 109.647 175.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -77.97 -3.27 41.1 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.188 0.44 . . . . 1.91 112.188 -172.198 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.525 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 2.1 m-30 -93.05 -10.38 36.36 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.157 0.503 . . . . 0.93 110.114 175.795 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.513 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -92.4 19.93 6.67 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.972 -0.558 . . . . 0.28 110.514 178.788 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.642 ' HA ' ' CE2' ' A' ' 60' ' ' TYR . 44.8 p-90 -67.89 -34.45 6.34 Favored Pre-proline 0 CA--C 1.543 0.675 0 N-CA-C 113.309 0.855 . . . . 0.58 113.309 -175.008 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.601 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 3.4 Cg_exo -82.31 10.15 3.68 Favored 'Trans proline' 0 C--N 1.358 1.055 0 C-N-CA 121.711 1.607 . . . . 0.47 111.203 174.129 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -112.57 -15.65 13.0 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.546 -0.752 . . . . 1.11 111.182 -177.085 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.642 ' CE2' ' HA ' ' A' ' 57' ' ' TRP . 12.5 m-85 -66.6 -28.58 68.61 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.389 0.614 . . . . 0.63 110.147 177.445 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -98.35 116.57 65.48 Favored Pre-proline 0 C--N 1.32 -0.693 0 CA-C-N 115.063 -0.971 . . . . 1.63 110.431 -172.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.653 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 18.0 Cg_endo -62.56 133.08 40.77 Favored 'Trans proline' 0 C--O 1.24 0.597 0 C-N-CA 122.564 2.176 . . . . 0.87 112.52 -178.589 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.401 HG11 ' CD2' ' A' ' 73' ' ' TYR . 5.1 t -62.33 111.14 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 CA-C-O 121.893 0.854 . . . . 0.88 109.846 178.066 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.415 ' HB3' ' HG2' ' A' ' 67' ' ' LYS . 0.2 OUTLIER -122.5 -3.53 8.84 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.684 -1.144 . . . . 1.85 109.717 -175.058 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 74.95 -40.43 0.44 Allowed 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 114.967 -1.015 . . . . 1.29 111.596 -178.004 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.8 mt -86.43 -60.92 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 120.677 0.275 . . . . 1.89 111.25 -176.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.415 ' HG2' ' HB3' ' A' ' 64' ' ' ASP . 6.1 pttt -71.5 -10.6 60.01 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.246 0.462 . . . . 2.99 112.246 -175.342 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.461 HD13 ' HA ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -114.58 -1.57 13.34 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.921 0.391 . . . . 1.66 110.596 175.949 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 52.9 50.33 18.24 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.849 -0.614 . . . . 1.74 111.735 -178.726 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.442 HD11 ' HG ' ' A' ' 68' ' ' LEU . 12.7 mt -120.81 71.07 19.32 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.804 -0.634 . . . . 1.61 109.628 174.702 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.71 -31.47 20.7 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.805 2.337 . . . . 1.3 113.458 -170.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.456 ' OD1' ' HG3' ' A' ' 75' ' ' LYS . 0.4 OUTLIER -100.11 10.86 40.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.925 0.393 . . . . 1.97 111.316 -176.763 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.401 ' CD2' HG11 ' A' ' 63' ' ' VAL . 15.8 t80 -63.46 -37.41 87.19 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.073 -0.512 . . . . 1.13 110.266 178.071 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 8.6 m-70 -78.99 -1.11 33.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.678 -0.692 . . . . 0.91 111.415 -175.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.456 ' HG3' ' OD1' ' A' ' 72' ' ' ASP . 13.0 mmtm -96.24 -18.01 20.35 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.216 0.531 . . . . 2.86 110.159 -179.272 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.3 mp -114.82 -45.43 4.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.66 -0.7 . . . . 1.0 110.171 178.493 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 33.3 mm -93.72 116.38 34.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 120.953 0.406 . . . . 0.75 110.116 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.85 -28.41 60.66 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.904 -0.589 . . . . 1.99 111.282 -177.028 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -122.33 85.33 47.4 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 116.23 -0.441 . . . . 2.05 110.842 -177.558 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -68.34 89.95 0.39 Allowed 'Trans proline' 0 CA--C 1.528 0.209 0 C-N-CA 122.527 2.152 . . . . 0.89 112.198 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 10.2 mmt -131.73 157.38 43.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.067 -0.515 . . . . 0.82 110.331 -178.474 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.653 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 1.2 p-10 -151.67 -115.39 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.699 -0.682 . . . . 1.42 109.637 -172.227 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' MET . . . . . 0.421 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 11.6 ttp -129.45 -22.28 3.06 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 121.922 -0.486 . . . . 0.8 110.789 176.572 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -83.3 -25.88 46.0 Favored Glycine 0 N--CA 1.444 -0.816 0 N-CA-C 110.607 -0.997 . . . . 0.32 110.607 179.317 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.442 HG23 ' HB3' ' A' ' 62' ' ' PRO . 0.6 OUTLIER -76.82 -44.86 30.83 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.375 -0.413 . . . . 0.95 110.504 175.76 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.404 HG12 ' HB3' ' A' ' 104' ' ' ASP . 83.6 mt -58.5 -48.68 84.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.732 -0.667 . . . . 0.97 110.257 175.199 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.421 ' HB3' ' O ' ' A' ' 83' ' ' MET . 0.0 OUTLIER -59.6 -32.93 70.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.116 -0.493 . . . . 1.15 110.902 178.397 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 8.6 tppt? -67.4 -50.39 59.81 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 120.601 0.239 . . . . 2.46 110.696 -179.393 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.706 ' HB3' ' CE1' ' A' ' 95' ' ' TYR . 15.2 mtp180 -68.22 -28.25 67.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.911 0.386 . . . . 1.16 110.643 179.29 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 5.8 mt -68.14 -56.59 8.24 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.86 -0.609 . . . . 0.49 111.635 177.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -65.92 -26.36 67.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.982 0.42 . . . . 1.39 111.24 -176.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -87.96 -4.68 58.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.989 -0.551 . . . . 1.3 110.715 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 50.63 61.66 3.1 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.739 -0.664 . . . . 1.75 110.766 -176.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' TYR . . . . . 0.543 ' CE1' ' HG3' ' A' ' 25' ' ' GLU . 72.4 t80 -85.07 -32.83 22.64 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 115.913 -0.585 . . . . 0.96 111.014 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.706 ' CE1' ' HB3' ' A' ' 89' ' ' ARG . 0.1 OUTLIER -80.71 -145.15 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.797 0.808 . . . . 1.28 110.398 178.885 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 96' ' ' TRP . . . . . 0.461 ' CZ2' ' HG3' ' A' ' 34' ' ' ARG . 2.3 t-105 -126.83 -53.59 1.43 Allowed 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 114.479 -1.237 . . . . 1.05 108.091 174.397 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 12.6 t -133.93 -173.06 3.14 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 115.043 -0.98 . . . . 1.0 110.072 -177.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.81 -5.49 58.24 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.611 0.243 . . . . 0.66 111.345 -177.242 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.45 -41.92 98.65 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.902 0.382 . . . . 0.85 110.552 177.739 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -69.66 -28.68 66.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.332 0.587 . . . . 2.44 109.593 177.789 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 4.2 t -71.77 -30.75 65.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.305 -0.862 . . . . 0.95 110.543 177.26 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.6 ttm -64.89 -40.37 94.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.08 -0.509 . . . . 1.13 109.935 177.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.2 -37.37 83.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.73 -0.668 . . . . 2.96 110.123 176.674 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ASP . . . . . 0.404 ' HB3' HG12 ' A' ' 86' ' ' ILE . 1.1 m-20 -58.6 -55.58 33.28 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.601 -0.727 . . . . 1.87 110.509 177.14 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.642 ' HE2' HD12 ' A' ' 50' ' ' LEU . 3.5 m-85 -58.31 -44.58 88.65 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.782 -0.645 . . . . 0.38 110.913 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -56.87 -44.98 82.77 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.28 -0.418 . . . . 0.97 110.294 177.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 54.3 m -65.12 -47.53 76.81 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.125 -0.489 . . . . 0.43 111.037 178.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.72 -41.57 74.05 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.083 -0.508 . . . . 0.88 111.313 -179.706 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -73.41 -45.79 52.59 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.422 -0.354 . . . . 0.29 110.633 -177.049 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.0 p -63.81 -35.6 81.14 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.607 -0.27 . . . . 0.66 110.871 -179.145 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 49.2 m-20 -46.28 -52.08 13.3 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.638 -0.71 . . . . 1.84 111.348 176.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 7.4 t -61.02 -38.42 86.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.451 -0.795 . . . . 0.63 111.085 -178.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -75.97 -16.21 60.03 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.336 -0.393 . . . . 0.81 111.71 -175.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 57.1 mt -92.39 -51.66 11.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.95 0.405 . . . . 0.55 110.816 178.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -71.52 -35.6 70.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.841 -0.618 . . . . 1.22 111.654 -175.167 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -105.3 -179.82 4.05 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.912 0.387 . . . . 1.04 110.982 -175.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.4 154.83 39.27 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.195 -0.457 . . . . 3.47 110.921 -177.027 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -61.48 -17.8 55.81 Favored 'Trans proline' 0 N--CA 1.476 0.49 0 C-N-CA 122.733 2.289 . . . . 0.96 112.373 177.173 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.16 0.42 51.22 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.832 -0.622 . . . . 1.23 111.515 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ASP . . . . . 0.489 ' OD2' ' HA2' ' B' ' 313' ' ' GLY . 1.4 t70 -71.43 156.25 39.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.446 0.641 . . . . 1.34 111.734 -173.488 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -69.58 -41.59 75.61 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.91 -1.041 . . . . 1.44 109.884 -179.322 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 3.1 tp -67.46 -28.11 40.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.602 -0.727 . . . . 0.42 110.627 -179.538 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 1.3 t -70.48 -45.61 73.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 109.794 -0.447 . . . . 0.35 109.794 176.465 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.68 -33.23 71.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.668 -0.696 . . . . 0.52 109.736 177.783 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 30.5 mtt -71.15 -46.62 61.12 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.475 -0.784 . . . . 0.62 110.506 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.58 -40.42 75.2 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.253 -0.43 . . . . 0.31 111.481 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -44.96 96.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.468 -0.333 . . . . 1.94 111.217 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -70.68 -36.89 73.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.074 0.464 . . . . 0.32 110.564 178.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.513 HD21 ' HA ' ' A' ' 56' ' ' ALA . 0.6 OUTLIER -64.29 -44.06 92.82 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.567 -0.742 . . . . 0.33 110.667 179.589 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -62.18 -25.91 68.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.744 -0.662 . . . . 1.47 111.349 -178.456 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.46 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 17.0 ttpt -64.25 -42.39 96.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.22 -0.445 . . . . 2.24 110.029 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.716 HD12 HD23 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -77.27 -23.69 14.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.09 -0.505 . . . . 1.23 110.501 -179.625 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.491 ' O ' HG23 ' A' ' 137' ' ' VAL . 30.3 t80 -62.09 -62.1 2.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.074 -0.512 . . . . 0.46 110.168 176.83 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.11 -26.46 68.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.126 0.489 . . . . 0.64 110.205 -178.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.46 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.01 -33.66 72.3 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.385 -0.825 . . . . 1.61 111.762 179.314 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 136' ' ' LYS . . . . . 0.697 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -97.96 -25.14 15.09 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.135 0.493 . . . . 1.52 110.597 -179.692 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.517 ' O ' ' HB2' ' A' ' 140' ' ' MET . 53.9 t -69.79 -32.35 51.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.948 -0.569 . . . . 0.35 110.619 179.176 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.59 -16.98 64.03 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.124 -0.489 . . . . 0.5 110.49 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -100.29 0.03 39.37 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.741 -0.663 . . . . 1.76 110.223 -179.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' MET . . . . . 0.584 ' HG2' ' CE1' ' A' ' 41' ' ' TYR . 0.1 OUTLIER -71.65 161.2 79.86 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.69 -0.686 . . . . 0.86 110.195 176.903 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.486 ' HG3' ' OD1' ' A' ' 37' ' ' ASN . 65.3 Cg_endo -74.7 107.67 2.52 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 121.714 1.609 . . . . 0.67 109.796 173.306 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -72.29 2.39 6.12 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.801 0.334 . . . . 2.91 111.881 -171.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -100.22 -111.52 0.19 Allowed 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 108.652 -0.87 . . . . 2.7 108.652 171.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 178.3 131.35 0.07 Allowed 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.606 -0.887 . . . . 2.34 108.606 173.164 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 2.8 t -129.04 94.05 2.27 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.705 -0.48 . . . . 0.99 109.705 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.758 ' HG3' HG22 ' A' ' 36' ' ' THR . 4.8 tt0 -67.99 146.28 53.7 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 110.148 -0.316 . . . . 1.53 110.148 177.634 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 9.8 mt . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.427 -0.797 . . . . 1.57 110.133 -178.598 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.586 0 N-CA-C 112.177 -0.369 . . . . 2.17 112.177 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 313' ' ' GLY . . . . . 0.489 ' HA2' ' OD2' ' A' ' 120' ' ' ASP . . . 114.4 -37.33 3.58 Favored Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 111.276 -0.73 . . . . 1.97 111.276 -174.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -158.09 126.06 5.3 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.907 -0.775 . . . . 3.58 108.907 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.842 -0.599 . . . . 4.6 109.597 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_endo . . . . . 0 N--CA 1.48 0.709 0 N-CA-C 110.483 -0.622 . . . . 6.18 110.483 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -137.2 70.08 1.4 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.167 0.508 . . . . 5.71 110.244 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 121.03 43.04 0.45 Allowed Glycine 0 N--CA 1.447 -0.61 0 CA-C-N 115.696 -0.684 . . . . 3.45 112.058 -179.085 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 33.3 p -69.4 151.3 46.29 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.63 -0.285 . . . . 2.44 110.438 178.453 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.473 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 6.1 mt-10 -55.85 123.51 14.49 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 121.471 0.653 . . . . 1.64 112.407 -178.169 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.471 ' O ' ' HB2' ' A' ' 94' ' ' TYR . 5.1 p -116.43 -16.68 8.47 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.939 0 CA-C-N 114.783 -1.099 . . . . 0.93 109.216 173.558 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -160.52 142.14 12.38 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.305 -0.861 . . . . 1.61 109.053 175.591 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.45 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 23.0 t-20 -134.92 127.12 18.16 Favored Pre-proline 0 C--N 1.316 -0.871 0 CA-C-O 120.639 0.257 . . . . 1.6 110.57 -179.661 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -72.97 -44.89 0.52 Allowed 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 122.837 2.358 . . . . 1.87 112.344 175.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.0 m -74.15 -38.22 63.81 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.743 -0.662 . . . . 2.18 110.719 -175.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.45 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 0.2 OUTLIER -85.78 130.31 51.22 Favored Pre-proline 0 C--N 1.322 -0.612 0 N-CA-C 109.055 -0.72 . . . . 2.75 109.055 177.183 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.448 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 18.6 Cg_endo -57.5 137.8 83.14 Favored 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.794 2.329 . . . . 1.38 112.907 -175.897 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -150.67 84.66 0.16 Allowed Glycine 0 N--CA 1.446 -0.656 0 CA-C-N 114.775 -1.102 . . . . 0.97 110.503 -178.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -100.78 -177.84 3.59 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.101 0.477 . . . . 1.93 111.338 -172.277 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.3 ttmt -123.76 100.0 6.56 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.712 -0.676 . . . . 2.64 110.09 177.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.542 HG22 ' HG3' ' A' ' 146' ' ' GLU . 18.0 p -101.13 173.94 6.23 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 116.41 -0.359 . . . . 0.68 110.042 175.761 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.439 ' HB3' ' O ' ' A' ' 145' ' ' VAL . 0.0 OUTLIER -65.68 -38.4 89.18 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.252 -0.431 . . . . 1.47 110.598 178.779 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.512 ' HB2' ' CD ' ' A' ' 144' ' ' GLU . 1.4 tt0 -62.9 -42.77 99.89 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 120.619 0.247 . . . . 1.04 110.856 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.432 ' HB2' ' HA ' ' A' ' 97' ' ' SER . 0.8 OUTLIER -61.07 -54.09 49.03 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.165 -0.471 . . . . 0.8 110.601 179.917 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.3 mm-40 -63.36 -35.55 80.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.988 -0.551 . . . . 1.75 110.781 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -58.39 -64.05 1.06 Allowed 'General case' 0 C--O 1.217 -0.641 0 CA-C-N 116.181 -0.463 . . . . 0.64 110.359 177.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.569 ' SD ' ' HB3' ' A' ' 101' ' ' CYS . 3.3 ttm -60.15 -32.84 71.42 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.414 -0.217 . . . . 1.13 110.414 -174.479 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -59.31 -58.11 10.06 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.904 -0.589 . . . . 1.3 111.056 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.4 m-80 -86.19 -28.04 24.14 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.146 -0.479 . . . . 0.5 112.054 -175.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.422 HG12 ' HD3' ' A' ' 136' ' ' LYS . 95.7 t -88.63 -56.57 5.06 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.926 0 CA-C-N 116.093 -0.503 . . . . 0.3 111.641 -176.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.507 HG23 ' HA ' ' A' ' 42' ' ' MET . 92.5 t -80.08 -65.74 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.395 -0.366 . . . . 0.26 111.892 -170.703 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -63.57 -34.45 67.69 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 C-N-CA 120.601 -0.439 . . . . 0.83 111.526 -174.425 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.89 -32.0 73.25 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.935 -0.306 . . . . 2.4 111.442 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 51.1 m -75.64 -37.5 59.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.842 0.353 . . . . 0.55 110.329 177.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.629 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -63.56 -40.81 97.94 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.162 -0.681 . . . . 0.33 109.162 174.031 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 12.4 t-105 -59.12 -37.56 77.51 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.115 -0.948 . . . . 0.39 111.494 178.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 14.3 mttm -88.86 9.27 25.37 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.178 0.436 . . . . 2.24 112.178 -175.17 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 16.3 t-80 -79.51 144.98 33.46 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.422 -0.584 . . . . 0.39 109.422 174.254 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -79.9 -12.75 59.72 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.616 0.246 . . . . 1.91 111.543 -174.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 3.7 m-30 -99.43 -8.16 25.12 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.992 0.425 . . . . 0.93 110.653 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.434 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -95.36 16.34 17.07 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.084 0.469 . . . . 0.28 110.808 -179.153 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.447 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 60.3 p-90 -62.38 -34.14 14.14 Favored Pre-proline 0 CA--C 1.548 0.867 0 N-CA-C 114.282 1.216 . . . . 0.58 114.282 -174.577 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.447 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 59.4 Cg_endo -90.58 9.88 3.05 Favored 'Trans proline' 0 C--N 1.36 1.148 0 CA-C-N 121.204 1.466 . . . . 0.47 112.866 -178.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -106.39 6.97 30.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.184 -0.462 . . . . 1.11 110.88 -177.198 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.8 m-30 -75.66 -24.87 56.4 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.212 -0.449 . . . . 0.63 111.966 -175.103 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -100.16 128.15 31.43 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 116.482 -0.326 . . . . 1.63 111.325 -171.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.499 ' HA ' ' OD2' ' A' ' 82' ' ' ASP . 27.0 Cg_endo -63.12 133.22 39.91 Favored 'Trans proline' 0 C--O 1.236 0.424 0 C-N-CA 122.667 2.244 . . . . 0.87 111.482 178.037 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.7 t -59.62 110.48 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 122.189 0.995 . . . . 0.88 111.676 -178.007 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -121.17 125.89 48.3 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 113.848 -1.524 . . . . 1.85 106.977 167.525 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.561 ' HB2' ' NE2' ' A' ' 74' ' ' HIS . . . -63.09 -12.49 27.26 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.62 0.6 . . . . 1.29 112.62 -170.13 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.9 mp -106.58 -42.44 6.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 120.84 0.352 . . . . 1.89 110.497 -177.699 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 36.1 tptt -67.09 -44.12 80.81 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.056 -0.52 . . . . 2.99 111.076 179.474 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.767 ' HB3' HD22 ' A' ' 70' ' ' LEU . 0.2 OUTLIER -97.54 -3.77 39.12 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.374 -0.375 . . . . 1.66 110.693 -179.123 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 53.37 63.04 2.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.607 -0.724 . . . . 1.74 110.689 -176.042 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.767 HD22 ' HB3' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -119.81 70.09 13.58 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 115.749 -0.66 . . . . 1.61 110.235 -179.037 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.79 -24.78 8.34 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.388 2.059 . . . . 1.3 112.622 -175.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -96.76 -8.18 31.9 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.004 0.43 . . . . 1.97 110.708 -178.879 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.578 ' O ' ' HB ' ' A' ' 77' ' ' ILE . 17.6 t80 -61.91 -40.17 94.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.762 -0.654 . . . . 1.13 110.208 178.209 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.561 ' NE2' ' HB2' ' A' ' 65' ' ' ALA . 9.5 m-70 -80.33 3.82 19.83 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.877 -0.601 . . . . 0.91 111.174 -178.336 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -108.16 -50.12 3.09 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.032 0.444 . . . . 2.86 110.114 179.042 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.0 mt -78.71 -36.95 20.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.74 -0.664 . . . . 1.0 110.692 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.578 ' HB ' ' O ' ' A' ' 73' ' ' TYR . 28.1 mm -99.79 135.6 34.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.903 -0.59 . . . . 0.75 109.819 -178.794 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.66 -40.64 14.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.813 0.339 . . . . 1.99 111.019 -176.571 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 10.1 m-20 -113.26 95.73 36.5 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.196 -0.456 . . . . 2.05 110.03 177.702 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -68.59 92.87 0.42 Allowed 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.924 2.416 . . . . 0.89 112.306 -178.566 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 13.3 mmt -135.79 167.28 21.46 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.121 -0.49 . . . . 0.82 110.633 -178.426 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.499 ' OD2' ' HA ' ' A' ' 62' ' ' PRO . 3.0 p-10 -151.49 -123.19 0.04 OUTLIER 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.044 -0.98 . . . . 1.42 108.788 -177.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -125.31 -17.77 5.55 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.082 0.467 . . . . 0.8 110.301 177.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.459 ' O ' ' HB2' ' A' ' 88' ' ' LYS . . . -88.65 -23.97 34.57 Favored Glycine 0 N--CA 1.44 -1.088 0 N-CA-C 110.304 -1.118 . . . . 0.32 110.304 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -76.89 -39.98 49.08 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.332 -0.434 . . . . 0.95 110.442 175.686 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.606 HG23 ' SG ' ' A' ' 101' ' ' CYS . 38.9 mt -59.8 -49.09 85.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.707 -0.679 . . . . 0.97 110.369 176.764 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.421 ' HG3' ' O ' ' A' ' 84' ' ' GLY . 0.2 OUTLIER -67.14 -28.94 68.55 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.367 -0.379 . . . . 1.15 110.682 179.138 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.459 ' HB2' ' O ' ' A' ' 84' ' ' GLY . 11.1 tttt -64.89 -41.73 95.38 Favored 'General case' 0 N--CA 1.457 -0.089 0 CA-C-O 121.049 0.452 . . . . 2.46 110.691 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 10.0 mtp180 -75.25 -32.35 61.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.012 -0.54 . . . . 1.16 110.68 178.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 8.1 mt -63.52 -53.17 56.09 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.863 -0.608 . . . . 0.49 111.167 178.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -66.79 -30.38 70.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.079 -0.51 . . . . 1.39 111.211 -176.158 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 12.4 m-80 -84.15 0.0 50.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.151 -0.477 . . . . 1.3 111.184 -177.102 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 60.52 50.97 5.42 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.705 0.628 . . . . 1.75 111.393 178.86 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' TYR . . . . . 0.473 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 61.3 t80 -82.87 -33.59 26.99 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.082 -0.508 . . . . 0.96 111.193 179.279 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.689 ' CD1' ' HB3' ' A' ' 100' ' ' GLU . 41.0 m-85 -90.78 169.45 10.94 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 121.541 0.686 . . . . 1.28 111.607 -176.148 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' TRP . . . . . 0.448 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 2.0 t90 -88.3 -44.7 10.62 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 114.526 -1.215 . . . . 1.05 109.2 169.314 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.432 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 35.3 t -152.12 177.18 10.77 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.139 -0.937 . . . . 1.0 110.224 -172.477 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -69.29 -18.05 63.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.928 0.394 . . . . 0.66 111.284 -177.461 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.57 -18.44 64.87 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.075 -0.511 . . . . 0.85 110.874 178.332 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.689 ' HB3' ' CD1' ' A' ' 95' ' ' TYR . 1.5 mt-10 -86.32 -39.95 15.96 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 109.435 -0.58 . . . . 2.44 109.435 177.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.606 ' SG ' HG23 ' A' ' 86' ' ' ILE . 0.1 OUTLIER -68.58 -30.84 69.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.432 -0.804 . . . . 0.95 110.758 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 9.6 ttm -56.78 -33.43 66.63 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.031 -0.532 . . . . 1.13 110.595 177.588 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -66.28 -41.35 89.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.847 -0.615 . . . . 2.96 110.539 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -76.51 -38.91 54.44 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.089 -0.505 . . . . 1.87 110.494 -178.578 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.629 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -59.7 -47.0 87.36 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.159 -0.473 . . . . 0.38 110.194 177.06 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -57.53 -47.1 82.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.852 -0.613 . . . . 0.97 109.823 175.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 89.1 m -59.95 -50.15 74.88 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.657 -0.701 . . . . 0.43 111.077 179.231 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.03 -41.69 68.33 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 122.594 0.357 . . . . 0.88 111.496 -178.532 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -70.31 -47.5 60.84 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.0 0.429 . . . . 0.29 110.043 -177.383 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 38.1 p -66.63 -30.52 70.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.883 -0.599 . . . . 0.66 111.144 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 23.3 m-20 -54.9 -45.54 74.72 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-O 121.188 0.518 . . . . 1.84 110.127 178.204 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 18.6 t -61.76 -41.5 97.76 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.252 -0.885 . . . . 0.63 110.808 179.056 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' TYR . . . . . 0.492 ' HD1' HG22 ' A' ' 123' ' ' VAL . 22.8 m-85 -71.16 -22.96 61.98 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.168 -0.469 . . . . 0.81 111.531 -176.633 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 51.7 mt -93.15 -52.3 10.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.968 0.413 . . . . 0.55 111.609 -179.01 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -66.31 -35.31 80.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.685 -0.689 . . . . 1.22 111.474 -173.698 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -106.49 -174.41 2.53 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.119 -0.491 . . . . 1.04 110.73 -176.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.45 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 0.0 OUTLIER -80.93 145.73 57.83 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 116.585 -0.28 . . . . 3.47 110.257 178.978 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -64.29 -9.08 18.55 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.671 2.248 . . . . 0.96 112.628 179.394 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.35 26.68 7.28 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.037 -0.528 . . . . 1.23 110.369 177.154 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 0.4 OUTLIER -84.18 171.35 12.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.499 . . . . 1.34 111.197 -177.518 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -65.03 -53.05 51.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.745 -0.661 . . . . 1.44 110.607 -177.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 3.1 tp -63.97 -29.61 47.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.629 -0.714 . . . . 0.42 111.104 -178.018 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.492 HG22 ' HD1' ' A' ' 113' ' ' TYR . 2.0 t -70.35 -43.62 78.19 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-O 121.085 0.469 . . . . 0.35 110.02 177.104 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.32 -37.29 74.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.508 -0.769 . . . . 0.52 109.55 177.315 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' MET . . . . . 0.495 ' O ' HD13 ' A' ' 129' ' ' LEU . 33.1 mtt -70.54 -45.68 65.05 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.179 -0.919 . . . . 0.62 110.825 178.485 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.84 -34.91 63.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 0.31 111.973 -178.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.39 -47.06 85.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.69 -0.232 . . . . 1.94 111.054 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -70.81 -39.27 73.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.061 0.457 . . . . 0.32 110.606 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.495 HD13 ' O ' ' A' ' 125' ' ' MET . 4.7 mp -56.9 -41.37 77.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.431 -0.804 . . . . 0.33 110.491 177.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -59.82 -30.34 68.86 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.281 -0.872 . . . . 1.47 112.355 -178.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.517 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 9.3 mmtp -63.25 -49.1 75.45 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 120.629 0.252 . . . . 2.24 110.605 -171.26 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -72.49 -24.57 21.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.359 -0.382 . . . . 1.23 110.86 -179.53 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.463 ' O ' HG23 ' A' ' 137' ' ' VAL . 26.4 t80 -63.16 -62.58 1.6 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.247 -0.433 . . . . 0.46 110.564 178.165 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.59 -22.75 62.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.888 0.375 . . . . 0.64 110.689 -175.73 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.517 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -65.03 -51.16 63.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.849 -0.614 . . . . 1.61 110.447 179.798 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 136' ' ' LYS . . . . . 0.422 ' HD3' HG12 ' A' ' 45' ' ' VAL . 40.8 mttt -80.8 -15.31 56.74 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.058 -0.519 . . . . 1.52 111.146 -175.816 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 133' ' ' PHE . 38.8 t -80.49 -35.22 15.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.227 -0.442 . . . . 0.35 110.083 177.762 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -69.51 -11.17 60.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.215 0.531 . . . . 0.5 110.793 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -97.48 -8.63 28.81 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.84 -0.618 . . . . 1.76 110.616 179.06 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -71.71 139.66 83.51 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 116.094 -0.503 . . . . 0.86 111.018 -177.465 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -72.0 98.43 0.9 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.653 2.235 . . . . 0.67 111.969 177.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.66 -8.45 56.04 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.014 0.435 . . . . 2.91 110.604 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -66.81 -35.46 80.11 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.082 -0.71 . . . . 2.7 109.082 174.084 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.512 ' CD ' ' HB2' ' A' ' 38' ' ' GLN . 0.0 OUTLIER 74.72 143.17 0.07 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 114.037 -1.438 . . . . 2.34 112.651 174.31 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 145' ' ' VAL . . . . . 0.439 ' O ' ' HB3' ' A' ' 37' ' ' ASN . 2.9 t -140.62 104.16 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-N 114.321 -1.309 . . . . 0.99 108.86 176.025 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.542 ' HG3' HG22 ' A' ' 36' ' ' THR . 16.8 tt0 -72.29 141.32 48.88 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.877 -0.416 . . . . 1.53 109.877 178.805 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 34.8 mt . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.495 -0.764 . . . . 1.57 109.829 -178.543 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.658 0 N-CA-C 111.759 -0.536 . . . . 2.17 111.759 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 104.71 -68.79 0.26 Allowed Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.927 -0.654 . . . . 1.97 111.708 -177.515 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -114.54 115.02 26.54 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.252 -0.647 . . . . 3.58 109.252 -179.429 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 315' ' ' ALY . . . . . 0.637 HH32 HD11 ' A' ' 68' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.729 0 CA-C-O 118.73 -0.652 . . . . 4.6 109.861 179.051 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_endo . . . . . 0 N--CA 1.48 0.707 0 N-CA-C 110.255 -0.709 . . . . 6.18 110.255 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -104.08 152.5 22.01 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.788 -0.449 . . . . 5.71 109.788 178.007 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.45 -83.37 0.88 Allowed Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.852 -0.69 . . . . 3.45 112.122 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 78.5 p -86.45 133.84 33.73 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.742 0.306 . . . . 2.44 111.401 -177.404 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.648 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 6.0 mt-10 -65.89 132.04 47.7 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.882 -0.599 . . . . 1.64 111.836 177.323 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -113.04 -12.46 11.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.512 -0.767 . . . . 0.93 110.218 176.521 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.2 m -156.21 138.92 15.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.502 -0.772 . . . . 1.61 109.204 178.758 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.493 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 19.6 t-20 -144.5 138.01 14.27 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-O 120.696 0.284 . . . . 1.6 110.412 178.694 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -69.94 -48.25 0.72 Allowed 'Trans proline' 0 CA--C 1.531 0.366 0 C-N-CA 123.138 2.559 . . . . 1.87 113.287 177.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.513 ' O ' ' HD3' ' A' ' 32' ' ' PRO . 28.2 t -77.1 -33.07 57.01 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.952 0.406 . . . . 2.18 110.729 -175.368 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.493 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 0.6 OUTLIER -92.01 104.22 10.11 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.82 -0.627 . . . . 2.75 109.85 177.981 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.513 ' HD3' ' O ' ' A' ' 30' ' ' SER . 16.2 Cg_exo -68.64 154.13 72.05 Favored 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 122.69 2.26 . . . . 1.38 112.845 -177.583 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -131.27 121.85 3.29 Favored Glycine 0 N--CA 1.441 -0.973 0 N-CA-C 110.291 -1.124 . . . . 0.97 110.291 178.607 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.479 ' HG3' ' CE2' ' A' ' 96' ' ' TRP . 1.5 mmm180 -131.47 171.91 12.83 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.895 0.379 . . . . 1.93 110.576 -174.289 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.485 ' HA ' HD22 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -108.94 103.32 12.34 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.105 -0.498 . . . . 2.64 110.134 179.341 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.687 HG22 ' HG3' ' A' ' 146' ' ' GLU . 23.9 p -109.05 170.18 8.21 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.182 -0.463 . . . . 0.68 111.066 178.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.444 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 55.6 t30 -62.67 -49.78 73.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.964 -0.562 . . . . 1.47 110.8 -179.576 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.8 tt0 -61.6 -37.43 83.88 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 120.689 0.281 . . . . 1.04 110.781 -179.116 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.779 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.6 OUTLIER -61.2 -59.2 5.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.932 -0.576 . . . . 0.8 110.884 -179.954 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -67.37 -29.44 68.97 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 116.081 -0.509 . . . . 1.75 110.742 -178.467 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.444 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 44.7 t80 -60.63 -63.39 1.32 Allowed 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.796 -0.638 . . . . 0.64 110.872 177.06 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.493 ' O ' HG12 ' A' ' 47' ' ' VAL . 23.6 ttp -61.04 -28.62 69.19 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.851 0.358 . . . . 1.13 110.358 -173.217 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.536 ' HB2' HD22 ' A' ' 90' ' ' LEU . 12.4 tt0 -61.41 -58.48 8.02 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.54 -0.755 . . . . 1.3 111.273 177.159 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -86.01 -26.59 25.33 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.364 -0.38 . . . . 0.5 111.777 -175.11 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.685 HG12 ' HG2' ' A' ' 136' ' ' LYS . 93.6 t -89.37 -57.84 3.94 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 N-CA-C 112.382 0.512 . . . . 0.3 112.382 -176.68 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.794 HG22 ' HB3' ' A' ' 136' ' ' LYS . 67.9 t -81.82 -66.59 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 112.016 0.376 . . . . 0.26 112.016 -170.385 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.493 HG12 ' O ' ' A' ' 42' ' ' MET . 0.9 OUTLIER -66.43 -34.21 68.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 120.477 -0.489 . . . . 0.83 111.298 -174.016 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.461 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -59.53 -38.04 79.95 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 121.012 -0.275 . . . . 2.4 111.437 178.456 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.7 m -74.6 -35.83 62.97 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.865 -0.334 . . . . 0.55 110.711 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.62 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -67.26 -33.86 76.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.266 0.555 . . . . 0.33 109.574 176.767 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 18.2 t-105 -65.06 -31.18 72.27 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.472 -0.786 . . . . 0.39 110.877 177.195 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.461 ' HG3' ' O ' ' A' ' 48' ' ' LYS . 13.6 mtpp -83.65 14.87 3.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.888 0.375 . . . . 2.24 111.646 -176.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.432 ' CD2' HD11 ' A' ' 132' ' ' ILE . 4.6 t-80 -98.82 128.43 45.03 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.095 -0.705 . . . . 0.39 109.095 173.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.415 ' NE2' ' HA ' ' A' ' 54' ' ' GLN . 0.0 OUTLIER -85.57 9.74 15.15 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.698 -0.401 . . . . 1.91 111.797 -173.991 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -103.35 -6.95 21.43 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.26 -0.644 . . . . 0.93 109.26 170.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.517 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -94.64 14.99 19.29 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.43 -0.804 . . . . 0.28 110.11 177.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.567 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 48.9 p-90 -66.92 -34.54 7.57 Favored Pre-proline 0 CA--C 1.544 0.74 0 N-CA-C 113.467 0.914 . . . . 0.58 113.467 -175.658 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.567 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 7.6 Cg_exo -73.79 -2.67 12.55 Favored 'Trans proline' 0 C--N 1.364 1.357 0 CA-C-N 121.108 1.431 . . . . 0.47 111.512 177.379 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.439 ' HB3' ' HB2' ' A' ' 83' ' ' MET . 1.9 m-85 -105.64 0.16 26.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.824 -0.626 . . . . 1.11 110.462 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 6.2 m-30 -66.47 -40.47 89.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.331 0.586 . . . . 0.63 110.88 -178.621 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.64 129.48 28.76 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-N 115.467 -0.788 . . . . 1.63 110.179 -176.587 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.572 ' HA ' ' OD2' ' A' ' 82' ' ' ASP . 19.5 Cg_endo -59.95 147.12 94.03 Favored 'Trans proline' 0 C--O 1.238 0.512 0 C-N-CA 122.964 2.443 . . . . 0.87 113.475 -176.233 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.411 ' O ' HG12 ' A' ' 63' ' ' VAL . 2.5 t -86.84 98.88 7.56 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 N-CA-C 108.408 -0.96 . . . . 0.88 108.408 177.674 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -109.78 12.12 24.14 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 114.812 -1.085 . . . . 1.85 110.896 -174.328 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 77.93 -17.55 0.56 Allowed 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 114.721 -1.127 . . . . 1.29 112.526 177.079 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.6 mt -109.29 -49.11 7.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 120.811 0.339 . . . . 1.89 110.762 -177.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.6 ttmm -56.96 -43.38 81.53 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.96 -0.563 . . . . 2.99 110.95 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.585 ' HB3' HD22 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -95.2 0.99 54.56 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.038 -0.528 . . . . 1.66 111.086 179.043 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 53.16 60.43 3.76 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 109.106 -0.701 . . . . 1.74 109.106 -174.099 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.585 HD22 ' HB3' ' A' ' 68' ' ' LEU . 0.4 OUTLIER -128.6 66.07 73.52 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 115.497 -0.774 . . . . 1.61 111.662 -170.124 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -77.49 -27.79 6.03 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.186 1.924 . . . . 1.3 111.828 177.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -76.83 -23.99 52.74 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.591 -0.731 . . . . 1.97 110.448 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.46 -43.59 93.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.452 -0.795 . . . . 1.13 110.468 178.254 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -77.66 6.31 7.56 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.254 -0.885 . . . . 0.91 111.195 -175.323 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -108.93 -57.98 2.08 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 120.869 0.366 . . . . 2.86 110.046 -179.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 26.9 mt -73.45 -42.7 56.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.835 -0.62 . . . . 1.0 110.852 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.487 HD11 ' HB2' ' A' ' 115' ' ' TYR . 27.1 mm -87.54 126.39 41.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.188 0.518 . . . . 0.75 110.004 -178.782 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.05 -53.99 45.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.515 -0.766 . . . . 1.99 110.879 -176.67 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.742 ' HB2' HG21 ' A' ' 107' ' ' THR . 0.3 OUTLIER -120.48 95.3 49.02 Favored Pre-proline 0 C--N 1.324 -0.539 0 N-CA-C 109.75 -0.463 . . . . 2.05 109.75 178.01 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -67.87 100.25 0.6 Allowed 'Trans proline' 0 CA--C 1.528 0.206 0 C-N-CA 122.19 1.926 . . . . 0.89 111.775 178.592 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.81 159.64 34.22 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.449 0.642 . . . . 0.82 111.428 -176.234 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.572 ' OD2' ' HA ' ' A' ' 62' ' ' PRO . 2.3 p-10 -136.99 -116.21 0.16 Allowed 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.383 -1.281 . . . . 1.42 108.649 -177.739 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' MET . . . . . 0.439 ' HB2' ' HB3' ' A' ' 59' ' ' PHE . 3.5 ttp -132.71 -19.51 2.34 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.795 0.331 . . . . 0.8 110.645 176.045 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -84.1 -29.13 31.97 Favored Glycine 0 N--CA 1.442 -0.905 0 N-CA-C 110.556 -1.018 . . . . 0.32 110.556 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.19 -39.01 68.93 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.925 0.393 . . . . 0.95 110.492 176.596 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.513 HG23 ' SG ' ' A' ' 101' ' ' CYS . 62.1 mt -59.76 -50.41 80.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.559 -0.746 . . . . 0.97 110.304 177.015 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.505 ' O ' ' HG2' ' A' ' 91' ' ' GLU . 0.0 OUTLIER -70.6 -21.9 62.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.337 -0.392 . . . . 1.15 111.37 -178.6 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.533 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 12.5 tppt? -65.09 -42.6 93.93 Favored 'General case' 0 CA--C 1.526 0.043 0 CA-C-O 120.714 0.292 . . . . 2.46 110.765 179.683 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.484 HH21 ' HE2' ' A' ' 94' ' ' TYR . 63.4 mtp180 -68.26 -32.33 72.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.96 0.409 . . . . 1.16 110.456 176.8 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.63 ' HG ' ' OH ' ' A' ' 95' ' ' TYR . 4.7 mt -69.13 -59.72 2.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.543 -0.753 . . . . 0.49 111.662 -177.195 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.505 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 16.6 pt-20 -73.95 -15.98 61.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.044 -0.526 . . . . 1.39 111.819 -173.031 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.533 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 0.9 OUTLIER -94.9 -3.39 48.79 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.997 -0.281 . . . . 1.3 110.363 176.962 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 52.3 57.43 6.46 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.653 -0.703 . . . . 1.75 111.186 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' TYR . . . . . 0.648 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 27.6 t80 -75.7 -48.91 19.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.322 -0.399 . . . . 0.96 110.888 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.63 ' OH ' ' HG ' ' A' ' 90' ' ' LEU . 0.1 OUTLIER -97.92 177.65 5.37 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.211 0.529 . . . . 1.28 111.212 -175.212 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 96' ' ' TRP . . . . . 0.479 ' CE2' ' HG3' ' A' ' 34' ' ' ARG . 1.9 t-105 -77.92 -48.03 17.28 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.277 -0.874 . . . . 1.05 110.761 -179.779 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 17.3 t -142.42 168.47 19.66 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.862 0.363 . . . . 1.0 110.892 -173.202 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.779 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -78.23 -11.71 59.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.033 -0.53 . . . . 0.66 111.613 -175.21 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.98 -27.39 66.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.002 0.43 . . . . 0.85 110.581 178.589 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.98 -36.19 59.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.073 -0.512 . . . . 2.44 110.245 177.537 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.513 ' SG ' HG23 ' A' ' 86' ' ' ILE . 0.5 OUTLIER -70.75 -19.81 62.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 0.95 110.897 179.678 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.582 ' HE1' HG22 ' A' ' 137' ' ' VAL . 11.3 mmt -55.95 -26.12 46.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.191 0.519 . . . . 1.13 110.144 173.747 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.16 -39.88 60.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.751 -0.659 . . . . 2.96 109.995 176.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.88 -53.98 51.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.817 -0.629 . . . . 1.87 110.345 178.548 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.62 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.6 OUTLIER -57.26 -47.7 80.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.497 -0.774 . . . . 0.38 110.605 -179.934 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -56.85 -44.01 81.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.787 -0.642 . . . . 0.97 110.256 177.133 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.742 HG21 ' HB2' ' A' ' 79' ' ' ASN . 90.5 m -64.3 -47.47 79.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.02 -0.537 . . . . 0.43 111.317 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.402 ' HG3' ' O ' ' A' ' 82' ' ' ASP . 0.3 OUTLIER -51.12 -44.4 61.34 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.734 0.302 . . . . 0.88 111.011 179.298 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -72.68 -47.55 46.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.02 -0.536 . . . . 0.29 110.953 -177.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.4 p -64.75 -37.5 87.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.46 -0.336 . . . . 0.66 110.91 -178.453 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ASN . . . . . 0.467 ' OD1' HG13 ' A' ' 77' ' ' ILE . 0.4 OUTLIER -54.33 -45.43 72.67 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.803 -0.635 . . . . 1.84 110.32 178.1 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 112' ' ' CYS . . . . . 0.588 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 1.2 m -60.93 -40.58 93.78 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.948 -0.569 . . . . 0.63 110.813 176.328 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -74.6 -19.7 60.21 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.265 -0.425 . . . . 0.81 111.094 -176.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 68.0 mt -93.42 -61.41 2.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.49 -0.323 . . . . 0.55 111.557 -179.376 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.487 ' HB2' HD11 ' A' ' 77' ' ' ILE . 43.2 t80 -68.89 -49.62 56.68 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.062 0.458 . . . . 1.22 110.446 -175.65 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ASN . . . . . 0.588 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 14.0 m120 -80.02 167.58 20.27 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.654 -0.703 . . . . 1.04 110.214 177.848 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.484 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 6.4 mttp -98.0 160.73 27.7 Favored Pre-proline 0 C--N 1.318 -0.769 0 N-CA-C 109.739 -0.467 . . . . 3.47 109.739 177.412 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' PRO . . . . . 0.691 ' HA ' HG11 ' A' ' 123' ' ' VAL . 18.9 Cg_endo -61.51 -13.63 30.56 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.474 2.116 . . . . 0.96 111.762 175.473 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.82 -4.11 44.39 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.251 -0.886 . . . . 1.23 111.284 178.873 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ASP . . . . . 0.618 ' OD2' ' HA2' ' B' ' 313' ' ' GLY . 1.9 m-20 -74.06 148.3 42.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.987 0.422 . . . . 1.34 110.471 -176.724 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.77 -43.56 98.6 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.612 -0.722 . . . . 1.44 111.105 -175.537 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ILE . . . . . 0.412 ' HB ' HH33 ' B' ' 312' ' ' ALY . 2.0 tp -66.4 -33.1 61.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.874 -0.603 . . . . 0.42 111.291 -178.359 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.691 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.1 t -66.09 -42.06 90.69 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.109 0.48 . . . . 0.35 109.792 178.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.81 -32.14 70.37 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.549 -0.75 . . . . 0.52 110.05 178.242 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' MET . . . . . 0.505 ' O ' HD13 ' A' ' 129' ' ' LEU . 11.2 mtt -79.24 -46.07 18.54 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.591 -0.731 . . . . 0.62 110.518 177.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -55.46 -41.69 73.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.361 -0.381 . . . . 0.31 111.711 -178.193 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.66 -31.79 73.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.801 0.334 . . . . 1.94 111.235 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -78.06 -38.88 43.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.094 0.473 . . . . 0.32 110.121 176.302 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.517 HD21 ' HA ' ' A' ' 56' ' ' ALA . 2.2 mp -59.47 -42.46 92.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.414 -0.812 . . . . 0.33 110.172 177.206 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -52.16 -29.36 21.79 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 114.953 -1.021 . . . . 1.47 112.867 -176.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.509 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.1 OUTLIER -60.64 -44.21 96.64 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 120.667 0.27 . . . . 2.24 110.757 -173.955 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.44 ' H ' HG13 ' A' ' 132' ' ' ILE . 0.4 OUTLIER -77.77 -23.61 14.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.159 -0.473 . . . . 1.23 111.105 -176.449 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.553 ' O ' HG23 ' A' ' 137' ' ' VAL . 34.1 t80 -65.92 -63.05 1.17 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.504 -0.316 . . . . 0.46 110.578 -179.597 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.446 ' H ' ' HG ' ' A' ' 134' ' ' LEU . 0.4 OUTLIER -68.97 -21.74 64.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.948 0.404 . . . . 0.64 110.657 -176.298 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.509 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -68.01 -45.47 73.94 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.697 -0.683 . . . . 1.61 110.185 178.089 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 136' ' ' LYS . . . . . 0.794 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -79.25 -28.51 42.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.042 -0.526 . . . . 1.52 111.082 -179.216 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.582 HG22 ' HE1' ' A' ' 102' ' ' MET . 54.2 t -65.08 -34.47 70.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.135 0.493 . . . . 0.35 110.573 178.019 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.79 -12.61 61.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.308 0.575 . . . . 0.5 110.509 177.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -105.02 0.37 27.59 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.765 -0.652 . . . . 1.76 110.343 179.013 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 140' ' ' MET . . . . . 0.472 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 11.3 mtp -75.74 141.73 72.57 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.955 -0.566 . . . . 0.86 110.924 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -73.44 92.43 0.85 Allowed 'Trans proline' 0 N--CA 1.462 -0.355 0 C-N-CA 122.324 2.016 . . . . 0.67 110.964 177.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -74.24 -1.65 21.5 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.042 -0.526 . . . . 2.91 111.648 -173.465 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -82.1 -39.37 23.45 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.65 -0.5 . . . . 2.7 109.65 175.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 72.93 134.23 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 114.504 -1.226 . . . . 2.34 111.697 178.051 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 34.4 t -142.49 112.24 2.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.299 -0.864 . . . . 0.99 109.14 179.123 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.687 ' HG3' HG22 ' A' ' 36' ' ' THR . 31.1 tt0 -63.13 138.51 58.57 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.719 -0.392 . . . . 1.53 110.396 179.463 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 96.5 mt . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.528 -0.749 . . . . 1.57 110.618 -174.03 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.519 0 N-CA-C 112.09 -0.404 . . . . 2.17 112.09 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 312' ' ' ALY . . . . . 0.46 ' HB3' HD11 ' A' ' 70' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 313' ' ' GLY . . . . . 0.618 ' HA2' ' OD2' ' A' ' 120' ' ' ASP . . . 113.7 -66.42 0.26 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.928 -0.653 . . . . 1.97 112.862 176.303 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 314' ' ' LYS . . . . . 0.422 ' HG3' ' H ' ' B' ' 314' ' ' LYS . 0.0 OUTLIER -111.59 149.22 31.76 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.81 0.338 . . . . 3.58 110.722 -175.43 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.924 0 CA-C-O 118.115 -0.945 . . . . 4.6 109.969 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo . . . . . 0 N--CA 1.479 0.646 0 N-CA-C 110.453 -0.634 . . . . 6.18 110.453 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.474 HD13 ' HA ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -131.09 97.88 4.42 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.687 -0.486 . . . . 5.71 109.687 178.797 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 91.22 72.16 1.23 Allowed Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.731 -0.747 . . . . 3.45 111.849 -179.055 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.5 p -57.98 129.6 42.67 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-O 120.957 0.408 . . . . 2.44 111.225 179.454 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.591 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 19.9 mt-10 -75.68 130.26 38.43 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.591 -0.731 . . . . 1.64 112.627 -175.391 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.4 p -117.81 -7.1 11.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.107 -0.951 . . . . 0.93 109.235 172.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.4 m -162.97 135.38 5.4 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 114.979 -1.01 . . . . 1.61 109.375 175.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.427 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 23.4 t-20 -126.94 125.86 24.3 Favored Pre-proline 0 C--N 1.321 -0.633 0 N-CA-C 109.742 -0.466 . . . . 1.6 109.742 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -66.06 -46.63 4.36 Favored 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 123.057 2.505 . . . . 1.87 113.017 -176.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.8 m -77.93 -22.02 50.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.987 0.422 . . . . 2.18 110.97 -176.119 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.427 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 4.6 ttmt -81.94 113.38 42.64 Favored Pre-proline 0 C--N 1.325 -0.484 0 N-CA-C 109.172 -0.677 . . . . 2.75 109.172 173.783 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.457 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 12.6 Cg_exo -65.34 147.17 87.28 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 121.778 1.652 . . . . 1.38 111.767 -179.234 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -127.81 130.27 6.66 Favored Glycine 0 N--CA 1.442 -0.913 0 CA-C-N 115.417 -0.811 . . . . 0.97 111.197 -176.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 34' ' ' ARG . 1.1 ttp180 -140.3 -179.96 6.3 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 120.975 0.417 . . . . 1.93 110.167 -178.4 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.3 106.06 10.76 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.835 -0.62 . . . . 2.64 109.602 177.565 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.524 HG22 ' HG3' ' A' ' 146' ' ' GLU . 1.3 p -109.14 166.68 10.67 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 120.711 -0.396 . . . . 0.68 110.281 175.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.667 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 0.2 OUTLIER -66.83 -26.56 66.98 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.859 -0.609 . . . . 1.47 110.661 -178.211 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -75.38 -39.29 59.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.817 0.341 . . . . 1.04 110.3 177.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.52 -53.45 56.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.924 -0.58 . . . . 0.8 110.555 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.9 mm100 -70.85 -24.11 62.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.825 -0.625 . . . . 1.75 110.682 -178.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.667 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 35.7 t80 -61.14 -64.11 1.06 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 116.169 -0.468 . . . . 0.64 110.905 177.569 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.511 ' O ' HG12 ' A' ' 47' ' ' VAL . 2.2 ttm -60.28 -31.71 70.5 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.813 -0.355 . . . . 1.13 110.506 -174.093 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -59.07 -57.27 13.81 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.734 -0.666 . . . . 1.3 110.997 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -86.28 -29.53 22.99 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.104 0.409 . . . . 0.5 112.104 -176.211 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 99.3 t -88.31 -57.82 3.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 112.161 0.43 . . . . 0.3 112.161 -175.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.653 HG22 ' HB3' ' A' ' 136' ' ' LYS . 60.2 t -82.14 -66.8 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 112.11 0.411 . . . . 0.26 112.11 -169.691 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.511 HG12 ' O ' ' A' ' 42' ' ' MET . 1.5 p -68.91 -32.9 56.49 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.326 0 C-N-CA 120.711 -0.395 . . . . 0.83 111.411 -174.099 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.11 -26.1 68.1 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 122.092 -0.38 . . . . 2.4 111.084 177.178 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 35.2 m -85.65 -38.1 18.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.77 0.319 . . . . 0.55 110.503 177.179 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.66 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -66.48 -39.94 89.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.039 0.447 . . . . 0.33 110.211 177.687 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 29.2 t-105 -60.37 -35.52 75.91 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.47 -0.787 . . . . 0.39 111.662 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.59 -4.1 52.83 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.064 0.394 . . . . 2.24 112.064 -174.036 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.589 ' ND1' ' HB2' ' A' ' 55' ' ' PHE . 10.0 t-80 -75.56 128.71 35.88 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.265 -0.643 . . . . 0.39 109.265 176.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -81.08 7.13 11.66 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.83 0.348 . . . . 1.91 111.46 -174.318 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.589 ' HB2' ' ND1' ' A' ' 53' ' ' HIS . 2.3 m-30 -103.36 -8.51 20.19 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.514 -0.55 . . . . 0.93 109.514 172.361 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.616 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -91.18 9.98 28.93 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.786 -0.643 . . . . 0.28 110.641 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.495 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 57.8 p-90 -61.9 -35.38 21.22 Favored Pre-proline 0 CA--C 1.547 0.842 0 N-CA-C 113.916 1.08 . . . . 0.58 113.916 -175.21 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.495 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 3.0 Cg_exo -76.98 -10.78 18.08 Favored 'Trans proline' 0 C--N 1.364 1.358 0 CA-C-N 121.016 1.399 . . . . 0.47 111.733 178.716 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -101.6 10.84 39.84 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.702 -0.681 . . . . 1.11 110.431 -177.028 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 2.9 m-30 -73.23 -31.67 64.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.794 -0.639 . . . . 0.63 111.001 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -114.59 144.7 32.35 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 115.77 -0.65 . . . . 1.63 110.564 -173.634 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.549 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 33.3 Cg_endo -66.35 151.46 83.24 Favored 'Trans proline' 0 C--O 1.237 0.474 0 C-N-CA 122.885 2.39 . . . . 0.87 112.905 -178.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.467 ' O ' HG12 ' A' ' 63' ' ' VAL . 1.4 t -70.42 101.79 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 CA-C-O 122.258 1.028 . . . . 0.88 109.253 173.707 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -96.16 6.1 49.57 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.336 -1.302 . . . . 1.85 108.993 176.486 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 69.4 -71.68 0.12 Allowed 'General case' 0 C--O 1.226 -0.137 0 CA-C-N 114.525 -1.216 . . . . 1.29 110.555 -175.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 5.7 mt -65.0 -39.68 86.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 116.372 -0.376 . . . . 1.89 111.09 -176.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.41 -24.25 65.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.034 -0.53 . . . . 2.99 111.766 -179.593 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.488 HD13 ' HA ' ' A' ' 68' ' ' LEU . 0.2 OUTLIER -117.06 5.74 12.83 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.636 0.255 . . . . 1.66 111.513 -178.662 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 65.24 35.37 7.76 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.826 -0.624 . . . . 1.74 111.576 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.702 HD21 ' HG2' ' B' ' 312' ' ' ALY . 2.6 mt -120.19 74.03 21.01 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 115.86 -0.609 . . . . 1.61 110.303 177.242 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.19 -29.85 25.88 Favored 'Trans proline' 0 C--O 1.233 0.25 0 C-N-CA 122.413 2.075 . . . . 1.3 113.216 -173.536 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -101.74 13.37 35.06 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.263 0.554 . . . . 1.97 111.057 -177.142 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.401 ' CD2' HG11 ' A' ' 63' ' ' VAL . 13.9 t80 -57.52 -41.25 80.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.68 -0.691 . . . . 1.13 110.442 177.323 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 18.7 m-70 -76.2 3.42 10.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.738 -0.665 . . . . 0.91 111.744 -176.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.0 mmpt? -97.28 -38.32 9.72 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.05 0.452 . . . . 2.86 109.972 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.9 mt -94.81 -47.7 13.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.962 -0.563 . . . . 1.0 110.037 177.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 41.9 mm -91.66 102.42 13.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.822 -0.626 . . . . 0.75 109.469 179.058 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.1 mtmt -72.35 -29.15 63.53 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.375 -0.83 . . . . 1.99 111.308 -174.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -116.22 80.17 9.36 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 115.719 -0.673 . . . . 2.05 110.315 178.109 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -69.16 97.69 0.6 Allowed 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.9 2.4 . . . . 0.89 111.865 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.6 mmt -133.36 155.02 50.21 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-O 121.363 0.601 . . . . 0.82 110.673 -177.298 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.549 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 5.0 p-10 -134.98 -129.85 0.16 Allowed 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 114.411 -1.268 . . . . 1.42 109.078 -172.029 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.25 -14.54 4.82 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.299 0.571 . . . . 0.8 110.266 178.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -90.62 -32.03 9.71 Favored Glycine 0 N--CA 1.441 -1.021 0 N-CA-C 109.921 -1.271 . . . . 0.32 109.921 -178.26 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.471 ' OG1' ' HB3' ' A' ' 62' ' ' PRO . 98.0 m -67.79 -37.32 81.88 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.004 -0.598 . . . . 0.95 110.5 173.792 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 54.9 mt -63.22 -50.87 77.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.984 -0.553 . . . . 0.97 109.976 176.137 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.542 ' O ' ' HG2' ' A' ' 91' ' ' GLU . 0.0 OUTLIER -65.47 -29.9 70.62 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.691 -0.686 . . . . 1.15 110.9 -179.737 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 30.6 tttt -66.79 -37.82 85.31 Favored 'General case' 0 C--N 1.337 0.053 0 CA-C-O 120.986 0.422 . . . . 2.46 110.687 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.403 HH12 ' CG ' ' A' ' 104' ' ' ASP . 29.5 mtp180 -74.56 -29.97 61.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.072 -0.513 . . . . 1.16 110.594 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.566 ' HG ' ' OH ' ' A' ' 95' ' ' TYR . 2.8 mt -70.09 -57.54 4.85 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.791 -0.64 . . . . 0.49 111.084 179.031 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.542 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 9.0 pt-20 -72.25 -7.23 48.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.888 -0.596 . . . . 1.39 112.081 -173.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -106.58 -4.22 19.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.412 0.148 . . . . 1.3 111.168 178.206 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 57.69 63.8 1.72 Allowed 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.337 0.589 . . . . 1.75 110.854 -177.645 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' TYR . . . . . 0.591 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 18.1 t80 -78.23 -26.4 47.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.603 -0.726 . . . . 0.96 111.404 -179.066 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.627 ' HE2' ' HG ' ' A' ' 101' ' ' CYS . 0.1 OUTLIER -135.62 179.19 6.49 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.056 -0.52 . . . . 1.28 111.202 -172.21 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 96' ' ' TRP . . . . . 0.457 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 1.8 t-105 -66.55 -47.5 72.65 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.451 -0.795 . . . . 1.05 110.742 178.272 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 26.9 t -150.35 167.06 28.15 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.996 -0.547 . . . . 1.0 110.888 -174.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -76.1 -4.69 42.89 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.762 -0.653 . . . . 0.66 111.682 -175.027 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.36 -32.08 70.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.05 0.452 . . . . 0.85 110.476 178.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -66.42 -43.25 86.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.755 -0.657 . . . . 2.44 110.011 177.478 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.627 ' HG ' ' HE2' ' A' ' 95' ' ' TYR . 0.0 OUTLIER -75.73 -20.28 58.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.925 -0.579 . . . . 0.95 111.381 -177.226 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -55.55 -29.17 58.5 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.199 0.523 . . . . 1.13 109.989 174.554 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -73.55 -41.18 63.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.679 -0.691 . . . . 2.96 110.281 175.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ASP . . . . . 0.452 ' OD1' ' HA ' ' A' ' 101' ' ' CYS . 8.9 m-20 -68.04 -38.9 83.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.029 -0.532 . . . . 1.87 110.453 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.66 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -59.21 -46.88 87.28 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.871 -0.604 . . . . 0.38 110.466 177.938 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -62.55 -42.69 99.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.884 -0.598 . . . . 0.97 109.977 177.165 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 94.7 m -63.27 -40.21 96.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.487 -0.779 . . . . 0.43 111.687 -179.144 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.75 -42.68 62.51 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.057 0.456 . . . . 0.88 110.902 177.026 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -71.1 -40.33 71.57 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.93 -0.577 . . . . 0.29 110.988 -178.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -41.56 75.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.604 -0.271 . . . . 0.66 111.115 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -48.16 -53.26 17.42 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.619 -0.718 . . . . 1.84 111.062 178.66 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.62 -34.41 77.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.695 -0.684 . . . . 0.63 111.011 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' TYR . . . . . 0.561 ' HD1' HG22 ' A' ' 123' ' ' VAL . 18.5 m-30 -77.22 -17.77 58.21 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.457 -0.338 . . . . 0.81 111.663 -177.374 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 67.5 mt -92.72 -53.63 8.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 120.668 0.27 . . . . 0.55 111.305 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -68.59 -37.75 80.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.322 -0.399 . . . . 1.22 110.53 -176.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -108.7 140.94 41.4 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.082 -0.508 . . . . 1.04 109.654 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.33 146.18 97.77 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 116.434 -0.348 . . . . 3.47 110.507 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' PRO . . . . . 0.822 ' HA ' HG11 ' A' ' 123' ' ' VAL . 37.0 Cg_exo -58.93 -12.12 14.25 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.215 2.61 . . . . 0.96 113.511 -177.532 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.93 -7.59 59.39 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.432 -0.349 . . . . 1.23 111.655 178.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ASP . . . . . 0.457 ' OD2' ' HA2' ' B' ' 313' ' ' GLY . 2.0 t70 -81.88 171.03 14.96 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.506 0.669 . . . . 1.34 112.043 -174.209 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ASP . . . . . 0.442 ' HB2' ' HA ' ' B' ' 314' ' ' LYS . 12.0 t0 -76.5 -41.58 46.44 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.497 -1.229 . . . . 1.44 110.791 -174.232 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ILE . . . . . 0.634 ' HA ' ' SD ' ' A' ' 125' ' ' MET . 2.6 tp -62.15 -35.55 69.47 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.11 0 CA-C-O 120.974 0.416 . . . . 0.42 110.043 179.313 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.822 HG11 ' HA ' ' A' ' 118' ' ' PRO . 12.5 t -69.74 -49.32 58.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.118 -0.492 . . . . 0.35 110.04 177.201 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.9 -40.09 72.52 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.305 -0.862 . . . . 0.52 110.892 -177.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' MET . . . . . 0.634 ' SD ' ' HA ' ' A' ' 122' ' ' ILE . 0.1 OUTLIER -75.58 -38.7 58.93 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.163 -0.472 . . . . 0.62 111.21 179.742 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 126' ' ' ALA . . . . . 0.42 ' N ' ' HG2' ' A' ' 125' ' ' MET . . . -60.15 -28.82 68.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.394 -0.366 . . . . 0.31 111.099 177.305 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.88 -38.52 91.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.26 -0.427 . . . . 1.94 110.815 177.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -73.59 -37.63 65.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.094 -0.503 . . . . 0.32 110.151 177.339 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.616 HD21 ' HA ' ' A' ' 56' ' ' ALA . 7.1 mp -58.25 -44.75 88.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.532 -0.758 . . . . 0.33 110.213 177.011 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -59.54 -30.56 68.7 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.081 -0.963 . . . . 1.47 111.842 -176.021 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.477 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -65.38 -46.58 79.54 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.576 -0.284 . . . . 2.24 110.467 -175.023 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.49 HD12 HD23 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -74.0 -21.73 18.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.537 -0.301 . . . . 1.23 110.746 179.828 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.514 ' O ' HG23 ' A' ' 137' ' ' VAL . 30.0 t80 -65.12 -62.23 1.67 Allowed 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.334 -0.394 . . . . 0.46 110.299 177.037 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.5 pp -66.59 -26.96 67.35 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.035 0.445 . . . . 0.64 110.341 -177.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.477 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -57.93 -48.22 80.55 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.446 -0.797 . . . . 1.61 111.046 178.708 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 136' ' ' LYS . . . . . 0.653 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -82.81 -24.41 33.38 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.14 -0.482 . . . . 1.52 110.948 -177.873 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 133' ' ' PHE . 59.2 t -70.97 -32.04 47.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.086 0.47 . . . . 0.35 110.362 178.273 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -69.53 -10.49 58.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.064 0.459 . . . . 0.5 110.471 177.269 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -103.34 -3.55 25.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.946 -0.57 . . . . 1.76 110.926 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' MET . . . . . 0.492 ' HG3' ' HA ' ' A' ' 137' ' ' VAL . 0.7 OUTLIER -67.91 143.9 96.76 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.094 -0.503 . . . . 0.86 111.337 -177.883 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -70.77 110.79 2.85 Favored 'Trans proline' 0 N--CA 1.462 -0.356 0 C-N-CA 122.52 2.147 . . . . 0.67 111.675 177.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.05 5.79 7.51 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.913 -0.585 . . . . 2.91 111.917 -175.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.413 ' O ' ' HB3' ' A' ' 144' ' ' GLU . 18.3 mt-10 -103.17 -41.18 6.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.436 -0.347 . . . . 2.7 111.244 -177.673 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.413 ' HB3' ' O ' ' A' ' 143' ' ' GLU . 2.7 tt0 70.95 101.57 0.06 Allowed 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.991 0.807 . . . . 2.34 110.866 -177.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 2.6 t -108.52 133.96 51.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.135 -0.691 . . . . 0.99 109.135 176.096 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.524 ' HG3' HG22 ' A' ' 36' ' ' THR . 1.2 tt0 -80.63 148.18 30.37 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.004 0.43 . . . . 1.53 111.13 -176.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 22.0 mt . . . . . 0 C--O 1.247 0.955 0 CA-C-O 118.896 -0.573 . . . . 1.57 110.142 178.134 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.663 0 N-CA-C 111.57 -0.612 . . . . 2.17 111.57 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 312' ' ' ALY . . . . . 0.702 ' HG2' HD21 ' A' ' 70' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 313' ' ' GLY . . . . . 0.59 ' O ' ' HB2' ' B' ' 314' ' ' LYS . . . 141.66 76.6 0.04 OUTLIER Glycine 0 N--CA 1.443 -0.861 0 N-CA-C 110.482 -1.047 . . . . 1.97 110.482 -175.765 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 314' ' ' LYS . . . . . 0.59 ' HB2' ' O ' ' B' ' 313' ' ' GLY . 11.8 mtmt 79.37 99.87 0.06 Allowed 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.442 0.697 . . . . 3.58 109.465 -174.524 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 315' ' ' ALY . . . . . 0.406 ' HD3' ' HB ' ' A' ' 122' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 52.7 mttt . . . . . 0 C--O 1.248 0.994 0 CA-C-N 115.541 -0.754 . . . . 4.6 109.796 179.008 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.455 ' HD2' ' OD1' ' A' ' 79' ' ' ASN . 8.2 Cg_endo . . . . . 0 N--CA 1.48 0.719 0 N-CA-C 110.384 -0.66 . . . . 6.18 110.384 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 33.0 tp -95.29 111.68 23.5 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.894 -0.41 . . . . 5.71 109.894 176.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.23 81.9 1.2 Allowed Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.59 -0.814 . . . . 3.45 111.152 -176.239 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 61.1 p -90.64 142.3 27.9 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 122.105 0.162 . . . . 2.44 111.056 -178.049 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.627 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 7.4 mt-10 -52.12 125.08 14.56 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 123.595 0.56 . . . . 1.64 111.812 175.856 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 7.2 p -106.71 -18.09 7.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 115.773 -0.649 . . . . 0.93 109.847 175.257 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -158.95 137.08 10.55 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.123 -0.944 . . . . 1.61 110.001 176.26 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.469 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 23.8 t-20 -136.8 122.92 13.47 Favored Pre-proline 0 C--N 1.32 -0.69 0 N-CA-C 109.357 -0.608 . . . . 1.6 109.357 173.741 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -60.4 -46.31 18.5 Favored 'Trans proline' 0 N--CA 1.474 0.338 0 C-N-CA 123.249 2.633 . . . . 1.87 113.008 -175.456 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.3 m -78.97 -30.04 44.25 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 116.037 -0.529 . . . . 2.18 110.957 -175.201 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.469 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 24.4 tttp -67.41 134.03 93.04 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.564 -0.744 . . . . 2.75 111.419 -177.378 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_exo -49.18 141.11 24.2 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 123.182 2.588 . . . . 1.38 112.993 173.366 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -158.91 117.07 0.75 Allowed Glycine 0 N--CA 1.443 -0.84 0 N-CA-C 110.218 -1.153 . . . . 0.97 110.218 177.282 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.434 ' HE ' ' CD ' ' A' ' 146' ' ' GLU . 7.2 mmm180 -131.55 158.82 39.94 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.013 0.435 . . . . 1.93 110.935 -175.377 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.518 ' HA ' HD22 ' A' ' 39' ' ' LEU . 1.5 mtpp -103.6 84.52 2.3 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.981 -0.554 . . . . 2.64 109.598 176.613 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.643 HG22 ' HG3' ' A' ' 146' ' ' GLU . 1.6 p -87.17 168.56 13.13 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.244 -0.434 . . . . 0.68 110.515 -179.285 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -59.12 -50.98 71.97 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-N 116.489 -0.323 . . . . 1.47 110.749 -178.434 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.512 ' HB2' ' OE2' ' A' ' 144' ' ' GLU . 1.7 mt-30 -59.21 -39.83 83.92 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.711 0.291 . . . . 1.04 111.222 -179.006 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.653 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.8 OUTLIER -61.66 -55.17 33.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.109 -0.496 . . . . 0.8 110.72 -179.638 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 18.2 mm100 -68.53 -30.47 69.29 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.872 -0.603 . . . . 1.75 110.862 -179.338 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -61.6 -63.36 1.3 Allowed 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.825 -0.625 . . . . 0.64 110.488 176.556 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.581 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -58.44 -33.62 69.9 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 110.175 -0.306 . . . . 1.13 110.175 -175.418 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -56.98 -56.62 19.34 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.569 -0.741 . . . . 1.3 111.121 178.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 61.3 m-80 -86.66 -28.16 23.34 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.285 -0.416 . . . . 0.5 112.039 -176.447 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 94.5 t -89.61 -56.89 4.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 N-CA-C 112.243 0.46 . . . . 0.3 112.243 -176.037 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.702 HG22 ' HB3' ' A' ' 136' ' ' LYS . 59.9 t -79.41 -65.82 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 121.012 -0.275 . . . . 0.26 111.521 -172.275 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.5 HG13 ' O ' ' A' ' 42' ' ' MET . 1.9 m -63.49 -33.58 62.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 N-CA-C 111.75 0.278 . . . . 0.83 111.75 -174.833 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.05 -39.35 86.92 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 121.102 -0.239 . . . . 2.4 111.53 -178.897 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 5.9 m -75.1 -33.26 61.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.728 0.299 . . . . 0.55 110.642 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.578 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -67.03 -41.06 87.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.324 0.583 . . . . 0.33 109.595 174.128 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 6.9 t-105 -63.03 -35.79 81.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.607 -0.724 . . . . 0.39 111.253 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.3 mmpt? -87.62 22.75 2.15 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.25 0.463 . . . . 2.24 112.25 -175.781 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.55 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 12.9 t-80 -96.24 139.99 31.59 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.42 -0.354 . . . . 0.39 110.07 175.232 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 40.6 mm-40 -81.44 7.03 12.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.777 0.323 . . . . 1.91 111.852 -176.126 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.55 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.7 OUTLIER -115.2 -7.29 12.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.022 0.439 . . . . 0.93 110.165 175.673 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.519 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -99.0 11.05 40.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.059 0.457 . . . . 0.28 110.939 -177.868 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.586 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 32.4 p-90 -63.24 -33.84 11.75 Favored Pre-proline 0 CA--C 1.547 0.855 0 N-CA-C 113.88 1.067 . . . . 0.58 113.88 -175.114 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.586 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 5.9 Cg_exo -78.97 -0.61 10.9 Favored 'Trans proline' 0 C--N 1.359 1.124 0 CA-C-N 121.2 1.464 . . . . 0.47 112.289 176.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -97.99 -2.01 41.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.121 -0.491 . . . . 1.11 110.614 -175.566 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.555 ' CZ ' ' HA ' ' A' ' 57' ' ' TRP . 13.1 m-30 -74.55 -11.7 60.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.02 -0.536 . . . . 0.63 110.603 179.24 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -106.96 119.71 50.42 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 115.902 -0.59 . . . . 1.63 111.23 -170.631 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.619 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 21.5 Cg_exo -63.44 145.45 92.36 Favored 'Trans proline' 0 C--O 1.237 0.438 0 C-N-CA 122.933 2.422 . . . . 0.87 113.103 -178.621 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 22.3 t -91.01 90.1 3.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 122.119 0.961 . . . . 0.88 108.847 177.568 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.4 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.6 OUTLIER -108.14 5.12 25.61 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.783 -1.099 . . . . 1.85 110.677 -176.774 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.508 ' HB2' ' NE2' ' A' ' 74' ' ' HIS . . . 79.28 -29.73 0.14 Allowed 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.003 -0.999 . . . . 1.29 112.58 177.385 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -98.76 -49.54 11.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 120.855 0.359 . . . . 1.89 111.901 -174.423 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.01 -22.45 49.28 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.136 -0.484 . . . . 2.99 111.632 -173.109 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.2 tp -112.87 3.59 16.44 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.864 0.364 . . . . 1.66 110.767 177.343 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ASN . . . . . 0.534 ' O ' HD13 ' A' ' 70' ' ' LEU . 15.4 t-20 53.68 69.41 0.71 Allowed 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.461 -0.791 . . . . 1.74 110.88 -178.378 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.534 HD13 ' O ' ' A' ' 69' ' ' ASN . 0.0 OUTLIER -133.31 64.18 68.46 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.584 -0.735 . . . . 1.61 110.596 178.218 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -78.54 -38.8 0.47 Allowed 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.417 2.078 . . . . 1.3 112.548 -178.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -77.97 -15.95 58.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.512 0.672 . . . . 1.97 109.896 -178.598 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.499 ' HA ' ' CE1' ' A' ' 115' ' ' TYR . 13.2 t80 -53.43 -41.6 66.23 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.845 -1.07 . . . . 1.13 111.007 177.102 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.508 ' NE2' ' HB2' ' A' ' 65' ' ' ALA . 1.8 m-70 -80.35 3.84 19.85 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.585 -0.734 . . . . 0.91 111.724 -173.053 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.9 mttp -88.14 -21.98 24.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.396 0.617 . . . . 2.86 109.589 178.616 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.8 mp -117.63 -46.42 3.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.143 -0.935 . . . . 1.0 110.339 -179.244 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.5 mm -86.84 111.56 21.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.009 -0.541 . . . . 0.75 110.476 -179.281 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.91 -29.5 58.43 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.072 -0.513 . . . . 1.99 110.87 -179.5 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.455 ' OD1' ' HD2' ' A' ' 21' ' ' PRO . 57.1 m-20 -119.84 81.95 27.06 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 116.031 -0.531 . . . . 2.05 109.962 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -76.06 98.85 1.23 Allowed 'Trans proline' 0 N--CA 1.464 -0.235 0 C-N-CA 123.265 2.644 . . . . 0.89 112.091 -177.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -132.81 174.97 9.75 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.51 0.671 . . . . 0.82 111.087 -176.633 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.619 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 3.1 p-10 -152.38 -126.99 0.04 OUTLIER 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.555 -1.202 . . . . 1.42 109.135 -173.255 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -126.24 -14.28 5.98 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.185 0.517 . . . . 0.8 110.188 -179.618 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.475 ' O ' ' HG3' ' A' ' 88' ' ' LYS . . . -92.7 -33.19 7.59 Favored Glycine 0 N--CA 1.438 -1.191 0 N-CA-C 110.157 -1.177 . . . . 0.32 110.157 -179.066 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.612 HG23 ' HB3' ' A' ' 62' ' ' PRO . 0.8 OUTLIER -65.56 -41.0 93.43 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.107 0.48 . . . . 0.95 110.435 176.875 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.439 HG12 ' HB3' ' A' ' 104' ' ' ASP . 79.0 mt -61.79 -47.95 90.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.365 -0.834 . . . . 0.97 109.935 175.074 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -32.28 73.39 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.692 -0.686 . . . . 1.15 111.136 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.475 ' HG3' ' O ' ' A' ' 84' ' ' GLY . 33.4 mttm -59.9 -52.9 63.43 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 120.951 0.405 . . . . 2.46 110.515 178.798 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -70.47 -30.42 67.23 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.633 -0.712 . . . . 1.16 111.233 -177.479 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.2 mt -66.14 -56.69 10.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.022 0.439 . . . . 0.49 111.119 178.406 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -68.42 -28.78 67.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.853 -0.612 . . . . 1.39 111.167 -177.114 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -80.69 -10.92 59.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.524 -0.307 . . . . 1.3 110.873 179.468 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 60.34 61.87 1.69 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.674 -0.694 . . . . 1.75 110.189 -178.013 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' TYR . . . . . 0.627 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 31.9 t80 -79.75 -52.73 7.56 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.79 -0.641 . . . . 0.96 111.434 -178.223 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -97.03 -178.71 4.29 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.071 0.462 . . . . 1.28 110.955 -175.32 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 -72.59 -54.08 10.12 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.589 -0.732 . . . . 1.05 111.216 -179.255 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 26.4 t -145.32 -178.82 6.26 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.054 0.454 . . . . 1.0 111.495 -172.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.653 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -76.81 -7.07 54.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.997 -0.547 . . . . 0.66 111.132 -177.028 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -34.86 73.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.323 0.583 . . . . 0.85 109.82 175.183 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.09 -30.79 62.52 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.418 -0.81 . . . . 2.44 110.14 177.461 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.48 ' HB3' ' SD ' ' A' ' 42' ' ' MET . 0.1 OUTLIER -74.36 -28.56 61.18 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.485 -0.779 . . . . 0.95 111.242 -179.258 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.77 -36.07 73.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.148 0.499 . . . . 1.13 110.326 177.616 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -70.05 -40.24 75.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.572 -0.74 . . . . 2.96 110.417 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ASP . . . . . 0.439 ' HB3' HG12 ' A' ' 86' ' ' ILE . 0.3 OUTLIER -70.06 -49.65 49.01 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.015 -0.539 . . . . 1.87 111.05 -176.55 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.578 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -55.66 -45.26 77.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.073 -0.512 . . . . 0.38 110.948 -179.496 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -60.56 -45.33 94.29 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.142 -0.481 . . . . 0.97 110.294 177.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 66.4 m -64.4 -37.15 86.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.79 -0.641 . . . . 0.43 111.462 -178.708 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -34.73 71.08 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.214 -0.448 . . . . 0.88 110.69 177.176 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -79.21 -36.93 39.36 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.37 -0.377 . . . . 0.29 110.515 -178.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.0 -37.23 86.96 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.764 0.316 . . . . 0.66 110.611 175.566 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -43.63 -55.06 4.56 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.271 -0.877 . . . . 1.84 110.925 177.58 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' CYS . . . . . 0.49 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 2.1 t -58.76 -47.73 83.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.196 -0.911 . . . . 0.63 111.906 -179.509 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 47.7 m-85 -74.85 -15.92 60.7 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.719 0.637 . . . . 0.81 112.719 -170.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 85.5 mt -91.77 -54.33 7.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.759 0.314 . . . . 0.55 111.271 -179.261 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.499 ' CE1' ' HA ' ' A' ' 73' ' ' TYR . 41.7 t80 -78.24 -40.35 37.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.78 0.324 . . . . 1.22 111.194 -175.31 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' ASN . . . . . 0.49 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 72.6 m-20 -86.12 -168.57 2.28 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.376 -0.375 . . . . 1.04 110.481 -177.252 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.26 154.07 43.78 Favored Pre-proline 0 C--N 1.32 -0.693 0 N-CA-C 110.526 -0.176 . . . . 3.47 110.526 -177.466 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -58.61 -25.97 77.08 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.409 2.072 . . . . 0.96 112.276 177.656 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.79 16.37 25.28 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.124 -0.489 . . . . 1.23 111.325 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' ASP . . . . . 0.433 ' OD1' HG22 ' A' ' 122' ' ' ILE . 3.8 t70 -76.52 159.72 30.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.47 . . . . 1.34 110.976 -177.605 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -69.56 -47.88 62.17 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.362 -0.836 . . . . 1.44 110.02 -178.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ILE . . . . . 0.433 HG22 ' OD1' ' A' ' 120' ' ' ASP . 2.2 tp -68.28 -30.4 47.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.384 -0.825 . . . . 0.42 110.666 -177.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 1.4 t -71.75 -41.36 70.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.225 -0.443 . . . . 0.35 110.163 177.532 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.07 -32.24 71.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.955 -0.566 . . . . 0.52 110.045 179.721 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 25.8 mtt -75.39 -39.16 59.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.539 -0.755 . . . . 0.62 110.546 177.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.35 -28.0 66.44 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.201 -0.454 . . . . 0.31 111.837 -178.823 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.68 -44.79 89.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.849 0.357 . . . . 1.94 111.213 179.286 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -76.72 -36.87 56.88 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.127 0.489 . . . . 0.32 110.433 179.166 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.519 HD21 ' HA ' ' A' ' 56' ' ' ALA . 1.0 OUTLIER -59.39 -43.51 92.92 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.357 -0.838 . . . . 0.33 111.047 179.909 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -65.93 -24.42 66.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.903 -0.589 . . . . 1.47 111.687 -175.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.508 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 19.1 ttmt -64.89 -41.62 95.46 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.768 -0.456 . . . . 2.24 109.768 -178.789 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.531 HD12 HD23 ' A' ' 50' ' ' LEU . 3.3 mt -69.39 -34.78 64.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.918 -0.583 . . . . 1.23 110.316 178.01 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.443 ' O ' HG23 ' A' ' 137' ' ' VAL . 29.9 t80 -58.35 -61.75 2.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.652 -0.703 . . . . 0.46 110.662 179.273 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 2.0 pp -63.94 -30.02 71.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.923 0.392 . . . . 0.64 110.406 -177.776 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.508 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.56 -50.73 72.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.549 -0.75 . . . . 1.61 111.13 178.894 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 136' ' ' LYS . . . . . 0.702 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -77.53 -23.29 50.18 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.77 -0.65 . . . . 1.52 111.055 -176.611 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.45 ' HA ' ' HG3' ' A' ' 140' ' ' MET . 46.4 t -78.15 -33.74 18.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.011 -0.54 . . . . 0.35 110.56 -179.476 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.03 -13.35 61.83 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.116 0.484 . . . . 0.5 110.616 179.05 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -106.71 4.2 27.51 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.681 -0.691 . . . . 1.76 110.869 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' MET . . . . . 0.45 ' HG3' ' HA ' ' A' ' 137' ' ' VAL . 0.7 OUTLIER -66.36 143.03 98.09 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.296 -0.411 . . . . 0.86 110.505 176.908 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -63.82 114.13 2.45 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.27 1.98 . . . . 0.67 111.272 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 13.6 mm-40 -79.37 26.29 0.29 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.184 -0.462 . . . . 2.91 111.622 -173.333 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.06 -40.16 3.0 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 115.936 -0.574 . . . . 2.7 110.763 -178.731 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 144' ' ' GLU . . . . . 0.512 ' OE2' ' HB2' ' A' ' 38' ' ' GLN . 0.0 OUTLIER 63.28 93.8 0.05 Allowed 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.063 -0.972 . . . . 2.34 110.313 -174.696 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 1.5 t -112.89 116.83 53.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 115.522 -0.763 . . . . 0.99 109.961 -178.397 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.643 ' HG3' HG22 ' A' ' 36' ' ' THR . 7.5 tt0 -64.8 133.14 51.37 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.693 0.283 . . . . 1.53 110.392 178.592 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 14.9 mt . . . . . 0 C--O 1.246 0.897 0 CA-C-O 118.697 -0.668 . . . . 1.57 110.372 -177.808 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.627 0 N-CA-C 111.828 -0.509 . . . . 2.17 111.828 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 312' ' ' ALY . . . . . 0.435 ' HCA' ' OH ' ' B' ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 155.21 -47.17 0.52 Allowed Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.494 -0.86 . . . . 1.97 112.736 179.294 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -151.81 136.11 16.75 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 122.523 -0.398 . . . . 3.58 111.177 -178.436 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 315' ' ' ALY . . . . . 0.435 ' OH ' ' HCA' ' B' ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 316' ' ' LYS . . . . . 0.429 ' HA ' ' HD2' ' B' ' 316' ' ' LYS . 11.1 tptp . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.487 -0.768 . . . . 4.6 110.23 -177.251 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo . . . . . 0 N--CA 1.476 0.499 0 N-CA-C 111.002 -0.422 . . . . 6.18 111.002 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.1 tp -96.61 115.02 26.74 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.509 -0.552 . . . . 5.71 109.509 177.506 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.49 43.91 5.7 Favored Glycine 0 N--CA 1.449 -0.456 0 N-CA-C 110.959 -0.857 . . . . 3.45 110.959 -173.646 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.5 p -75.2 146.98 40.78 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.239 -0.481 . . . . 2.44 111.768 -176.022 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -123.46 155.96 36.46 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.978 -0.555 . . . . 1.64 110.051 176.542 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.2 p -128.28 -0.98 3.43 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.027 0 CA-C-O 122.058 0.932 . . . . 0.93 108.57 174.575 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.2 m -149.17 141.35 23.99 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 114.159 -1.382 . . . . 1.61 108.192 176.761 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -145.11 136.67 12.77 Favored Pre-proline 0 C--N 1.315 -0.929 0 C-N-CA 121.112 -0.235 . . . . 1.6 110.579 -177.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -65.76 -48.13 3.27 Favored 'Trans proline' 0 N--CA 1.473 0.278 0 C-N-CA 123.061 2.507 . . . . 1.87 112.955 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.467 ' O ' ' HD3' ' A' ' 32' ' ' PRO . 5.4 m -75.74 -19.31 59.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.082 -0.508 . . . . 2.18 110.872 -176.175 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.468 ' HE3' ' CZ ' ' A' ' 94' ' ' TYR . 0.0 OUTLIER -102.33 100.63 16.14 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.55 -0.75 . . . . 2.75 110.598 178.409 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.467 ' HD3' ' O ' ' A' ' 30' ' ' SER . 15.2 Cg_exo -66.63 152.57 80.41 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.096 1.864 . . . . 1.38 111.564 178.675 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -136.02 88.78 0.23 Allowed Glycine 0 N--CA 1.444 -0.778 0 N-CA-C 111.662 -0.575 . . . . 0.97 111.662 -177.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.463 ' HG3' ' CZ2' ' A' ' 96' ' ' TRP . 7.3 mtm180 -91.87 148.81 21.94 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.723 -0.473 . . . . 1.93 109.723 178.681 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.0 120.62 32.14 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.395 -0.366 . . . . 2.64 110.103 -178.157 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.626 HG22 ' HG3' ' A' ' 146' ' ' GLU . 1.0 OUTLIER -111.36 160.58 16.92 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.827 -0.349 . . . . 0.68 110.722 177.89 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.489 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 8.1 t30 -60.69 -37.84 82.99 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-N 115.879 -0.6 . . . . 1.47 110.113 178.292 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.417 ' O ' ' HB3' ' A' ' 41' ' ' TYR . 23.4 tt0 -64.18 -42.37 96.71 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.303 -0.408 . . . . 1.04 110.433 178.829 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.785 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.4 OUTLIER -63.32 -52.01 63.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.216 -0.447 . . . . 0.8 110.549 179.027 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.422 ' O ' ' HG3' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -67.5 -22.98 65.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.288 0.566 . . . . 1.75 110.789 -179.541 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.489 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 62.3 t80 -64.45 -59.73 3.99 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 115.523 -0.762 . . . . 0.64 110.769 176.624 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.556 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -58.99 -34.39 71.79 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.573 -0.285 . . . . 1.13 111.749 -172.587 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.562 ' HA ' ' CG1' ' A' ' 47' ' ' VAL . 0.0 OUTLIER -65.68 -45.21 83.72 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.426 -0.509 . . . . 1.3 110.851 -177.521 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 -85.68 -34.24 21.34 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.085 -0.507 . . . . 0.5 111.795 -177.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 85.6 t -88.73 -57.81 3.96 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 112.332 0.493 . . . . 0.3 112.332 -175.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.664 HG22 ' HB3' ' A' ' 136' ' ' LYS . 42.4 t -79.63 -66.63 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 111.855 0.317 . . . . 0.26 111.855 -170.636 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.562 ' CG1' ' HA ' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -68.94 -35.97 71.75 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.314 0 C-N-CA 120.677 -0.409 . . . . 0.83 111.624 -173.728 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.46 -38.64 87.95 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.678 -0.409 . . . . 2.4 111.376 179.066 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.2 m -73.64 -36.37 65.39 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 121.083 -0.247 . . . . 0.55 110.824 178.24 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.626 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -66.24 -39.63 89.65 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 109.588 -0.523 . . . . 0.33 109.588 174.991 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 11.6 t-105 -58.04 -36.38 72.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.641 -0.709 . . . . 0.39 110.98 177.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -84.78 10.59 11.04 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.198 0.444 . . . . 2.24 112.198 -175.155 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 19.1 t-80 -83.12 139.06 33.42 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.842 0.353 . . . . 0.39 110.465 177.15 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.9 mm-40 -72.26 1.79 7.11 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.005 -0.543 . . . . 1.91 112.308 -175.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -118.83 -7.84 10.4 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.771 0.32 . . . . 0.93 110.918 178.165 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.662 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -92.6 6.43 47.34 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.955 0.407 . . . . 0.28 111.217 -176.089 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.55 ' HA ' ' CZ ' ' A' ' 60' ' ' TYR . 40.4 p-90 -62.97 -35.14 16.38 Favored Pre-proline 0 CA--C 1.548 0.867 0 N-CA-C 114.099 1.148 . . . . 0.58 114.099 -174.397 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.51 ' HD3' ' CG ' ' A' ' 57' ' ' TRP . 15.3 Cg_exo -71.19 -17.9 30.93 Favored 'Trans proline' 0 C--N 1.357 0.987 0 CA-C-N 121.095 1.427 . . . . 0.47 112.435 177.478 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -85.36 -4.53 59.19 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.196 -0.456 . . . . 1.11 111.257 -175.773 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.55 ' CZ ' ' HA ' ' A' ' 57' ' ' TRP . 17.6 m-30 -60.54 -38.08 83.29 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.304 0.573 . . . . 0.63 110.883 -178.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -97.45 132.8 24.63 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-N 115.41 -0.814 . . . . 1.63 110.615 -177.049 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.73 145.09 25.42 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.334 2.023 . . . . 0.87 112.083 178.343 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.454 HG11 ' CD1' ' A' ' 73' ' ' TYR . 4.4 t -69.59 110.11 2.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-O 121.727 0.775 . . . . 0.88 110.794 177.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.406 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.5 OUTLIER -110.23 -0.74 17.67 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.897 -1.047 . . . . 1.85 109.559 179.474 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 74.69 -64.19 0.39 Allowed 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 114.627 -1.169 . . . . 1.29 111.055 -175.727 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 12.9 mt -68.56 -48.84 70.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.788 0.328 . . . . 1.89 111.115 -176.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 38.2 tttp -50.46 -51.92 42.67 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.73 -0.668 . . . . 2.99 112.331 -177.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.629 ' HB3' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -105.1 7.24 33.76 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.496 -0.32 . . . . 1.66 111.573 -171.958 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ASN . . . . . 0.433 ' O ' HD13 ' A' ' 70' ' ' LEU . 17.7 t-20 59.11 67.28 0.93 Allowed 'General case' 0 N--CA 1.467 0.418 0 O-C-N 123.731 0.644 . . . . 1.74 111.207 -178.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.7 HD21 ' HG2' ' B' ' 312' ' ' ALY . 0.1 OUTLIER -128.06 66.94 73.44 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.349 -0.841 . . . . 1.61 110.798 -179.699 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.96 -34.93 21.97 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 121.909 1.739 . . . . 1.3 111.972 -179.353 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -72.0 -30.8 65.6 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.98 -0.554 . . . . 1.97 110.678 -178.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.454 ' CD1' HG11 ' A' ' 63' ' ' VAL . 2.8 t80 -59.67 -45.9 90.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.65 -0.705 . . . . 1.13 110.577 -178.478 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 4.1 m170 -75.73 -7.8 55.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.128 -0.487 . . . . 0.91 110.977 -177.144 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt -95.72 -44.6 7.37 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 116.082 -0.508 . . . . 2.86 110.004 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.6 mt -82.78 -50.31 15.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.859 -0.609 . . . . 1.0 111.026 -178.711 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 43.7 mm -83.1 138.08 19.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.438 -0.346 . . . . 0.75 110.339 -177.424 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.62 -47.43 12.09 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.205 -0.452 . . . . 1.99 110.936 -179.721 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -115.22 96.43 45.44 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 116.476 -0.329 . . . . 2.05 110.822 -179.535 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -73.38 99.01 1.07 Allowed 'Trans proline' 0 CA--C 1.529 0.271 0 C-N-CA 122.381 2.054 . . . . 0.89 112.516 178.005 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.24 145.76 47.94 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 116.056 -0.52 . . . . 0.82 110.085 -178.929 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.454 ' O ' HD13 ' A' ' 86' ' ' ILE . 5.4 m-20 -145.35 -153.93 0.51 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 114.862 -1.063 . . . . 1.42 108.297 -172.536 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.53 -18.72 21.94 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.065 -0.717 . . . . 0.8 109.065 -172.55 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -80.37 -25.07 57.86 Favored Glycine 0 N--CA 1.44 -1.084 0 N-CA-C 109.539 -1.424 . . . . 0.32 109.539 175.795 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -84.47 -41.28 16.75 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 114.705 -0.747 . . . . 0.95 111.486 178.385 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.486 ' CD1' ' HB3' ' A' ' 104' ' ' ASP . 0.2 OUTLIER -56.41 -47.42 81.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 121.163 0.506 . . . . 0.97 109.727 178.398 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.6 ptmt -66.15 -27.54 68.1 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.765 -0.652 . . . . 1.15 111.506 -179.091 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.9 tttt -67.92 -43.02 80.15 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.935 0.398 . . . . 2.46 110.795 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.543 ' HD3' ' OD2' ' A' ' 104' ' ' ASP . 1.6 mtt180 -69.84 -32.0 70.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.309 -0.405 . . . . 1.16 110.558 178.578 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.418 ' HG ' ' SG ' ' A' ' 101' ' ' CYS . 7.7 mt -67.71 -54.41 19.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.656 -0.702 . . . . 0.49 111.22 178.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 25.0 pt-20 -64.92 -26.74 68.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.119 -0.491 . . . . 1.39 111.313 -175.496 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -95.29 10.67 35.31 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.081 -0.509 . . . . 1.3 111.276 -178.098 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.3 p30 37.25 54.9 1.33 Allowed 'General case' 0 N--CA 1.475 0.825 0 O-C-N 124.169 0.918 . . . . 1.75 111.711 -177.517 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' TYR . . . . . 0.468 ' CZ ' ' HE3' ' A' ' 31' ' ' LYS . 29.8 t80 -66.06 -73.5 0.13 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.057 -0.974 . . . . 0.96 112.06 -175.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -94.87 39.44 1.1 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.518 -0.765 . . . . 1.28 112.582 -172.651 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' TRP . . . . . 0.463 ' CZ3' ' HB2' ' A' ' 32' ' ' PRO . 1.2 t-105 71.25 -66.07 0.31 Allowed 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.24 0.83 . . . . 1.05 113.24 169.012 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -125.15 161.26 27.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.114 0.483 . . . . 1.0 111.912 -168.143 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.785 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -73.4 -12.71 60.91 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.973 -0.558 . . . . 0.66 111.071 -179.665 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 20.0 m -64.05 -26.32 68.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.293 0.568 . . . . 0.85 109.791 175.297 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -82.47 -26.68 32.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.522 -0.763 . . . . 2.44 110.35 176.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.418 ' SG ' ' HG ' ' A' ' 90' ' ' LEU . 0.5 OUTLIER -74.64 -23.08 58.63 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.539 -0.755 . . . . 0.95 110.62 179.475 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 6.5 ttm -60.94 -31.65 71.19 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.053 -0.521 . . . . 1.13 110.134 176.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.4 -38.16 68.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.696 -0.683 . . . . 2.96 110.252 178.18 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ASP . . . . . 0.543 ' OD2' ' HD3' ' A' ' 89' ' ' ARG . 1.5 m-20 -67.3 -50.41 60.37 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.994 -0.548 . . . . 1.87 110.502 -178.405 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.626 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -55.75 -43.92 77.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.692 -0.685 . . . . 0.38 110.272 177.479 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -60.41 -49.87 75.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.615 -0.72 . . . . 0.97 110.361 178.064 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 71.3 m -55.37 -51.14 67.76 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 123.584 0.552 . . . . 0.43 111.259 179.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 2.3 ttp -53.42 -40.88 65.5 Favored 'General case' 0 C--O 1.233 0.216 0 O-C-N 123.326 0.391 . . . . 0.88 111.151 178.581 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -67.8 -43.58 79.33 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.485 -0.325 . . . . 0.29 110.971 -178.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.37 -43.71 98.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.738 0.304 . . . . 0.66 110.888 177.564 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ASN . . . . . 0.416 ' HB3' ' OH ' ' A' ' 73' ' ' TYR . 7.1 m-20 -47.24 -48.86 24.28 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.455 -0.793 . . . . 1.84 111.335 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' CYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 14.0 t -57.24 -42.46 81.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.724 -0.671 . . . . 0.63 111.518 179.124 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -80.44 -21.06 42.52 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.857 0.36 . . . . 0.81 111.833 -173.756 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 55.5 mt -87.01 -50.86 13.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.935 0.398 . . . . 0.55 110.75 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -73.43 -42.83 61.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.054 -0.521 . . . . 1.22 110.739 -177.304 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' ASN . . . . . 0.414 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 67.0 m-80 -100.01 161.5 13.57 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.233 -0.439 . . . . 1.04 110.728 -174.541 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.1 mmtt -82.83 147.95 56.22 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.95 -0.568 . . . . 3.47 109.844 178.007 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' PRO . . . . . 0.919 ' HA ' HG11 ' A' ' 123' ' ' VAL . 24.2 Cg_endo -62.26 -12.98 29.63 Favored 'Trans proline' 0 N--CA 1.473 0.271 0 C-N-CA 122.786 2.324 . . . . 0.96 112.386 178.837 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.41 9.35 39.77 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.82 -0.627 . . . . 1.23 111.338 179.686 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -85.92 164.0 17.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.081 0.467 . . . . 1.34 111.062 -177.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.76 -45.41 94.01 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.234 -0.894 . . . . 1.44 110.943 -177.64 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -69.33 -34.85 64.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.176 -0.92 . . . . 0.42 111.487 -174.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.919 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.3 t -71.32 -35.04 56.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.881 0.372 . . . . 0.35 110.088 179.507 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.87 -32.06 65.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.5 0.667 . . . . 0.52 109.646 177.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' MET . . . . . 0.487 ' O ' HD13 ' A' ' 129' ' ' LEU . 8.7 mtt -80.13 -43.95 20.78 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 114.992 -1.004 . . . . 0.62 110.787 179.739 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.86 -35.16 63.72 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.246 -0.434 . . . . 0.31 111.885 -177.612 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.63 -41.98 98.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.403 -0.362 . . . . 1.94 111.386 -179.542 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -78.06 -36.56 48.2 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.174 0.512 . . . . 0.32 110.466 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.662 HD21 ' HA ' ' A' ' 56' ' ' ALA . 4.0 mp -60.8 -42.06 96.86 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.445 -0.798 . . . . 0.33 111.042 -179.333 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -61.13 -28.63 69.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.883 -0.599 . . . . 1.47 111.967 -175.295 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.491 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 7.0 mttm -64.53 -34.35 78.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.839 0.352 . . . . 2.24 110.441 -177.119 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 13.9 mt -75.54 -31.0 22.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.036 -0.529 . . . . 1.23 110.67 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.505 ' O ' HG23 ' A' ' 137' ' ' VAL . 29.4 t80 -58.66 -62.33 1.95 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.009 -0.541 . . . . 0.46 110.691 -179.426 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.28 -28.24 69.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.104 0.478 . . . . 0.64 110.488 -179.364 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.491 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.36 -39.8 88.48 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.469 -0.787 . . . . 1.61 111.481 179.231 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 136' ' ' LYS . . . . . 0.664 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -90.76 -26.56 19.43 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.895 0.378 . . . . 1.52 110.745 -178.677 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 133' ' ' PHE . 55.8 t -67.8 -32.03 54.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.1 -0.5 . . . . 0.35 110.23 177.403 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -64.96 -18.69 65.48 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.029 -0.532 . . . . 0.5 110.849 179.074 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.3 mm100 -103.58 -0.28 29.91 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.599 -0.728 . . . . 1.76 110.958 -178.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' MET . . . . . 0.472 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 0.4 OUTLIER -66.43 142.32 97.65 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.155 -0.475 . . . . 0.86 111.371 -179.432 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -74.77 101.7 1.49 Allowed 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.472 2.114 . . . . 0.67 111.895 179.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 76.5 mm-40 -70.05 -2.24 12.21 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 112.192 0.441 . . . . 2.91 112.192 -175.086 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -81.83 -38.42 25.52 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.881 0.372 . . . . 2.7 110.384 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 67.09 86.33 0.13 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.842 -1.072 . . . . 2.34 110.347 -178.685 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 1.2 t -96.25 120.19 45.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.564 -0.744 . . . . 0.99 109.618 178.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.626 ' HG3' HG22 ' A' ' 36' ' ' THR . 0.4 OUTLIER -73.15 146.02 45.95 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.752 0.311 . . . . 1.53 110.625 179.972 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 69.1 mt . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.555 -0.736 . . . . 1.57 110.371 -177.432 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.676 0 N-CA-C 111.847 -0.501 . . . . 2.17 111.847 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 312' ' ' ALY . . . . . 0.7 ' HG2' HD21 ' A' ' 70' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 148.09 92.67 0.11 Allowed Glycine 0 N--CA 1.447 -0.62 0 CA-C-N 115.572 -0.74 . . . . 1.97 111.592 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 66.3 115.68 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.35 0.66 . . . . 3.58 111.554 -176.955 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 315' ' ' ALY . . . . . 0.461 HH31 ' HB3' ' A' ' 58' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.108 0 CA-C-O 117.965 -1.017 . . . . 4.6 109.659 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo . . . . . 0 N--CA 1.479 0.623 0 N-CA-C 110.023 -0.799 . . . . 6.18 110.023 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -117.27 123.13 45.83 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.722 0.296 . . . . 5.71 110.337 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 91.39 -50.21 2.98 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.782 -0.723 . . . . 3.45 113.062 175.256 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 87.5 p -105.19 135.9 45.7 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.209 0.528 . . . . 2.44 112.075 -177.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.601 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 8.8 mt-10 -65.01 137.37 57.68 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.343 -0.844 . . . . 1.64 111.151 172.514 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.536 HG21 ' HG2' ' A' ' 88' ' ' LYS . 2.3 p -119.52 -8.61 11.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.449 0.642 . . . . 0.93 110.059 173.012 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -148.92 132.68 16.95 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.645 -0.707 . . . . 1.61 110.027 177.21 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -140.77 131.01 13.39 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 116.366 -0.379 . . . . 1.6 110.319 178.008 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -67.35 -47.33 2.26 Favored 'Trans proline' 0 CA--C 1.53 0.316 0 C-N-CA 123.093 2.529 . . . . 1.87 113.093 -179.167 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 3.1 m -80.54 -22.48 40.79 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.083 -0.508 . . . . 2.18 111.331 -174.062 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.461 ' HA ' ' HD3' ' A' ' 32' ' ' PRO . 17.5 tttm -77.85 127.27 82.48 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 115.932 -0.577 . . . . 2.75 110.941 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 31' ' ' LYS . 3.8 Cg_exo -72.36 151.42 53.98 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.386 2.058 . . . . 1.38 111.952 177.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -151.84 113.36 0.58 Allowed Glycine 0 N--CA 1.443 -0.856 0 N-CA-C 110.681 -0.967 . . . . 0.97 110.681 179.674 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.6 mtm180 -124.7 159.74 30.16 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 110.099 -0.334 . . . . 1.93 110.099 -175.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.506 ' HA ' HD22 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -99.2 84.2 2.99 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.118 0.485 . . . . 2.64 110.99 179.284 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.489 ' HA ' ' HA ' ' A' ' 146' ' ' GLU . 5.4 p -94.46 176.6 6.23 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 120.927 0.394 . . . . 0.68 111.401 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.575 ' HA ' HD11 ' A' ' 147' ' ' LEU . 37.9 t30 -63.31 -54.92 29.55 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.613 -0.721 . . . . 1.47 110.679 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -56.74 -39.85 74.7 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.771 0.319 . . . . 1.04 111.105 -178.035 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.506 HD22 ' HA ' ' A' ' 35' ' ' LYS . 0.9 OUTLIER -60.53 -58.99 6.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.057 -0.52 . . . . 0.8 111.282 -179.767 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.4 mt-30 -69.54 -26.02 64.3 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.962 -0.563 . . . . 1.75 110.721 -177.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.406 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 47.8 t80 -60.85 -62.95 1.48 Allowed 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.739 -0.664 . . . . 0.64 110.669 177.164 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.554 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -61.06 -30.41 70.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.726 0.298 . . . . 1.13 110.529 -173.912 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.472 ' HB2' HD22 ' A' ' 90' ' ' LEU . 7.7 tt0 -59.14 -56.24 24.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.866 -0.606 . . . . 1.3 110.836 178.351 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 -86.4 -30.42 22.14 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.99 0.424 . . . . 0.5 111.927 -176.109 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 91.7 t -88.48 -57.6 4.12 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 N-CA-C 112.423 0.527 . . . . 0.3 112.423 -174.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.569 HG22 ' HB3' ' A' ' 136' ' ' LYS . 50.1 t -80.46 -66.51 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 C-N-CA 120.716 -0.394 . . . . 0.26 111.712 -170.015 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.472 HG12 ' O ' ' A' ' 42' ' ' MET . 1.5 p -70.67 -34.11 55.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 C-N-CA 120.581 -0.448 . . . . 0.83 111.437 -173.658 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.4 ' O ' ' HE3' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -65.02 -34.79 79.27 Favored 'General case' 0 C--N 1.329 -0.29 0 O-C-N 122.195 -0.316 . . . . 2.4 111.578 179.345 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.0 m -77.5 -39.1 47.46 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.909 -0.316 . . . . 0.55 110.54 177.086 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.591 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -60.53 -38.05 83.19 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.246 0.546 . . . . 0.33 109.875 175.663 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 17.6 t-105 -60.76 -28.73 68.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.461 -0.79 . . . . 0.39 111.499 178.409 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.4 ' HE3' ' O ' ' A' ' 48' ' ' LYS . 4.7 mtmt -92.72 18.79 8.28 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.014 0.375 . . . . 2.24 112.014 -174.177 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.425 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 23.3 t-80 -89.48 139.12 30.85 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.963 -0.384 . . . . 0.39 109.963 175.759 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -70.76 -8.88 55.52 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.323 -0.399 . . . . 1.91 112.023 -175.47 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.425 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 1.8 m-30 -107.53 -1.49 21.27 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.96 0.409 . . . . 0.93 110.47 177.762 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.586 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -92.25 2.29 56.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.271 0.558 . . . . 0.28 110.972 -177.802 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.461 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 54.0 p-90 -63.87 -33.22 9.23 Favored Pre-proline 0 CA--C 1.547 0.855 0 N-CA-C 114.489 1.292 . . . . 0.58 114.489 -173.683 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.461 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 6.6 Cg_exo -74.59 -5.1 16.42 Favored 'Trans proline' 0 C--N 1.36 1.179 0 CA-C-N 121.296 1.499 . . . . 0.47 112.49 178.411 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -100.9 3.13 41.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.875 0.369 . . . . 1.11 110.269 -177.352 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.416 ' CZ ' ' HA ' ' A' ' 57' ' ' TRP . 16.0 m-30 -71.83 -26.15 62.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.048 -0.524 . . . . 0.63 111.159 -178.484 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.408 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -110.52 123.91 34.52 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.098 -0.501 . . . . 1.63 110.896 -174.617 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.535 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 39.1 Cg_exo -60.41 159.62 26.66 Favored 'Trans proline' 0 C--O 1.237 0.45 0 C-N-CA 122.968 2.445 . . . . 0.87 113.166 179.395 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.514 HG11 ' CD2' ' A' ' 73' ' ' TYR . 2.7 t -100.77 105.14 17.23 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 CA-C-O 121.705 0.764 . . . . 0.88 109.103 -178.575 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -114.12 2.9 15.05 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.919 -1.037 . . . . 1.85 110.885 -176.211 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 73.02 -9.03 1.18 Allowed 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 115.195 -0.911 . . . . 1.29 112.812 175.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 21.5 mm -113.96 -55.39 4.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.019 0.438 . . . . 1.89 110.666 -175.631 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.68 -40.3 88.51 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.756 -0.656 . . . . 2.99 110.611 -177.548 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.61 -5.08 57.49 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.91 -0.586 . . . . 1.66 110.564 178.221 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 58.9 t30 53.21 68.11 0.89 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.774 -0.648 . . . . 1.74 110.507 -174.707 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -130.04 65.59 75.75 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 115.603 -0.726 . . . . 1.61 110.667 -177.067 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -70.5 -30.36 18.95 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.166 1.91 . . . . 1.3 112.414 -177.422 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.23 -9.14 59.6 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.043 -0.526 . . . . 1.97 110.951 -177.805 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.514 ' CD2' HG11 ' A' ' 63' ' ' VAL . 11.9 t80 -63.55 -42.27 98.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.144 -0.48 . . . . 1.13 110.468 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -71.39 -7.82 49.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.0 -0.545 . . . . 0.91 111.637 -176.342 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 52.9 mmtt -92.5 -28.88 16.52 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.107 0.48 . . . . 2.86 110.095 -177.788 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.6 mt -101.72 -42.37 9.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.416 0.627 . . . . 1.0 110.184 178.452 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 47.8 mm -105.17 117.49 50.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 115.76 -0.655 . . . . 0.75 110.014 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.66 -15.68 34.31 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.289 -0.414 . . . . 1.99 110.697 -176.699 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -120.36 84.45 35.14 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.921 -0.582 . . . . 2.05 109.896 177.333 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -70.7 91.24 0.61 Allowed 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.604 2.203 . . . . 0.89 112.318 -176.862 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 1.6 mmt -129.39 162.51 27.87 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.03 -0.532 . . . . 0.82 110.436 -178.009 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.535 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 8.4 p-10 -146.92 -126.01 0.06 Allowed 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 114.79 -1.096 . . . . 1.42 109.082 -173.568 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -120.0 -22.01 6.87 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.139 0.495 . . . . 0.8 110.15 -178.918 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -84.64 -24.89 44.37 Favored Glycine 0 N--CA 1.442 -0.931 0 N-CA-C 110.759 -0.937 . . . . 0.32 110.759 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.68 -38.56 64.86 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 121.104 0.478 . . . . 0.95 110.252 177.371 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.581 HG23 ' SG ' ' A' ' 101' ' ' CYS . 75.9 mt -60.17 -49.27 84.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.404 -0.816 . . . . 0.97 110.046 175.255 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.89 -27.45 66.67 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.562 -0.745 . . . . 1.15 111.303 -178.623 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.536 ' HG2' HG21 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -62.48 -44.63 95.93 Favored 'General case' 0 N--CA 1.456 -0.128 0 CA-C-O 120.521 0.2 . . . . 2.46 111.301 -178.837 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 24.0 mtp180 -75.97 -29.03 58.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.638 0.256 . . . . 1.16 110.698 -179.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.584 ' HG ' ' OH ' ' A' ' 95' ' ' TYR . 3.9 mt -63.67 -55.52 22.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.945 -0.57 . . . . 0.49 110.91 178.429 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -72.05 -22.53 61.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.229 -0.441 . . . . 1.39 111.249 -176.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.408 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 4.9 m-80 -83.72 -9.04 59.11 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.491 -0.322 . . . . 1.3 110.558 178.183 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 56.71 53.8 7.96 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.604 0.716 . . . . 1.75 110.142 -178.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' TYR . . . . . 0.601 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 61.7 t80 -81.35 -16.27 52.83 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.329 -0.85 . . . . 0.96 111.411 -175.503 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.584 ' OH ' ' HG ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -129.18 174.22 9.77 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.042 0.449 . . . . 1.28 110.936 -179.455 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 -73.64 -50.47 20.87 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.178 -0.919 . . . . 1.05 110.671 -178.667 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 29.1 t -143.55 176.74 8.97 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.033 -0.531 . . . . 1.0 110.228 -175.456 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.466 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -75.82 -7.35 54.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.475 -0.33 . . . . 0.66 111.741 -173.823 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.74 -32.23 71.52 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.937 0.398 . . . . 0.85 110.795 -179.515 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -73.26 -32.03 64.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.844 -0.617 . . . . 2.44 110.522 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.625 ' HA ' ' OD2' ' A' ' 104' ' ' ASP . 0.5 OUTLIER -75.44 -20.65 58.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.737 -0.665 . . . . 0.95 111.539 -175.94 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.38 -27.39 62.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.006 0.432 . . . . 1.13 110.182 176.555 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -71.9 -40.52 68.8 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.851 -0.613 . . . . 2.96 110.511 177.848 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ASP . . . . . 0.625 ' OD2' ' HA ' ' A' ' 101' ' ' CYS . 5.3 m-20 -66.47 -48.21 70.62 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.977 -0.556 . . . . 1.87 110.404 -179.565 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.591 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.4 OUTLIER -56.82 -42.88 80.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.873 -0.603 . . . . 0.38 110.558 179.617 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -58.69 -50.47 73.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.169 -0.468 . . . . 0.97 110.054 175.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 30.9 m -57.88 -49.09 77.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.128 -0.487 . . . . 0.43 111.315 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.31 -38.05 57.43 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.878 0.471 . . . . 0.88 111.927 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -77.87 -49.12 14.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.972 0.415 . . . . 0.29 110.167 -175.293 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.81 -36.39 80.98 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.937 -0.574 . . . . 0.66 111.61 178.044 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -49.31 -52.83 25.28 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.013 0.435 . . . . 1.84 111.201 178.525 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' CYS . . . . . 0.43 ' SG ' ' HA ' ' A' ' 123' ' ' VAL . 1.0 OUTLIER -63.95 -41.71 97.52 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.536 -0.756 . . . . 0.63 110.998 -178.753 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -63.28 -37.92 89.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.399 -0.364 . . . . 0.81 111.411 -177.403 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 55.8 mt -80.04 -48.96 19.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.451 -0.341 . . . . 0.55 111.887 -176.293 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 92.2 t80 -69.8 -26.63 64.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.75 0.31 . . . . 1.22 111.55 -174.016 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -111.46 175.8 5.28 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.15 0.5 . . . . 1.04 111.375 -173.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -97.06 152.04 38.08 Favored Pre-proline 0 C--N 1.322 -0.625 0 CA-C-N 115.543 -0.753 . . . . 3.47 110.298 -177.744 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' PRO . . . . . 0.464 ' HA ' HG11 ' A' ' 123' ' ' VAL . 18.5 Cg_endo -60.18 -21.69 67.17 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.798 2.332 . . . . 0.96 112.697 179.783 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.52 18.39 16.76 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.131 -0.486 . . . . 1.23 111.347 -179.862 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' ASP . . . . . 0.492 ' OD2' ' HA2' ' B' ' 313' ' ' GLY . 2.8 t0 -96.7 155.71 16.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.236 -0.438 . . . . 1.34 110.361 178.648 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -71.7 -41.05 69.07 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.792 -0.64 . . . . 1.44 110.703 -175.738 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.2 tp -62.65 -34.02 62.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.99 -0.55 . . . . 0.42 110.853 -178.319 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.464 HG11 ' HA ' ' A' ' 118' ' ' PRO . 0.9 OUTLIER -68.99 -41.71 81.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.113 0.483 . . . . 0.35 109.861 177.102 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.37 -34.83 79.07 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.646 -0.707 . . . . 0.52 109.819 -179.604 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' MET . . . . . 0.562 ' O ' HD13 ' A' ' 129' ' ' LEU . 14.5 mtt -69.0 -47.09 66.37 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.257 -0.883 . . . . 0.62 110.677 179.568 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.59 -39.43 67.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.239 -0.437 . . . . 0.31 111.394 -179.391 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.76 -36.74 83.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.14 -0.482 . . . . 1.94 111.386 -178.42 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -74.95 -37.15 62.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.198 0.523 . . . . 0.32 110.319 178.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.586 HD21 ' HA ' ' A' ' 56' ' ' ALA . 7.6 mp -61.05 -39.85 91.4 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.264 -0.88 . . . . 0.33 110.323 178.085 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -55.0 -32.75 62.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.574 -0.739 . . . . 1.47 112.071 -176.504 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.616 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -62.59 -38.8 91.55 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 120.692 0.282 . . . . 2.24 110.676 -175.389 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 25.0 mt -72.2 -34.19 48.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.17 -0.468 . . . . 1.23 110.5 179.493 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.556 ' O ' HG23 ' A' ' 137' ' ' VAL . 30.7 t80 -60.52 -62.72 1.66 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.947 -0.57 . . . . 0.46 110.845 -178.684 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.428 ' HG ' ' H ' ' A' ' 134' ' ' LEU . 0.3 OUTLIER -64.8 -28.41 69.55 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 120.917 0.389 . . . . 0.64 110.612 -177.022 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.616 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -58.9 -57.53 12.64 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.611 -0.722 . . . . 1.61 110.777 176.626 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 136' ' ' LYS . . . . . 0.569 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -71.15 -26.48 63.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.786 -0.643 . . . . 1.52 111.081 -176.552 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' ' 133' ' ' PHE . 75.8 t -68.93 -31.87 52.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.936 0.398 . . . . 0.35 110.245 177.003 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -70.52 -12.5 61.61 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.111 0.482 . . . . 0.5 110.718 177.572 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -104.26 -1.36 27.17 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.877 -0.601 . . . . 1.76 110.333 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' MET . . . . . 0.475 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 0.5 OUTLIER -68.29 144.94 97.15 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 115.907 -0.588 . . . . 0.86 111.193 -178.193 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.419 ' C ' ' H ' ' A' ' 143' ' ' GLU . 58.5 Cg_endo -73.95 91.14 0.93 Allowed 'Trans proline' 0 N--CA 1.459 -0.508 0 C-N-CA 122.4 2.067 . . . . 0.67 111.436 177.002 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -78.98 26.4 0.25 Allowed 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.633 0.73 . . . . 2.91 111.875 -176.739 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.419 ' H ' ' C ' ' A' ' 141' ' ' PRO . 4.5 mp0 -114.13 -43.13 3.26 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-N 115.14 -0.937 . . . . 2.7 108.49 174.791 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 72.35 137.99 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 114.667 -1.151 . . . . 2.34 112.37 171.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -155.58 150.63 10.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 114.845 -1.07 . . . . 0.99 108.5 177.683 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.489 ' HA ' ' HA ' ' A' ' 36' ' ' THR . 0.9 OUTLIER -81.74 148.31 29.0 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 119.793 -0.763 . . . . 1.53 109.602 174.387 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.575 HD11 ' HA ' ' A' ' 37' ' ' ASN . 14.1 mt . . . . . 0 C--O 1.247 0.923 0 CA-C-O 118.581 -0.723 . . . . 1.57 110.906 -178.188 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.791 0 N-CA-C 111.354 -0.698 . . . . 2.17 111.354 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 313' ' ' GLY . . . . . 0.492 ' HA2' ' OD2' ' A' ' 120' ' ' ASP . . . 102.1 82.87 1.68 Allowed Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.846 -0.692 . . . . 1.97 111.499 -176.688 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 73.47 123.37 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.604 0.762 . . . . 3.58 110.371 -175.072 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 2.8 tptt . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.277 -0.868 . . . . 4.6 109.89 178.695 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo . . . . . 0 N--CA 1.478 0.603 0 N-CA-C 109.926 -0.836 . . . . 6.18 109.926 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.495 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -148.58 135.57 20.03 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 110.023 -0.362 . . . . 5.71 110.023 176.188 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.36 -71.92 2.41 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.976 -0.631 . . . . 3.45 112.216 -179.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 10.4 p -122.5 140.21 53.02 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 110.247 -0.279 . . . . 2.44 110.247 178.575 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.719 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 7.3 mt-10 -61.32 134.75 57.29 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.184 0.516 . . . . 1.64 111.926 178.778 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.523 HG21 ' HG3' ' A' ' 88' ' ' LYS . 8.1 p -114.53 -12.83 11.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 115.405 -0.816 . . . . 0.93 109.596 174.704 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.491 ' HB3' ' ND2' ' A' ' 92' ' ' ASN . 66.9 p -163.7 141.8 7.57 Favored 'General case' 0 N--CA 1.439 -0.993 0 CA-C-N 114.893 -1.049 . . . . 1.61 109.21 179.179 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.459 ' HB3' ' CB ' ' A' ' 31' ' ' LYS . 39.1 t-20 -148.05 124.77 5.49 Favored Pre-proline 0 C--N 1.316 -0.86 0 CA-C-N 116.261 -0.427 . . . . 1.6 110.099 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.19 -40.13 9.19 Favored 'Trans proline' 0 N--CA 1.472 0.244 0 C-N-CA 123.093 2.529 . . . . 1.87 112.685 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.6 m -77.46 -22.68 51.0 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 116.054 -0.521 . . . . 2.18 110.363 -177.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.459 ' CB ' ' HB3' ' A' ' 28' ' ' ASN . 5.3 tttp -83.52 131.4 52.68 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.512 -0.767 . . . . 2.75 110.232 177.115 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.436 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 40.9 Cg_endo -68.3 140.5 48.87 Favored 'Trans proline' 0 N--CA 1.463 -0.3 0 C-N-CA 122.758 2.306 . . . . 1.38 112.702 177.77 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -142.45 121.58 1.8 Allowed Glycine 0 N--CA 1.446 -0.635 0 N-CA-C 110.491 -1.043 . . . . 0.97 110.491 177.118 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.444 ' HE ' ' CD ' ' A' ' 146' ' ' GLU . 0.3 OUTLIER -129.38 173.03 10.91 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 117.052 0.426 . . . . 1.93 110.877 -174.452 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -110.33 100.97 9.74 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.778 -0.646 . . . . 2.64 110.778 177.472 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.404 ' HA ' ' HA ' ' A' ' 146' ' ' GLU . 4.7 p -108.66 164.25 12.54 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.781 -0.368 . . . . 0.68 110.58 175.682 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.465 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 0.1 OUTLIER -65.72 -35.87 81.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.931 -0.577 . . . . 1.47 110.647 -179.666 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -67.43 -36.27 80.88 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 120.748 0.308 . . . . 1.04 110.505 178.162 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.43 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.6 OUTLIER -63.1 -53.7 49.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.991 -0.55 . . . . 0.8 110.648 178.971 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -68.51 -30.36 69.16 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.985 -0.552 . . . . 1.75 110.617 -179.584 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.465 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 43.3 t80 -57.9 -63.2 1.33 Allowed 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 115.846 -0.616 . . . . 0.64 110.781 176.417 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.468 ' HG2' HG21 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -60.23 -31.87 70.59 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.749 0.309 . . . . 1.13 110.915 -172.945 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.428 ' HA ' ' CG1' ' A' ' 47' ' ' VAL . 11.1 tt0 -67.41 -48.2 68.01 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.88 -0.6 . . . . 1.3 110.978 -178.449 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 66.9 m-80 -85.81 -32.41 21.79 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 112.369 0.507 . . . . 0.5 112.369 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 72.6 t -88.23 -57.4 4.28 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 N-CA-C 112.214 0.45 . . . . 0.3 112.214 -174.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.468 HG21 ' HG2' ' A' ' 42' ' ' MET . 78.6 t -82.6 -66.22 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 C-N-CA 120.695 -0.402 . . . . 0.26 111.864 -170.176 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.459 HG12 ' O ' ' A' ' 42' ' ' MET . 1.4 p -64.54 -36.79 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 C-N-CA 120.431 -0.508 . . . . 0.83 111.669 -174.026 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.38 -36.97 79.3 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.848 0.356 . . . . 2.4 111.037 177.416 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 56.3 m -77.88 -34.31 51.66 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.59 -0.277 . . . . 0.55 110.948 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.718 HD23 HD11 ' A' ' 132' ' ' ILE . 0.0 OUTLIER -65.47 -42.63 92.05 Favored 'General case' 0 C--N 1.332 -0.196 0 N-CA-C 109.654 -0.499 . . . . 0.33 109.654 175.275 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 21.2 t-105 -61.9 -38.54 88.74 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.743 -0.662 . . . . 0.39 111.006 178.471 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -84.42 15.37 3.71 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.018 0.377 . . . . 2.24 112.018 -175.31 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -87.3 134.47 33.55 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.557 -0.535 . . . . 0.39 109.557 175.138 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -74.9 -4.54 38.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.896 0.379 . . . . 1.91 111.782 -175.393 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.466 ' CD2' ' HG2' ' A' ' 125' ' ' MET . 3.0 m-30 -105.38 1.64 28.03 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.118 0.485 . . . . 0.93 110.202 177.065 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.727 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -101.24 12.78 36.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.173 -0.467 . . . . 0.28 111.05 -178.612 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.489 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 55.6 p-90 -65.62 -34.62 9.61 Favored Pre-proline 0 CA--C 1.546 0.822 0 N-CA-C 113.507 0.929 . . . . 0.58 113.507 -175.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.489 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 4.7 Cg_exo -75.01 -1.84 11.76 Favored 'Trans proline' 0 C--N 1.364 1.357 0 CA-C-N 120.924 1.366 . . . . 0.47 112.136 178.617 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -106.9 10.59 30.53 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.019 -0.537 . . . . 1.11 110.405 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 11.7 m-30 -79.57 -13.25 59.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.894 -0.593 . . . . 0.63 111.317 -178.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -113.55 136.55 21.97 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 116.267 -0.424 . . . . 1.63 110.712 -174.452 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.586 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 37.1 Cg_endo -67.1 140.81 55.31 Favored 'Trans proline' 0 C--O 1.239 0.532 0 C-N-CA 122.765 2.31 . . . . 0.87 112.592 -179.474 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.414 HG11 ' CD2' ' A' ' 73' ' ' TYR . 47.4 t -83.97 86.03 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 CA-C-O 122.373 1.082 . . . . 0.88 109.408 178.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.534 ' OD1' ' HB2' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -103.18 17.1 24.87 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 114.259 -1.337 . . . . 1.85 108.612 177.26 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 78.21 -66.08 0.22 Allowed 'General case' 0 C--O 1.215 -0.719 0 CA-C-N 113.379 -1.737 . . . . 1.29 111.254 -176.883 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 55.7 mt -75.53 -37.5 37.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 112.173 0.435 . . . . 1.89 112.173 -171.108 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.534 ' HB2' ' OD1' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -57.67 -50.03 74.53 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.044 0.387 . . . . 2.99 112.044 -177.311 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 68' ' ' LEU . 9.9 tp -95.37 -2.63 48.71 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.289 0.566 . . . . 1.66 110.151 178.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ASN . . . . . 0.458 ' O ' HD13 ' A' ' 70' ' ' LEU . 1.2 t-20 63.57 56.98 1.51 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 114.95 -1.023 . . . . 1.74 112.168 178.627 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.458 HD13 ' O ' ' A' ' 69' ' ' ASN . 1.1 mm? -122.23 78.79 43.96 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.17 -0.923 . . . . 1.61 108.89 172.281 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.18 -32.85 26.23 Favored 'Trans proline' 0 C--O 1.233 0.269 0 C-N-CA 122.336 2.024 . . . . 1.3 113.198 -172.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.12 7.21 46.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.438 -0.346 . . . . 1.97 111.202 -174.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.484 ' OH ' ' HB3' ' A' ' 111' ' ' ASN . 1.0 OUTLIER -59.16 -42.81 91.65 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.321 -0.4 . . . . 1.13 110.25 179.437 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -77.29 0.9 20.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.857 -0.61 . . . . 0.91 111.315 -175.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.9 mttp -97.99 -39.05 9.14 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.212 0.529 . . . . 2.86 110.327 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.6 mt -99.09 -39.73 8.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.941 -0.572 . . . . 1.0 110.766 -178.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 50.0 mm -97.3 124.89 50.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.893 -0.594 . . . . 0.75 110.171 -178.011 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.38 -17.24 30.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.342 -0.39 . . . . 1.99 111.262 -176.494 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -128.32 87.28 55.67 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-O 120.841 0.353 . . . . 2.05 110.343 177.658 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -71.36 90.51 0.68 Allowed 'Trans proline' 0 CA--C 1.528 0.203 0 C-N-CA 122.976 2.451 . . . . 0.89 111.938 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 4.0 mmt -122.33 150.49 42.31 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 121.471 0.653 . . . . 0.82 110.527 -178.375 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.586 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 1.0 OUTLIER -128.45 -119.69 0.24 Allowed 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.589 -1.187 . . . . 1.42 109.03 -177.255 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -134.03 -17.68 2.12 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.941 0.4 . . . . 0.8 110.628 174.654 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -86.99 -30.77 19.47 Favored Glycine 0 CA--C 1.502 -0.749 0 N-CA-C 109.72 -1.352 . . . . 0.32 109.72 -178.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.3 m -74.17 -26.87 60.54 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.662 -0.769 . . . . 0.95 110.159 172.328 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.6 mm -66.19 -57.41 10.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.856 -0.611 . . . . 0.97 109.766 175.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.16 -24.46 66.31 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.554 -0.748 . . . . 1.15 110.886 179.049 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.523 ' HG3' HG21 ' A' ' 26' ' ' VAL . 4.3 tppt? -63.17 -48.09 79.87 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 120.703 0.287 . . . . 2.46 110.565 178.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 11.7 mtp180 -67.77 -29.54 68.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.973 0.416 . . . . 1.16 110.818 -179.691 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 9.4 mt -72.07 -51.38 21.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.855 -0.611 . . . . 0.49 111.182 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -73.72 -19.86 60.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.819 0.342 . . . . 1.39 111.252 -176.539 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.491 ' ND2' ' HB3' ' A' ' 27' ' ' SER . 17.6 t30 -95.06 0.83 54.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.369 -0.378 . . . . 1.3 111.371 -179.087 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 56.25 65.7 1.37 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.394 0.616 . . . . 1.75 110.874 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' TYR . . . . . 0.719 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 26.6 t80 -80.41 -47.51 14.28 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 116.122 -0.49 . . . . 0.96 111.382 178.682 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.421 ' HB3' ' OE1' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -106.32 -173.95 2.42 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.664 0.745 . . . . 1.28 111.835 -174.311 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 96' ' ' TRP . . . . . 0.436 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 2.1 t90 -83.11 -45.29 14.14 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.298 -1.319 . . . . 1.05 110.159 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 46.1 t -149.49 173.67 13.34 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.47 -0.786 . . . . 1.0 110.002 -173.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.43 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -70.84 -8.55 53.43 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.398 -0.365 . . . . 0.66 111.264 -176.639 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -37.36 76.58 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.762 -0.654 . . . . 0.85 111.005 179.433 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.44 ' O ' ' HB3' ' A' ' 103' ' ' GLN . 3.1 tt0 -81.6 -30.7 32.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.05 -0.523 . . . . 2.44 110.718 -178.756 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 13.7 t -65.19 -22.74 66.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.205 0.526 . . . . 0.95 110.834 -178.32 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.26 -24.1 66.15 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.121 -0.49 . . . . 1.13 110.224 176.589 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.588 ' HG2' ' N ' ' A' ' 104' ' ' ASP . 0.0 OUTLIER -72.06 -51.38 21.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 2.96 110.445 179.158 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ASP . . . . . 0.588 ' N ' ' HG2' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -70.63 -36.45 73.44 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.269 -0.423 . . . . 1.87 110.475 -177.491 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.698 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -60.58 -51.47 69.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.946 -0.57 . . . . 0.38 110.485 174.859 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -58.97 -41.27 87.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.891 -0.595 . . . . 0.97 110.766 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 71.1 m -56.41 -48.5 76.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.88 -0.6 . . . . 0.43 110.943 179.545 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.46 -42.9 61.92 Favored 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.439 0.462 . . . . 0.88 111.5 178.324 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -72.34 -45.04 61.62 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.43 -0.35 . . . . 0.29 111.159 -176.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.71 -36.16 82.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.132 0.492 . . . . 0.66 110.55 178.425 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ASN . . . . . 0.484 ' HB3' ' OH ' ' A' ' 73' ' ' TYR . 25.1 m-20 -53.08 -51.91 60.31 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.314 -0.857 . . . . 1.84 111.05 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 43.8 t -60.26 -40.65 91.07 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.829 -0.623 . . . . 0.63 111.379 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -71.18 -26.84 63.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.475 -0.329 . . . . 0.81 111.528 -176.077 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 56.0 mt -92.65 -53.67 8.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.875 0.369 . . . . 0.55 111.708 -177.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -71.03 -35.49 72.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.294 -0.412 . . . . 1.22 111.355 -174.043 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 50.3 m-20 -101.42 166.0 10.97 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.925 0.393 . . . . 1.04 110.705 -174.546 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 1.7 mmpt? -78.68 140.86 59.44 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 115.947 -0.569 . . . . 3.47 110.188 178.543 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' PRO . . . . . 0.638 ' HA ' HG11 ' A' ' 123' ' ' VAL . 28.2 Cg_endo -65.49 -8.63 19.64 Favored 'Trans proline' 0 CA--C 1.531 0.361 0 C-N-CA 122.357 2.038 . . . . 0.96 112.541 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -103.01 4.18 37.03 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.375 -0.375 . . . . 1.23 111.251 177.516 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -76.5 154.45 34.63 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.628 -0.508 . . . . 1.34 109.628 178.672 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' ASP . . . . . 0.428 ' HB3' ' HB3' ' B' ' 315' ' ' ALY . 2.5 t70 -67.97 -33.29 74.36 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.972 -0.558 . . . . 1.44 110.205 -178.159 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.9 tp -63.27 -36.52 76.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 116.339 -0.391 . . . . 0.42 110.519 177.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.638 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.6 t -73.18 -43.31 57.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 N-CA-C 109.778 -0.453 . . . . 0.35 109.778 178.139 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.521 ' HA ' ' OE1' ' A' ' 127' ' ' GLN . 0.2 OUTLIER -61.63 -29.77 70.27 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.001 -0.545 . . . . 0.52 110.008 -179.466 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 125' ' ' MET . . . . . 0.466 ' HG2' ' CD2' ' A' ' 55' ' ' PHE . 46.7 mtt -80.63 -35.43 33.99 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.565 -0.743 . . . . 0.62 110.565 176.645 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.33 -36.81 76.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.021 -0.536 . . . . 0.31 111.592 -179.136 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' GLN . . . . . 0.521 ' OE1' ' HA ' ' A' ' 124' ' ' LEU . 18.9 mt-30 -61.22 -45.96 92.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.687 0.28 . . . . 1.94 110.638 179.319 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.85 -41.34 83.06 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.102 -0.499 . . . . 0.32 110.598 178.258 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.727 HD21 ' HA ' ' A' ' 56' ' ' ALA . 2.5 mp -58.78 -46.19 88.09 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.687 -0.688 . . . . 0.33 110.211 177.547 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -66.48 -30.05 70.29 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.672 -0.695 . . . . 1.47 111.061 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.1 OUTLIER -64.28 -43.33 95.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.221 -0.445 . . . . 2.24 110.285 -177.068 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.718 HD11 HD23 ' A' ' 50' ' ' LEU . 5.5 pt -79.93 -26.89 12.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.305 -0.407 . . . . 1.23 110.45 177.364 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.483 ' O ' HG23 ' A' ' 137' ' ' VAL . 37.7 t80 -59.57 -61.59 2.51 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.595 -0.275 . . . . 0.46 110.598 175.415 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 2.8 pp -65.03 -22.16 66.95 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.112 0.482 . . . . 0.64 110.442 -178.096 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.526 ' O ' ' HG3' ' A' ' 139' ' ' GLN . 0.8 OUTLIER -66.07 -54.09 30.17 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.596 -0.729 . . . . 1.61 109.979 177.572 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 4.7 mmtm -65.03 -33.71 76.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.61 -0.723 . . . . 1.52 110.692 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.485 ' O ' ' HB2' ' A' ' 140' ' ' MET . 78.7 t -67.16 -31.66 54.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.037 -0.529 . . . . 0.35 110.566 178.293 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.29 -19.52 64.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.058 0.456 . . . . 0.5 110.565 178.23 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' GLN . . . . . 0.526 ' HG3' ' O ' ' A' ' 135' ' ' GLN . 6.9 mt-30 -100.52 0.08 38.84 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.675 -0.693 . . . . 1.76 110.703 -178.787 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 140' ' ' MET . . . . . 0.485 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 0.2 OUTLIER -66.14 147.62 98.77 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.965 -0.561 . . . . 0.86 111.115 -179.411 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.416 ' C ' ' H ' ' A' ' 143' ' ' GLU . 59.9 Cg_endo -71.35 107.01 2.05 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 C-N-CA 122.557 2.171 . . . . 0.67 112.01 -176.192 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.04 14.93 0.46 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.172 0.511 . . . . 2.91 111.372 -178.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.416 ' H ' ' C ' ' A' ' 141' ' ' PRO . 0.5 OUTLIER -95.2 -40.22 9.69 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 115.74 -0.664 . . . . 2.7 109.774 178.082 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 52.8 tt0 55.24 70.06 0.67 Allowed 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.025 -0.989 . . . . 2.34 110.776 -179.045 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 1.7 t -94.6 132.34 38.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.111 -0.495 . . . . 0.99 110.241 -177.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.444 ' CD ' ' HE ' ' A' ' 34' ' ' ARG . 26.8 tt0 -78.21 146.0 35.22 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.739 0.304 . . . . 1.53 110.191 178.236 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 82.5 mt . . . . . 0 C--O 1.247 0.934 0 CA-C-O 118.626 -0.702 . . . . 1.57 110.118 -179.315 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.783 0 N-CA-C 111.618 -0.593 . . . . 2.17 111.618 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 125.68 -60.94 0.62 Allowed Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.785 -0.721 . . . . 1.97 111.415 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 179.06 115.0 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.198 -0.667 . . . . 3.58 109.198 175.35 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 315' ' ' ALY . . . . . 0.428 ' HB3' ' HB3' ' A' ' 121' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 11.2 mtmt . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.42 -0.8 . . . . 4.6 110.245 -177.94 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.476 0.451 0 N-CA-C 110.371 -0.665 . . . . 6.18 110.371 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.401 ' HG ' ' H ' ' A' ' 22' ' ' LEU . 0.3 OUTLIER -73.79 -167.27 0.45 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.42 -0.355 . . . . 5.71 111.08 179.682 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -75.97 77.52 1.31 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 121.016 -0.611 . . . . 3.45 112.892 -177.681 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 78.2 p -93.59 131.35 38.95 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 110.2 -0.296 . . . . 2.44 110.2 175.432 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.67 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 6.9 mt-10 -63.78 125.43 24.32 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.255 0.55 . . . . 1.64 111.812 -179.375 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 9.8 p -108.61 -16.97 8.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.269 -0.878 . . . . 0.93 109.879 176.616 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 33.7 m -161.55 138.26 8.4 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.369 -0.832 . . . . 1.61 109.263 -178.551 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -134.43 121.07 15.06 Favored Pre-proline 0 C--N 1.322 -0.615 0 N-CA-C 110.113 -0.328 . . . . 1.6 110.113 178.352 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -74.86 -37.28 2.2 Favored 'Trans proline' 0 N--CA 1.473 0.305 0 C-N-CA 123.414 2.743 . . . . 1.87 112.843 -178.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 16.3 m -69.46 -25.14 63.95 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 121.795 0.807 . . . . 2.18 109.64 179.4 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.4 ttmm -82.85 134.16 47.46 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 114.685 -1.143 . . . . 2.75 109.496 174.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.487 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 11.4 Cg_endo -56.06 133.76 60.01 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.02 1.813 . . . . 1.38 111.115 175.484 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -124.57 69.35 0.48 Allowed Glycine 0 N--CA 1.444 -0.818 0 CA-C-N 115.644 -0.707 . . . . 0.97 111.887 -171.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.424 ' HE ' ' CD ' ' A' ' 146' ' ' GLU . 0.9 OUTLIER -101.35 -179.13 3.94 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.307 -0.627 . . . . 1.93 109.307 178.37 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.51 ' O ' ' HG2' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -143.32 137.53 28.86 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.89 -0.411 . . . . 2.64 109.89 178.271 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.54 HG22 ' HG3' ' A' ' 146' ' ' GLU . 2.1 p -120.64 174.59 6.48 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.311 -0.404 . . . . 0.68 110.251 179.296 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 56.7 t-20 -50.34 -44.65 54.54 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.705 0.628 . . . . 1.47 110.158 175.558 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.434 ' HG2' ' SD ' ' A' ' 140' ' ' MET . 3.3 mt-30 -60.63 -43.1 97.9 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.227 -0.442 . . . . 1.04 110.836 179.204 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.41 ' HB2' ' H ' ' A' ' 36' ' ' THR . 1.9 tm? -55.02 -56.88 14.85 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.528 -0.76 . . . . 0.8 110.856 -178.731 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -70.88 -31.03 67.56 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.84 -0.618 . . . . 1.75 111.105 -178.426 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.528 ' CZ ' HG11 ' A' ' 45' ' ' VAL . 58.9 t80 -58.34 -63.72 1.17 Allowed 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.814 -0.63 . . . . 0.64 111.42 -179.505 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.607 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.3 OUTLIER -60.1 -30.69 69.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.618 0.247 . . . . 1.13 111.039 -172.427 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -62.29 -53.17 58.99 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.038 -0.528 . . . . 1.3 111.317 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.469 ' O ' ' HB2' ' A' ' 48' ' ' LYS . 50.3 m-80 -87.94 -29.49 20.77 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.932 0.396 . . . . 0.5 112.048 -177.579 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.528 HG11 ' CZ ' ' A' ' 41' ' ' TYR . 92.7 t -89.26 -58.66 3.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 N-CA-C 112.559 0.578 . . . . 0.3 112.559 -175.814 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.673 HG22 ' HB3' ' A' ' 136' ' ' LYS . 61.3 t -77.54 -65.12 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 C-N-CA 120.977 -0.289 . . . . 0.26 111.579 -169.246 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.474 HG12 ' O ' ' A' ' 42' ' ' MET . 1.6 p -66.51 -34.19 68.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 C-N-CA 120.512 -0.475 . . . . 0.83 111.546 -174.785 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -62.86 -35.46 80.05 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 120.559 -0.457 . . . . 2.4 111.457 177.826 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 22.8 m -77.35 -39.28 48.11 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.858 -0.337 . . . . 0.55 110.79 177.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.648 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -60.72 -37.97 83.49 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.221 0.534 . . . . 0.33 109.699 176.24 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 16.6 t-105 -63.78 -30.18 71.31 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.231 -0.895 . . . . 0.39 111.626 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.9 mttm -83.16 -5.94 59.3 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.197 0.443 . . . . 2.24 112.197 -173.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.405 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 3.7 t-80 -74.73 131.72 41.06 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.546 -0.539 . . . . 0.39 109.546 176.19 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -76.79 -11.87 59.9 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.591 -0.277 . . . . 1.91 111.397 -175.176 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.405 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 1.5 m-30 -92.87 -2.54 55.78 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.11 0.481 . . . . 0.93 110.14 176.281 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.781 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -96.78 14.26 25.76 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.111 -0.495 . . . . 0.28 110.596 179.245 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.52 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 47.6 p-90 -66.37 -33.2 6.29 Favored Pre-proline 0 CA--C 1.546 0.811 0 N-CA-C 114.016 1.117 . . . . 0.58 114.016 -174.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.52 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 11.7 Cg_exo -71.94 -2.05 10.92 Favored 'Trans proline' 0 C--N 1.361 1.228 0 C-N-CA 121.443 1.429 . . . . 0.47 112.328 178.825 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -111.19 15.73 21.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.272 -0.422 . . . . 1.11 110.632 -178.431 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.45 ' CE2' ' HA ' ' A' ' 57' ' ' TRP . 18.3 m-30 -83.21 -12.07 57.22 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.051 -0.522 . . . . 0.63 110.699 179.261 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.71 135.28 27.11 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.205 -0.452 . . . . 1.63 110.306 -177.919 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -71.47 147.3 51.9 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 122.718 2.279 . . . . 0.87 112.599 -177.648 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.419 HG21 ' CZ ' ' A' ' 73' ' ' TYR . 2.6 t -70.38 105.92 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.525 0 CA-C-O 121.931 0.872 . . . . 0.88 110.326 176.74 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.458 ' HB3' ' HB3' ' A' ' 67' ' ' LYS . 12.0 t70 -116.07 131.1 57.04 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 107.601 -1.259 . . . . 1.85 107.601 166.348 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.14 -16.11 61.18 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.317 -0.401 . . . . 1.29 111.462 -173.241 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.9 mt -97.42 -44.08 12.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.031 0.443 . . . . 1.89 110.663 177.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.458 ' HB3' ' HB3' ' A' ' 64' ' ' ASP . 14.8 tptm -66.0 -48.41 71.29 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.729 -0.669 . . . . 2.99 111.587 -177.019 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -101.8 1.74 37.53 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.502 -0.317 . . . . 1.66 110.701 -177.137 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 47.7 t30 58.23 55.06 5.32 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.868 -0.605 . . . . 1.74 111.332 178.436 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.0 mt -123.37 70.67 44.7 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 115.892 -0.595 . . . . 1.61 111.269 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.98 -19.78 22.77 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.158 1.905 . . . . 1.3 111.441 178.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -77.46 -16.44 58.76 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.322 -0.854 . . . . 1.97 110.557 -179.756 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.419 ' CZ ' HG21 ' A' ' 63' ' ' VAL . 0.8 OUTLIER -61.27 -38.17 85.77 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.371 -0.831 . . . . 1.13 111.732 -176.412 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 8.1 m-70 -83.43 -0.79 51.58 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.083 -0.508 . . . . 0.91 111.303 -169.511 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.5 mtpt -93.02 -21.51 19.7 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.141 0.496 . . . . 2.86 109.815 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mt -114.53 -49.28 5.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.51 -0.768 . . . . 1.0 111.001 -178.346 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.452 HG22 ' H ' ' A' ' 79' ' ' ASN . 33.9 mm -99.87 123.12 52.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.058 0.456 . . . . 0.75 110.44 -178.121 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.37 -9.25 51.05 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.985 -0.552 . . . . 1.99 110.891 -177.463 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.452 ' H ' HG22 ' A' ' 77' ' ' ILE . 0.2 OUTLIER -134.6 80.31 51.04 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.9 -0.591 . . . . 2.05 110.743 -179.414 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -70.7 94.7 0.61 Allowed 'Trans proline' 0 CA--C 1.529 0.26 0 C-N-CA 122.478 2.119 . . . . 0.89 112.219 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -128.13 159.78 34.07 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.167 0.508 . . . . 0.82 110.981 -176.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.2 p-10 -135.93 -126.45 0.15 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.929 -1.032 . . . . 1.42 109.742 -175.021 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.4 ttm -122.76 -18.1 6.64 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.43 -0.581 . . . . 0.8 109.43 177.116 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.432 ' HA2' ' HG2' ' A' ' 87' ' ' LYS . . . -82.13 -35.74 20.15 Favored Glycine 0 N--CA 1.44 -1.036 0 N-CA-C 109.808 -1.317 . . . . 0.32 109.808 179.484 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.8 m -72.36 -31.64 65.78 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.236 -0.482 . . . . 0.95 110.621 174.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.5 HD12 ' HB2' ' A' ' 104' ' ' ASP . 0.2 OUTLIER -64.67 -53.29 44.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 109.145 -0.687 . . . . 0.97 109.145 177.454 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.432 ' HG2' ' HA2' ' A' ' 84' ' ' GLY . 0.2 OUTLIER -65.39 -26.18 67.88 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.896 -0.593 . . . . 1.15 110.737 179.384 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.01 -47.21 81.19 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-O 120.81 0.338 . . . . 2.46 110.54 179.124 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 9.5 mtp180 -67.81 -31.59 71.55 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.23 -0.441 . . . . 1.16 110.619 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.3 mt -68.43 -52.27 34.57 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.061 -0.518 . . . . 0.49 111.254 178.458 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -75.66 -18.82 59.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.36 -0.382 . . . . 1.39 111.822 -175.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -95.27 0.05 53.44 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.749 0.309 . . . . 1.3 110.411 178.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 56.58 66.48 1.18 Allowed 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.614 -0.721 . . . . 1.75 110.921 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' TYR . . . . . 0.67 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 11.3 t80 -70.76 -57.76 4.32 Favored 'General case' 0 CA--C 1.512 -0.483 0 CA-C-O 121.765 0.793 . . . . 0.96 110.725 175.44 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -103.7 -177.88 3.5 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 114.268 -1.333 . . . . 1.28 112.074 -173.901 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' TRP . . . . . 0.487 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 2.3 t-105 -79.89 -44.61 20.12 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.444 -1.253 . . . . 1.05 110.647 -177.217 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 14.5 t -146.68 175.37 10.65 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.994 -0.548 . . . . 1.0 110.971 -173.636 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.15 -14.54 60.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.253 -0.43 . . . . 0.66 111.083 -176.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.12 -31.22 68.74 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.479 0.657 . . . . 0.85 109.869 174.469 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.64 -39.31 45.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.365 -0.834 . . . . 2.44 110.228 177.012 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 31.7 t -62.85 -22.62 66.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.595 -0.729 . . . . 0.95 110.586 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 5.4 mtt -58.97 -21.1 57.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.89 -0.595 . . . . 1.13 110.646 175.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -76.27 -55.94 5.1 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 116.38 -0.373 . . . . 2.96 110.328 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ASP . . . . . 0.5 ' HB2' HD12 ' A' ' 86' ' ' ILE . 0.1 OUTLIER -67.07 -40.62 87.07 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.361 -0.381 . . . . 1.87 111.224 -176.21 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.648 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -59.24 -45.32 91.45 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.129 0.49 . . . . 0.38 110.548 176.623 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -64.72 -43.96 91.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.847 -0.615 . . . . 0.97 110.336 178.324 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' THR . . . . . 0.467 ' O ' ' HB3' ' A' ' 111' ' ' ASN . 57.3 m -53.98 -46.58 71.73 Favored 'General case' 0 C--N 1.332 -0.157 0 O-C-N 123.76 0.663 . . . . 0.43 111.31 -178.403 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -52.83 -40.29 63.21 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.12 -0.491 . . . . 0.88 111.07 178.195 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -74.85 -50.53 16.72 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.303 -0.408 . . . . 0.29 111.512 -177.447 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.28 -43.47 97.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.926 0.393 . . . . 0.66 111.058 -177.041 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ASN . . . . . 0.467 ' HB3' ' O ' ' A' ' 107' ' ' THR . 0.1 OUTLIER -51.76 -44.31 63.31 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.386 -0.825 . . . . 1.84 111.252 179.229 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.83 -36.01 82.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.402 -0.363 . . . . 0.63 110.842 -178.535 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -71.85 -24.32 61.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.252 -0.431 . . . . 0.81 111.395 -178.006 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 25.2 mt -89.84 -49.11 14.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.361 -0.381 . . . . 0.55 111.226 -177.386 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 88.0 t80 -69.22 -32.11 71.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.442 . . . . 1.22 111.461 -175.005 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 54.1 m-80 -108.15 169.62 8.51 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.126 0.489 . . . . 1.04 111.531 -173.016 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 11.2 mmtt -82.53 149.45 61.02 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.672 -0.694 . . . . 3.47 109.969 177.845 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' PRO . . . . . 0.568 ' HA ' HG11 ' A' ' 123' ' ' VAL . 34.2 Cg_endo -66.23 -9.6 24.26 Favored 'Trans proline' 0 CA--C 1.53 0.319 0 C-N-CA 122.576 2.184 . . . . 0.96 112.848 -177.557 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -111.53 27.67 9.46 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.822 0.344 . . . . 1.23 111.269 179.605 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' ASP . . . . . 0.471 ' OD2' HG22 ' A' ' 122' ' ' ILE . 8.6 t70 -99.85 164.58 11.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 1.34 110.705 178.255 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -64.26 -49.16 72.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.834 -0.621 . . . . 1.44 110.417 -178.632 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ILE . . . . . 0.471 HG22 ' OD2' ' A' ' 120' ' ' ASP . 3.4 tp -61.45 -35.95 70.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.12 -0.491 . . . . 0.42 111.054 -175.517 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.568 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.4 t -70.4 -47.1 67.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 121.001 0.429 . . . . 0.35 110.157 177.682 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.2 mt -60.91 -35.25 76.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.726 -0.67 . . . . 0.52 110.238 -179.052 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 29.6 mtt -73.2 -43.36 61.46 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.757 -0.656 . . . . 0.62 110.619 179.118 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.97 -35.22 68.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.239 -0.437 . . . . 0.31 111.491 -179.522 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -62.89 -42.65 99.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.275 -0.42 . . . . 1.94 111.007 179.023 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -77.06 -39.73 48.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 0.32 110.518 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.781 HD21 ' HA ' ' A' ' 56' ' ' ALA . 2.3 mp -57.49 -39.74 77.09 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.483 -0.78 . . . . 0.33 110.757 178.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.6 -26.63 68.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.706 -0.679 . . . . 1.47 111.527 -177.68 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.498 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 27.6 mttt -64.9 -35.97 82.87 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.887 -0.412 . . . . 2.24 109.887 -179.64 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.464 ' H ' HG13 ' A' ' 132' ' ' ILE . 2.5 mt -74.77 -30.51 24.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.735 -0.666 . . . . 1.23 110.393 178.629 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.476 ' O ' HG23 ' A' ' 137' ' ' VAL . 49.5 t80 -59.29 -61.84 2.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.88 -0.6 . . . . 0.46 110.153 177.434 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.02 -30.07 71.32 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.102 0.477 . . . . 0.64 110.534 -178.861 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.498 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -59.49 -31.6 69.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.469 -0.787 . . . . 1.61 112.173 -180.0 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 136' ' ' LYS . . . . . 0.673 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -99.72 -22.32 15.43 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.072 0.463 . . . . 1.52 110.444 -179.504 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.648 ' O ' ' HB2' ' A' ' 140' ' ' MET . 56.1 t -77.92 -31.9 17.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.63 -0.714 . . . . 0.35 110.436 -179.329 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.24 -18.27 64.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.167 0.508 . . . . 0.5 110.419 178.342 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' GLN . . . . . 0.471 ' HB2' ' OH ' ' A' ' 41' ' ' TYR . 1.9 mt-30 -98.18 2.8 48.82 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.633 -0.712 . . . . 1.76 110.324 179.487 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 140' ' ' MET . . . . . 0.648 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 1.6 mtt -67.39 147.68 98.81 Favored Pre-proline 0 C--O 1.233 0.219 0 CA-C-N 115.874 -0.603 . . . . 0.86 110.667 177.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.31 105.7 2.09 Favored 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.222 1.948 . . . . 0.67 111.508 175.818 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.04 8.37 2.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.083 0.468 . . . . 2.91 111.487 -174.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -91.06 -38.82 12.55 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.846 -0.616 . . . . 2.7 109.864 178.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 61.8 91.31 0.06 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 114.647 -1.161 . . . . 2.34 110.641 -177.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 10.3 t -111.08 126.27 68.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 115.897 -0.592 . . . . 0.99 109.532 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.54 ' HG3' HG22 ' A' ' 36' ' ' THR . 4.1 tt0 -71.64 149.23 45.77 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.993 0.425 . . . . 1.53 111.135 -177.443 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 16.0 mt . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.881 -0.58 . . . . 1.57 110.555 -178.245 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.772 0 N-CA-C 111.725 -0.55 . . . . 2.17 111.725 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 118.41 -47.98 0.98 Allowed Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.806 -0.712 . . . . 1.97 111.735 178.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 1.8 tpmp? -157.23 123.73 4.96 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.845 0.355 . . . . 3.58 110.222 177.477 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 315' ' ' ALY . . . . . 0.422 ' NZ ' ' HB3' ' A' ' 58' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 8.2 mmtm . . . . . 0 C--O 1.244 0.766 0 CA-C-O 118.547 -0.74 . . . . 4.6 109.993 -179.082 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo . . . . . 0 N--CA 1.479 0.646 0 N-CA-C 110.202 -0.73 . . . . 6.18 110.202 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.436 ' H ' ' HG ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -106.83 111.99 24.75 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.002 0.43 . . . . 5.71 110.614 179.129 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.85 -88.58 1.06 Allowed Glycine 0 N--CA 1.452 -0.293 0 CA-C-N 115.77 -0.65 . . . . 3.45 112.16 179.727 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.8 p -137.69 141.74 41.09 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.516 -0.549 . . . . 2.44 109.516 176.599 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.658 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 5.2 mt-10 -49.31 116.28 1.65 Allowed 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.415 0.626 . . . . 1.64 112.144 178.157 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.3 p -101.94 -6.23 9.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 115.461 -0.79 . . . . 0.93 109.522 176.425 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 70.8 m -160.83 145.85 14.22 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 114.963 -1.017 . . . . 1.61 109.73 178.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.479 ' HB3' ' HB2' ' A' ' 31' ' ' LYS . 24.8 t-20 -146.57 126.85 6.93 Favored Pre-proline 0 C--N 1.316 -0.852 0 N-CA-C 108.765 -0.828 . . . . 1.6 108.765 175.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -61.81 -46.13 14.72 Favored 'Trans proline' 0 N--CA 1.474 0.374 0 C-N-CA 123.241 2.628 . . . . 1.87 113.305 -175.024 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 6.1 m -77.55 -22.74 50.56 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.212 0.529 . . . . 2.18 110.927 -177.045 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.479 ' HB2' ' HB3' ' A' ' 28' ' ' ASN . 9.3 tttm -77.22 124.77 87.12 Favored Pre-proline 0 C--N 1.321 -0.665 0 CA-C-N 115.393 -0.821 . . . . 2.75 111.231 -177.624 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.403 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 6.0 Cg_exo -76.09 151.57 34.87 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.538 2.159 . . . . 1.38 111.975 175.754 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -136.85 136.06 8.09 Favored Glycine 0 N--CA 1.443 -0.86 0 N-CA-C 110.366 -1.094 . . . . 0.97 110.366 177.177 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.98 166.19 22.96 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.187 0.517 . . . . 1.93 111.361 -176.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -115.23 70.13 0.74 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.32 -0.854 . . . . 2.64 109.483 -179.593 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.68 HG22 ' HG3' ' A' ' 146' ' ' GLU . 2.6 p -89.0 170.02 11.02 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.84 -0.344 . . . . 0.68 110.726 -177.414 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.506 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 67.2 t30 -59.55 -47.34 85.95 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 115.939 -0.573 . . . . 1.47 110.406 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -56.0 -46.58 78.68 Favored 'General case' 0 C--O 1.233 0.231 0 O-C-N 123.296 0.373 . . . . 1.04 110.821 179.723 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.91 -59.61 5.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.103 -0.498 . . . . 0.8 111.355 -178.248 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -65.55 -28.26 69.03 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.088 -0.505 . . . . 1.75 110.613 -177.289 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.561 ' CE1' ' HG2' ' A' ' 140' ' ' MET . 36.3 t80 -60.89 -63.34 1.33 Allowed 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.172 -0.467 . . . . 0.64 110.974 176.736 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.526 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.2 OUTLIER -63.82 -28.45 69.87 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.736 -0.385 . . . . 1.13 110.648 -172.436 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.651 ' HB2' HD22 ' A' ' 90' ' ' LEU . 4.1 tt0 -66.08 -50.58 63.62 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.86 -0.609 . . . . 1.3 110.743 178.907 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.9 m-80 -86.53 -31.1 21.45 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 111.99 0.367 . . . . 0.5 111.99 -177.52 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 99.4 t -89.34 -58.47 3.47 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.924 0 N-CA-C 112.446 0.536 . . . . 0.3 112.446 -176.586 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.69 HG22 ' HB3' ' A' ' 136' ' ' LYS . 71.3 t -77.23 -66.14 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.337 -0.392 . . . . 0.26 111.685 -169.15 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.452 HG11 HD13 ' A' ' 90' ' ' LEU . 1.8 p -65.83 -36.05 76.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 C-N-CA 120.531 -0.468 . . . . 0.83 111.588 -175.185 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 7.8 mttt -63.05 -39.61 95.25 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.343 -0.543 . . . . 2.4 111.496 178.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.605 HG21 ' HE2' ' A' ' 136' ' ' LYS . 90.2 m -69.75 -39.33 76.8 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.729 0.299 . . . . 0.55 110.801 177.554 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.639 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -64.28 -40.29 95.65 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 109.724 -0.473 . . . . 0.33 109.724 176.391 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 51' ' ' TRP . . . . . 0.427 ' CE3' ' HE3' ' A' ' 83' ' ' MET . 15.5 t-105 -62.87 -35.91 81.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.541 -0.754 . . . . 0.39 111.025 177.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -81.68 9.59 7.51 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.412 -0.358 . . . . 2.24 111.873 -177.21 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.401 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 10.8 t-80 -90.05 126.46 35.78 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.299 -0.63 . . . . 0.39 109.299 173.276 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -81.97 15.46 2.28 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 112.114 0.412 . . . . 1.91 112.114 -173.279 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.401 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.3 OUTLIER -111.43 -5.3 14.62 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.205 -0.665 . . . . 0.93 109.205 171.524 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.634 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -95.57 16.93 15.83 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.579 -0.737 . . . . 0.28 110.613 179.681 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.517 ' CG ' ' HD3' ' A' ' 58' ' ' PRO . 57.9 p-90 -67.28 -35.16 8.07 Favored Pre-proline 0 CA--C 1.54 0.593 0 N-CA-C 113.527 0.936 . . . . 0.58 113.527 -175.366 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.517 ' HD3' ' CG ' ' A' ' 57' ' ' TRP . 2.9 Cg_exo -76.17 2.82 6.77 Favored 'Trans proline' 0 C--N 1.361 1.223 0 C-N-CA 121.445 1.43 . . . . 0.47 111.425 175.314 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -107.2 -4.85 18.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.396 -0.82 . . . . 1.11 110.687 -178.716 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.0 m-30 -71.15 -29.1 64.8 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.315 -0.402 . . . . 0.63 111.748 -176.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.75 123.39 45.88 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-N 116.269 -0.423 . . . . 1.63 111.203 -172.512 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.683 ' HB3' HG23 ' A' ' 85' ' ' THR . 25.0 Cg_exo -61.56 144.65 97.88 Favored 'Trans proline' 0 C--O 1.238 0.481 0 C-N-CA 122.686 2.258 . . . . 0.87 112.314 178.164 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 4.0 t -80.69 111.49 17.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-O 121.661 0.743 . . . . 0.88 110.633 -179.665 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.451 ' HB3' ' HG2' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -111.51 -0.09 16.31 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.043 -0.98 . . . . 1.85 109.478 177.488 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.498 ' HB2' ' NE2' ' A' ' 74' ' ' HIS . . . 78.38 -55.66 0.48 Allowed 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 114.762 -1.108 . . . . 1.29 111.5 -177.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.7 mp -80.41 -44.32 21.99 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 O-C-N 122.177 -0.327 . . . . 1.89 111.749 -173.142 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.451 ' HG2' ' HB3' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -64.03 -31.04 72.09 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.594 0.22 . . . . 2.99 111.594 -177.424 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.451 ' HB3' HD22 ' A' ' 70' ' ' LEU . 5.0 tp -109.81 3.61 20.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.643 0.258 . . . . 1.66 111.601 -176.482 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 58.85 59.52 2.81 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.361 0.6 . . . . 1.74 111.236 179.287 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.451 HD22 ' HB3' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -124.7 72.96 62.12 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 115.222 -0.899 . . . . 1.61 109.625 178.051 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -74.49 -58.83 0.05 OUTLIER 'Trans proline' 0 CA--C 1.531 0.34 0 C-N-CA 121.952 1.768 . . . . 1.3 112.928 -174.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -79.83 6.77 10.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.387 0.613 . . . . 1.97 111.019 -176.445 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -61.04 -38.42 86.08 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.233 -0.894 . . . . 1.13 110.613 177.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.498 ' NE2' ' HB2' ' A' ' 65' ' ' ALA . 5.1 m-70 -80.25 -0.4 36.24 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.461 -0.79 . . . . 0.91 111.404 -175.764 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.2 mmtp -94.47 -44.24 7.98 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.658 -0.497 . . . . 2.86 109.658 -179.032 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 14.0 mt -82.99 -47.18 18.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.807 -0.633 . . . . 1.0 110.807 179.374 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.6 mm -93.53 133.64 33.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.167 -0.47 . . . . 0.75 110.056 -178.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.55 -36.28 24.12 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.136 -0.484 . . . . 1.99 110.54 -177.161 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -119.56 88.88 39.82 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 115.771 -0.65 . . . . 2.05 110.279 -179.713 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -74.46 80.57 2.24 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 122.857 2.371 . . . . 0.89 112.297 -178.35 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.63 176.52 5.14 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.358 0.599 . . . . 0.82 111.158 -178.442 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.571 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 4.4 p-10 -154.32 -129.08 0.03 OUTLIER 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 114.763 -1.108 . . . . 1.42 108.96 -172.254 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' MET . . . . . 0.469 ' SD ' HD13 ' A' ' 50' ' ' LEU . 6.7 ttp -124.69 -16.8 6.12 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.245 0.545 . . . . 0.8 110.242 -177.875 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -90.05 -29.47 15.09 Favored Glycine 0 N--CA 1.44 -1.044 0 N-CA-C 110.455 -1.058 . . . . 0.32 110.455 -178.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.683 HG23 ' HB3' ' A' ' 62' ' ' PRO . 0.7 OUTLIER -70.06 -42.65 72.55 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 121.258 0.552 . . . . 0.95 110.373 177.185 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 48.8 mt -61.95 -44.1 98.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.249 -0.887 . . . . 0.97 109.944 175.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.73 -34.56 76.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.838 -0.619 . . . . 1.15 111.44 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.0 mtpt -62.1 -49.09 77.31 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.393 0.616 . . . . 2.46 110.518 179.345 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 32.5 mtp180 -66.69 -29.38 69.36 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.382 -0.827 . . . . 1.16 111.314 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.651 HD22 ' HB2' ' A' ' 43' ' ' GLN . 6.3 mt -70.18 -51.67 29.35 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.297 -0.41 . . . . 0.49 110.883 177.917 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -73.68 -17.45 61.14 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.142 -0.481 . . . . 1.39 111.695 -175.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 14.4 t30 -100.94 1.32 39.69 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 121.028 -0.269 . . . . 1.3 110.825 178.496 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 54.77 58.92 4.41 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.937 -0.574 . . . . 1.75 111.184 178.149 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' TYR . . . . . 0.658 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 43.5 t80 -76.51 -28.56 56.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.167 -0.47 . . . . 0.96 111.283 -178.603 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -117.36 179.76 3.95 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.119 0.485 . . . . 1.28 111.217 -177.537 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' TRP . . . . . 0.403 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 2.1 t-105 -81.34 -44.47 17.57 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.282 -0.872 . . . . 1.05 110.771 -177.071 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 36.5 t -148.12 -179.6 7.04 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.034 -0.53 . . . . 1.0 111.166 -172.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.45 -18.05 60.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.067 -0.515 . . . . 0.66 111.196 -176.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.38 -29.43 67.7 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.319 0.581 . . . . 0.85 110.195 177.322 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -82.34 -24.64 34.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.508 -0.769 . . . . 2.44 110.265 -179.488 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 9.6 t -83.42 -30.57 27.2 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.528 -0.76 . . . . 0.95 110.876 -178.753 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 8.8 ttm -59.01 -33.8 71.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.802 -0.635 . . . . 1.13 111.532 -177.5 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.48 -45.51 87.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.165 -0.471 . . . . 2.96 110.611 -179.54 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.26 -38.05 71.9 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.328 -0.396 . . . . 1.87 110.316 -179.422 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.639 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -57.97 -43.97 86.81 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.856 -0.611 . . . . 0.38 110.802 178.466 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 31.0 t30 -66.53 -46.29 76.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.973 -0.558 . . . . 0.97 110.08 176.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 94.2 m -57.14 -41.38 79.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.787 -0.642 . . . . 0.43 111.859 -179.234 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -54.25 -35.09 62.13 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 120.792 0.33 . . . . 0.88 111.141 177.762 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -78.97 -49.58 12.53 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.233 -0.439 . . . . 0.29 110.753 -177.626 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.77 -42.85 89.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.352 -0.385 . . . . 0.66 110.876 179.759 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -51.6 -47.1 63.73 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.589 -0.732 . . . . 1.84 111.002 178.017 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 4.4 t -62.32 -44.82 95.6 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 120.765 0.316 . . . . 0.63 110.938 177.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -65.41 -34.2 77.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.295 -0.411 . . . . 0.81 111.613 -177.421 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 54.4 mt -80.48 -52.77 13.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.468 -0.333 . . . . 0.55 111.701 -176.147 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 93.0 t80 -64.77 -35.49 81.25 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.865 0.364 . . . . 1.22 111.156 -175.179 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 -99.8 -175.98 3.13 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.084 -0.507 . . . . 1.04 110.552 -175.539 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.578 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 0.2 OUTLIER -93.33 150.73 39.5 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 109.469 -0.567 . . . . 3.47 109.469 176.161 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 118' ' ' PRO . . . . . 0.403 ' HA ' HG11 ' A' ' 123' ' ' VAL . 38.2 Cg_exo -62.9 -15.35 46.81 Favored 'Trans proline' 0 N--CA 1.471 0.174 0 C-N-CA 122.29 1.993 . . . . 0.96 112.141 177.463 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.88 16.63 24.89 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.6 -0.727 . . . . 1.23 110.927 177.474 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' ASP . . . . . 0.578 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 0.2 OUTLIER -80.04 159.01 26.34 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 120.884 0.373 . . . . 1.34 110.569 -178.752 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 121' ' ' ASP . . . . . 0.432 ' HB2' ' O ' ' B' ' 313' ' ' GLY . 4.9 m-20 -68.01 -46.72 70.47 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.726 -0.67 . . . . 1.44 110.666 -177.856 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -62.69 -37.83 80.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.123 -0.489 . . . . 0.42 110.634 179.232 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.403 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.3 t -66.12 -42.19 90.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.009 0.433 . . . . 0.35 110.252 178.703 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -33.38 72.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.843 -0.617 . . . . 0.52 109.878 179.909 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' MET . . . . . 0.458 ' O ' HD13 ' A' ' 129' ' ' LEU . 11.9 mtt -75.06 -47.47 28.73 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.403 -0.817 . . . . 0.62 110.515 177.001 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -55.9 -37.91 69.51 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.11 -0.495 . . . . 0.31 111.358 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -59.03 -41.4 87.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.979 -0.555 . . . . 1.94 111.043 178.268 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -76.17 -38.89 56.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.027 0.442 . . . . 0.32 110.602 178.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.634 HD21 ' HA ' ' A' ' 56' ' ' ALA . 2.3 mp -57.31 -41.76 80.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.566 -0.743 . . . . 0.33 110.399 177.787 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -61.27 -26.28 67.66 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.281 -0.872 . . . . 1.47 112.106 -176.676 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.534 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 49.4 mttm -62.64 -45.78 91.27 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 120.751 0.31 . . . . 2.24 110.38 -175.623 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.443 HD12 HD23 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -77.48 -21.89 14.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.185 -0.462 . . . . 1.23 110.903 -179.601 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.544 ' O ' HG23 ' A' ' 137' ' ' VAL . 22.0 t80 -63.43 -61.98 1.98 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.652 -0.249 . . . . 0.46 110.516 177.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.0 -27.2 67.95 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.115 0.484 . . . . 0.64 110.219 -178.386 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.534 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -58.87 -56.74 18.34 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.173 -0.922 . . . . 1.61 110.865 174.384 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 136' ' ' LYS . . . . . 0.69 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -66.67 -30.29 70.51 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.92 -0.582 . . . . 1.52 110.867 -177.761 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 133' ' ' PHE . 83.2 t -66.53 -34.8 72.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.146 -0.479 . . . . 0.35 110.229 176.311 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -70.84 -15.32 62.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.163 -0.472 . . . . 0.5 111.019 179.477 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' GLN . . . . . 0.479 ' HG3' ' O ' ' A' ' 135' ' ' GLN . 11.1 mt-30 -98.25 -6.38 31.24 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.398 -0.364 . . . . 1.76 110.596 177.816 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 140' ' ' MET . . . . . 0.561 ' HG2' ' CE1' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -66.12 159.21 72.7 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.086 -0.507 . . . . 0.86 110.453 -179.927 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -74.65 116.95 4.77 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 121.479 1.452 . . . . 0.67 110.366 174.707 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 -71.34 -2.78 17.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.514 0.673 . . . . 2.91 110.391 -178.471 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.6 -130.92 0.21 Allowed 'General case' 0 N--CA 1.432 -1.371 0 CA-C-N 114.768 -1.105 . . . . 2.7 108.861 179.843 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 178.8 132.5 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.08 -0.711 . . . . 2.34 109.08 169.641 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 2.4 t -131.66 114.45 25.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.305 -0.407 . . . . 0.99 110.118 -179.49 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.68 ' HG3' HG22 ' A' ' 36' ' ' THR . 15.8 tt0 -76.09 134.21 40.09 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 110.221 -0.288 . . . . 1.53 110.221 179.397 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 4.3 mt . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.647 -0.692 . . . . 1.57 110.346 -179.195 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.666 0 N-CA-C 111.076 -0.809 . . . . 2.17 111.076 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 313' ' ' GLY . . . . . 0.432 ' O ' ' HB2' ' A' ' 121' ' ' ASP . . . 102.9 -76.41 0.3 Allowed Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.517 -0.849 . . . . 1.97 112.425 178.564 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -94.6 120.56 35.02 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.812 0.339 . . . . 3.58 110.565 -174.559 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.961 0 N-CA-C 109.225 -0.658 . . . . 4.6 109.225 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo . . . . . 0 N--CA 1.481 0.736 0 N-CA-C 109.457 -1.017 . . . . 6.18 109.457 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.53 73.56 5.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.264 0.554 . . . . 5.71 109.976 176.708 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 167.04 79.71 0.04 OUTLIER Glycine 0 N--CA 1.444 -0.79 0 CA-C-N 115.554 -0.748 . . . . 3.45 111.353 -177.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 3.1 m -117.82 134.53 54.83 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.129 0.49 . . . . 2.44 110.783 179.637 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.459 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 2.7 mt-10 -64.5 152.79 40.83 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.288 -0.869 . . . . 1.64 112.319 -178.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.1 p -122.94 -2.69 7.2 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 114.911 -1.04 . . . . 0.93 109.329 174.205 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.2 m -169.87 143.37 2.58 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.706 -1.134 . . . . 1.61 108.514 178.441 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -151.91 140.21 13.33 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-O 120.555 0.216 . . . . 1.6 110.527 -178.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -70.76 -45.15 1.12 Allowed 'Trans proline' 0 N--CA 1.475 0.439 0 C-N-CA 123.193 2.595 . . . . 1.87 113.323 177.657 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.7 m -74.8 -28.34 60.68 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 121.206 0.527 . . . . 2.18 110.389 -176.297 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -86.31 114.84 59.61 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 115.488 -0.778 . . . . 2.75 109.015 174.347 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.498 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 5.9 Cg_exo -66.66 148.11 82.64 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 121.651 1.567 . . . . 1.38 111.812 -176.84 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -144.81 119.51 1.26 Allowed Glycine 0 N--CA 1.44 -1.045 0 N-CA-C 110.638 -0.985 . . . . 0.97 110.638 -179.194 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.3 mmm-85 -134.52 171.51 14.21 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.861 -0.422 . . . . 1.93 109.861 -176.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.472 ' HA ' HD22 ' A' ' 39' ' ' LEU . 26.7 ttpt -111.1 98.56 7.62 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.649 -0.5 . . . . 2.64 109.649 -179.124 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.695 HG22 ' HG3' ' A' ' 146' ' ' GLU . 2.8 p -106.15 167.25 9.94 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.748 0.309 . . . . 0.68 111.366 -178.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.572 ' HB3' ' O ' ' A' ' 145' ' ' VAL . 0.1 OUTLIER -66.78 -35.52 80.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.096 -0.502 . . . . 1.47 110.781 -179.582 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -70.32 -38.87 75.02 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.894 0.378 . . . . 1.04 110.34 176.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.827 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.5 OUTLIER -62.88 -52.63 62.37 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.003 -0.544 . . . . 0.8 110.339 178.253 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.95 -20.88 65.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.008 -0.542 . . . . 1.75 111.134 -179.416 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.57 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 43.4 t80 -68.31 -63.47 1.05 Allowed 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.741 -0.663 . . . . 0.64 111.33 179.851 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.551 ' HA ' HG23 ' A' ' 46' ' ' VAL . 1.5 ttm -60.37 -33.85 73.04 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 111.978 0.362 . . . . 1.13 111.978 -170.101 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.557 ' HG2' ' O ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -63.01 -48.91 76.75 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.154 0.502 . . . . 1.3 110.585 -175.423 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.544 ' O ' ' HB2' ' A' ' 48' ' ' LYS . 69.7 m-80 -85.79 -31.29 22.41 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.835 -0.621 . . . . 0.5 111.537 -178.312 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 88.3 t -89.01 -59.72 2.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 112.878 0.695 . . . . 0.3 112.878 -175.38 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.691 HG22 ' HB3' ' A' ' 136' ' ' LYS . 21.9 t -79.14 -51.82 16.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 C-N-CA 120.992 -0.283 . . . . 0.26 110.669 -171.183 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.55 HG23 ' O ' ' A' ' 42' ' ' MET . 14.7 t -58.34 -47.61 87.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.912 -0.586 . . . . 0.83 111.083 -178.03 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.544 ' HB2' ' O ' ' A' ' 44' ' ' ASN . 3.6 mttt -63.34 -29.9 71.13 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.214 0.449 . . . . 2.4 112.214 -177.474 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.489 HG21 ' HD3' ' A' ' 136' ' ' LYS . 25.5 m -73.99 -42.05 60.99 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.77 -0.372 . . . . 0.55 110.129 177.376 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.608 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -61.82 -42.18 98.71 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.609 0.719 . . . . 0.33 109.43 174.824 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 8.1 t-105 -58.48 -35.02 71.56 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.664 -1.153 . . . . 0.39 111.99 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 10.9 mtpp -91.36 12.99 18.68 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.301 0.482 . . . . 2.24 112.301 -173.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.419 ' ND1' ' HB2' ' A' ' 55' ' ' PHE . 15.3 t-80 -85.94 138.81 31.73 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.104 -0.332 . . . . 0.39 110.104 176.772 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.3 mm-40 -75.45 0.99 15.17 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.049 0.388 . . . . 1.91 112.049 -174.877 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.419 ' HB2' ' ND1' ' A' ' 53' ' ' HIS . 0.5 OUTLIER -111.56 -1.87 15.66 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.951 0.405 . . . . 0.93 110.638 178.238 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.449 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -100.95 16.31 25.7 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.014 0.435 . . . . 0.28 110.764 -178.826 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.539 ' CG ' ' HD3' ' A' ' 58' ' ' PRO . 63.7 p-90 -64.91 -36.34 16.12 Favored Pre-proline 0 CA--C 1.545 0.775 0 N-CA-C 113.742 1.016 . . . . 0.58 113.742 -174.204 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.539 ' HD3' ' CG ' ' A' ' 57' ' ' TRP . 60.5 Cg_endo -84.25 9.34 4.17 Favored 'Trans proline' 0 C--N 1.359 1.103 0 CA-C-N 120.873 1.347 . . . . 0.47 111.881 178.256 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.431 ' CZ ' HH32 ' B' ' 312' ' ' ALY . 0.3 OUTLIER -112.75 21.17 15.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.636 -0.711 . . . . 1.11 110.777 -177.978 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 18.2 m-30 -91.64 -16.68 26.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.481 -0.327 . . . . 0.63 111.482 -176.411 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.483 ' HB2' HD13 ' A' ' 68' ' ' LEU . 37.3 mt-30 -114.96 133.25 22.67 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 116.559 -0.291 . . . . 1.63 110.897 -173.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.618 ' HA ' ' OD1' ' A' ' 82' ' ' ASP . 27.3 Cg_endo -63.28 142.73 87.27 Favored 'Trans proline' 0 C--O 1.237 0.474 0 C-N-CA 122.539 2.16 . . . . 0.87 112.191 179.737 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 40.0 t -71.64 93.09 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 122.137 0.97 . . . . 0.88 110.466 178.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.42 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.0 OUTLIER -98.65 -3.08 36.87 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.653 -1.158 . . . . 1.85 108.978 175.272 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.42 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 81.38 -35.52 0.11 Allowed 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 114.155 -1.384 . . . . 1.29 111.703 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 42.9 mt -95.04 -48.52 12.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 120.676 0.274 . . . . 1.89 110.355 179.346 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.41 -38.04 58.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.736 -0.666 . . . . 2.99 112.074 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.483 HD13 ' HB2' ' A' ' 61' ' ' GLN . 6.8 tp -109.96 6.69 23.37 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.555 -0.293 . . . . 1.66 111.394 -175.459 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ASN . . . . . 0.697 HD21 ' N ' ' B' ' 311' ' ' GLY . 8.9 t30 59.24 51.45 6.87 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.265 0.555 . . . . 1.74 111.374 178.033 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 17.6 mt -126.97 71.7 75.59 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.83 -0.623 . . . . 1.61 110.402 179.829 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -72.47 -40.99 1.89 Allowed 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.338 2.025 . . . . 1.3 113.051 -174.446 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -92.41 26.29 2.66 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.31 0.576 . . . . 1.97 111.085 -176.016 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -70.04 -53.87 15.67 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.584 -0.734 . . . . 1.13 111.814 -178.855 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -73.96 4.99 4.6 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.796 -0.638 . . . . 0.91 112.252 -171.089 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.0 mttp -88.26 -21.82 24.27 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.591 -0.522 . . . . 2.86 109.591 179.191 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.502 HD13 ' CE1' ' A' ' 115' ' ' TYR . 2.7 mp -122.82 -48.33 2.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.692 -0.685 . . . . 1.0 110.443 -179.424 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.483 HD11 ' HB2' ' A' ' 115' ' ' TYR . 41.5 mm -83.26 124.42 39.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 120.898 0.38 . . . . 0.75 110.209 -179.698 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 10.9 mmtt -77.49 -44.88 27.36 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.88 -0.6 . . . . 1.99 110.903 -176.519 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 41.4 m-20 -113.39 97.76 44.34 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 116.197 -0.456 . . . . 2.05 110.284 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -75.12 79.4 2.7 Favored 'Trans proline' 0 CA--C 1.528 0.213 0 C-N-CA 122.9 2.4 . . . . 0.89 112.197 -178.778 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 4.0 mmt -119.25 151.57 38.17 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.281 0.562 . . . . 0.82 110.755 -177.326 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.618 ' OD1' ' HA ' ' A' ' 62' ' ' PRO . 3.2 p-10 -132.64 -112.84 0.23 Allowed 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 114.885 -1.052 . . . . 1.42 109.485 -174.094 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.6 ttm -131.66 -21.89 2.45 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 122.141 -0.349 . . . . 0.8 110.639 175.65 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -81.95 -33.08 27.74 Favored Glycine 0 N--CA 1.442 -0.902 0 N-CA-C 110.322 -1.111 . . . . 0.32 110.322 179.377 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -70.02 -35.08 74.07 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-O 121.134 0.492 . . . . 0.95 110.113 175.358 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.4 mm -56.28 -61.37 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.257 -0.883 . . . . 0.97 110.044 175.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.554 ' O ' ' HG3' ' A' ' 91' ' ' GLU . 0.3 OUTLIER -62.09 -28.68 69.79 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.428 -0.806 . . . . 1.15 111.609 -179.292 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 65.1 tttt -63.76 -42.65 97.78 Favored 'General case' 0 C--O 1.226 -0.154 0 C-N-CA 120.675 -0.41 . . . . 2.46 110.411 -179.349 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 6.5 mtm-85 -74.45 -24.27 59.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.93 0.395 . . . . 1.16 110.755 -177.75 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.481 HD11 ' SD ' ' A' ' 42' ' ' MET . 3.2 mt -75.32 -53.46 8.72 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.787 -0.642 . . . . 0.49 110.645 177.286 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.554 ' HG3' ' O ' ' A' ' 87' ' ' LYS . 13.2 mt-10 -69.56 -37.1 76.87 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.957 -0.565 . . . . 1.39 110.948 -176.876 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -78.55 -11.03 59.94 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.393 -0.367 . . . . 1.3 110.824 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 63.01 69.06 0.6 Allowed 'General case' 0 N--CA 1.462 0.172 0 O-C-N 123.844 0.715 . . . . 1.75 111.427 176.685 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' TYR . . . . . 0.459 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 11.4 t80 -80.1 -47.32 14.99 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.818 -0.628 . . . . 0.96 111.145 179.737 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -117.42 -174.23 2.57 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.958 0.408 . . . . 1.28 110.999 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' TRP . . . . . 0.498 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 1.9 t-105 -67.07 -68.4 0.38 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.368 -0.833 . . . . 1.05 112.005 -175.82 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 75.3 m -121.2 168.18 11.88 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.002 -0.545 . . . . 1.0 111.582 -171.694 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.827 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -68.32 -16.87 64.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.763 -0.653 . . . . 0.66 111.352 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' SER . . . . . 0.462 ' O ' ' HB2' ' A' ' 102' ' ' MET . 0.3 OUTLIER -61.15 -26.37 67.64 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.265 -0.425 . . . . 0.85 110.993 179.409 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -38.65 64.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.208 0.528 . . . . 2.44 110.147 176.595 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.438 ' HB3' ' HE1' ' A' ' 42' ' ' MET . 0.0 OUTLIER -69.47 -21.52 63.7 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.488 -0.778 . . . . 0.95 110.367 179.679 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.751 ' HE1' HG22 ' A' ' 137' ' ' VAL . 8.5 mmt -57.23 -33.26 67.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.021 -0.536 . . . . 1.13 110.131 175.953 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 8.6 tm0? -72.52 -39.66 67.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.494 -0.776 . . . . 2.96 110.039 178.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -70.68 -38.06 73.71 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.856 -0.611 . . . . 1.87 110.323 -178.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.608 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -57.47 -48.53 78.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.661 -0.699 . . . . 0.38 109.919 174.26 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -59.69 -41.15 90.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.716 -0.674 . . . . 0.97 110.106 176.126 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 86.5 m -58.33 -45.97 87.11 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.672 -0.695 . . . . 0.43 111.455 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -54.47 -47.18 73.26 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.001 0.429 . . . . 0.88 110.738 176.092 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -66.19 -40.95 90.79 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.813 -0.631 . . . . 0.29 111.23 -177.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.82 -43.07 80.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.742 0.306 . . . . 0.66 110.247 178.457 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -49.85 -48.56 51.04 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.651 -0.704 . . . . 1.84 110.669 176.611 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' CYS . . . . . 0.428 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 1.5 t -62.48 -41.05 98.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.186 -0.461 . . . . 0.63 110.859 178.351 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' TYR . . . . . 0.452 ' HD1' HG22 ' A' ' 123' ' ' VAL . 12.1 m-85 -70.79 -27.11 63.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.413 -0.358 . . . . 0.81 111.625 -177.61 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 59.4 mt -85.22 -50.15 14.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 120.779 0.323 . . . . 0.55 111.395 -177.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.502 ' CE1' HD13 ' A' ' 76' ' ' ILE . 1.1 t80 -86.25 36.25 0.68 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.416 0.627 . . . . 1.22 111.738 -174.867 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' ASN . . . . . 0.428 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 51.6 m-80 -157.59 -172.85 4.13 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.142 -0.936 . . . . 1.04 109.703 -179.078 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 2.5 mttp -96.39 150.06 36.64 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 109.539 -0.541 . . . . 3.47 109.539 174.276 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -59.68 -19.97 55.96 Favored 'Trans proline' 0 N--CA 1.475 0.389 0 C-N-CA 122.564 2.176 . . . . 0.96 112.798 -179.473 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -118.67 30.7 7.05 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.913 -0.585 . . . . 1.23 110.618 177.866 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' ASP . . . . . 0.429 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 1.5 t0 -84.24 173.36 11.06 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.055 0.455 . . . . 1.34 111.886 -175.425 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' ASP . . . . . 0.421 ' HB2' ' HA ' ' B' ' 314' ' ' LYS . 1.3 t0 -67.23 -56.66 8.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.267 -0.879 . . . . 1.44 111.736 -173.195 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ILE . . . . . 0.437 ' O ' HG13 ' A' ' 122' ' ' ILE . 1.0 OUTLIER -69.17 -29.37 42.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.978 0.418 . . . . 0.42 110.542 -179.546 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.452 HG22 ' HD1' ' A' ' 113' ' ' TYR . 2.1 t -64.44 -43.62 96.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.268 -0.424 . . . . 0.35 110.178 177.585 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.0 mt -56.28 -35.69 67.76 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 115.628 -0.715 . . . . 0.52 109.817 176.287 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' MET . . . . . 0.467 ' O ' HD13 ' A' ' 129' ' ' LEU . 30.7 mtt -73.38 -43.81 59.85 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.015 -0.993 . . . . 0.62 110.654 -178.884 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -55.1 -36.57 65.83 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.831 0.348 . . . . 0.31 111.048 178.166 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.53 -44.36 97.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.865 -0.607 . . . . 1.94 111.211 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.44 -35.29 60.96 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.082 0.468 . . . . 0.32 110.474 178.734 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.467 HD13 ' O ' ' A' ' 125' ' ' MET . 1.8 mp -62.27 -44.98 95.3 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.532 -0.758 . . . . 0.33 110.914 179.865 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -70.8 -22.28 62.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.48 -0.327 . . . . 1.47 111.727 -176.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 37.2 mttm -70.34 -41.73 72.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.812 0.339 . . . . 2.24 110.126 -177.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 129' ' ' LEU . 1.6 pt -79.88 -21.24 12.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.401 -0.363 . . . . 1.23 110.332 176.221 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.559 ' O ' HG23 ' A' ' 137' ' ' VAL . 25.1 t80 -61.58 -61.79 2.27 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.224 -0.444 . . . . 0.46 110.258 173.833 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.4 pp -64.38 -25.29 67.96 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 121.028 0.442 . . . . 0.64 110.462 -177.783 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.459 ' HB2' ' HA ' ' A' ' 132' ' ' ILE . 0.0 OUTLIER -55.75 -47.71 76.5 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.395 -0.82 . . . . 1.61 111.117 176.373 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 136' ' ' LYS . . . . . 0.691 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -82.44 -24.27 34.38 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.939 -0.573 . . . . 1.52 110.786 -178.112 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.751 HG22 ' HE1' ' A' ' 102' ' ' MET . 95.6 t -66.61 -35.87 75.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 121.299 0.571 . . . . 0.35 110.066 176.46 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.97 -17.58 64.48 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.808 -0.633 . . . . 0.5 110.606 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -101.82 3.82 39.73 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.969 -0.559 . . . . 1.76 110.811 178.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' MET . . . . . 0.472 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 24.0 mtp -72.84 146.07 87.45 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.343 -0.39 . . . . 0.86 109.973 175.876 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -68.1 116.29 4.25 Favored 'Trans proline' 0 N--CA 1.464 -0.255 0 C-N-CA 122.409 2.073 . . . . 0.67 112.291 -178.461 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -78.01 15.05 0.96 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.273 0.559 . . . . 2.91 110.615 177.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -99.74 -47.82 4.93 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-N 115.731 -0.668 . . . . 2.7 110.186 -178.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 61.99 89.13 0.08 Allowed 'General case' 0 C--O 1.237 0.395 0 CA-C-N 115.015 -0.993 . . . . 2.34 110.41 -174.743 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' VAL . . . . . 0.572 ' O ' ' HB3' ' A' ' 37' ' ' ASN . 2.8 t -104.4 115.3 46.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.461 -0.791 . . . . 0.99 109.654 178.806 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.695 ' HG3' HG22 ' A' ' 36' ' ' THR . 3.8 tt0 -68.4 147.15 52.48 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.546 -0.297 . . . . 1.53 110.887 -177.867 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 12.1 mt . . . . . 0 C--O 1.248 0.989 0 CA-C-O 118.186 -0.912 . . . . 1.57 110.922 -177.705 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 311' ' ' GLY . . . . . 0.697 ' N ' HD21 ' A' ' 69' ' ' ASN . . . . . . . . 0 N--CA 1.482 1.705 0 N-CA-C 111.551 -0.619 . . . . 2.17 111.551 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 312' ' ' ALY . . . . . 0.431 HH32 ' CZ ' ' A' ' 59' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 83.06 -138.41 17.92 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.849 -0.691 . . . . 1.97 111.994 -179.566 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 314' ' ' LYS . . . . . 0.421 ' HA ' ' HB2' ' A' ' 121' ' ' ASP . 0.0 OUTLIER -88.97 138.33 31.5 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.968 0.413 . . . . 3.58 110.337 178.72 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.87 -0.586 . . . . 4.6 109.471 178.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo . . . . . 0 N--CA 1.479 0.64 0 N-CA-C 110.7 -0.539 . . . . 6.18 110.7 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -121.61 136.69 54.94 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.505 -0.554 . . . . 5.71 109.505 178.46 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.22 59.46 6.31 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.879 -0.677 . . . . 3.45 112.485 -178.587 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 26.6 p -69.61 172.92 6.65 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 110.495 -0.187 . . . . 2.44 110.495 177.453 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.58 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 5.2 mt-10 -49.75 116.36 1.75 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.357 0.598 . . . . 1.64 112.449 -178.687 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.2 p -103.7 -13.6 8.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.263 -0.88 . . . . 0.93 109.956 178.337 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.6 m -165.78 147.59 7.21 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.31 -0.859 . . . . 1.61 109.415 179.288 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.524 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 23.0 t-20 -148.83 125.99 5.53 Favored Pre-proline 0 C--N 1.317 -0.824 0 CA-C-N 115.972 -0.558 . . . . 1.6 109.605 177.789 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -66.44 -43.32 8.23 Favored 'Trans proline' 0 N--CA 1.474 0.374 0 C-N-CA 123.375 2.717 . . . . 1.87 113.282 -175.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.0 m -75.4 -26.53 58.5 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-O 121.451 0.643 . . . . 2.18 110.468 -176.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.524 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 11.1 tttm -82.77 121.93 77.99 Favored Pre-proline 0 C--N 1.318 -0.775 0 CA-C-N 115.179 -0.918 . . . . 2.75 109.985 178.883 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.466 ' HB2' ' CZ3' ' A' ' 96' ' ' TRP . 23.1 Cg_endo -64.96 132.33 31.86 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.027 1.818 . . . . 1.38 112.116 -179.898 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -138.38 77.7 0.33 Allowed Glycine 0 N--CA 1.445 -0.707 0 CA-C-N 115.119 -0.946 . . . . 0.97 110.947 -178.162 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -85.98 148.96 25.51 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.02 0.438 . . . . 1.93 111.08 -173.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.79 102.56 14.78 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.955 -0.566 . . . . 2.64 110.045 176.274 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.587 HG22 ' HG3' ' A' ' 146' ' ' GLU . 1.3 p -110.51 167.23 10.37 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.911 0.386 . . . . 0.68 111.004 176.362 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.415 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 62.3 t30 -63.12 -39.92 96.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.806 -0.634 . . . . 1.47 111.264 -179.096 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.404 ' O ' ' HB3' ' A' ' 41' ' ' TYR . 9.2 tt0 -64.6 -42.86 95.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.559 -0.291 . . . . 1.04 110.521 178.262 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.479 ' O ' ' HG2' ' A' ' 43' ' ' GLN . 0.5 OUTLIER -59.01 -52.31 66.3 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.272 -0.422 . . . . 0.8 110.641 -179.754 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.442 ' O ' ' HG3' ' A' ' 43' ' ' GLN . 1.4 mt-30 -70.1 -19.98 63.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.04 -0.527 . . . . 1.75 111.186 -179.586 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.415 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 57.2 t80 -64.83 -63.34 1.14 Allowed 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.966 -0.561 . . . . 0.64 111.307 178.299 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.54 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -58.84 -34.84 72.02 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 111.879 0.326 . . . . 1.13 111.879 -170.922 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' A' ' 39' ' ' LEU . 0.5 OUTLIER -63.81 -49.59 72.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.208 0.528 . . . . 1.3 110.398 -176.192 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -85.46 -29.89 23.95 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.894 -0.594 . . . . 0.5 111.943 -177.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 87.8 t -89.37 -58.54 3.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 112.491 0.552 . . . . 0.3 112.491 -177.105 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.603 HG22 ' HB3' ' A' ' 136' ' ' LYS . 43.8 t -78.4 -66.06 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 120.645 0.26 . . . . 0.26 111.305 -172.055 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.491 HG13 ' O ' ' A' ' 42' ' ' MET . 2.0 m -64.17 -33.75 64.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.366 -0.379 . . . . 0.83 111.8 -173.83 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.5 mttp -69.5 -31.98 70.57 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.848 -0.341 . . . . 2.4 111.467 -178.653 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.1 m -77.22 -38.57 51.0 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.785 -0.366 . . . . 0.55 110.386 177.112 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.666 HD23 HD12 ' A' ' 132' ' ' ILE . 0.0 OUTLIER -64.43 -35.72 81.84 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 109.409 -0.589 . . . . 0.33 109.409 175.132 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 13.7 t-105 -62.79 -34.2 76.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.635 -0.711 . . . . 0.39 111.209 178.049 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.5 mttt -84.28 5.68 25.79 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.944 -0.302 . . . . 2.24 111.763 -175.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.481 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 14.3 t-80 -84.96 134.17 34.25 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.57 -0.53 . . . . 0.39 109.57 175.379 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -85.19 12.41 7.99 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.827 0.346 . . . . 1.91 111.829 -173.613 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.481 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.6 OUTLIER -111.97 -1.08 15.54 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.338 0.59 . . . . 0.93 109.42 172.364 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.65 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -100.9 20.21 15.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.647 -0.706 . . . . 0.28 110.534 179.45 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.559 ' CG ' ' HD3' ' A' ' 58' ' ' PRO . 40.5 p-90 -73.13 -35.41 2.76 Favored Pre-proline 0 CA--C 1.541 0.623 0 N-CA-C 113.025 0.75 . . . . 0.58 113.025 -175.835 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.559 ' HD3' ' CG ' ' A' ' 57' ' ' TRP . 2.9 Cg_exo -75.82 -1.13 11.01 Favored 'Trans proline' 0 C--N 1.361 1.208 0 C-N-CA 121.475 1.45 . . . . 0.47 110.703 174.49 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -102.98 -7.95 21.03 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 114.778 -1.101 . . . . 1.11 110.537 -178.225 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 9.0 m-30 -65.35 -50.67 64.71 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.947 -0.57 . . . . 0.63 111.365 -176.625 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.15 127.33 64.61 Favored Pre-proline 0 C--N 1.32 -0.686 0 CA-C-N 115.425 -0.807 . . . . 1.63 110.549 -174.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.61 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 37.8 Cg_endo -67.94 150.07 77.93 Favored 'Trans proline' 0 C--O 1.237 0.469 0 C-N-CA 122.766 2.311 . . . . 0.87 112.799 -177.355 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 4.0 t -72.02 97.97 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 122.19 0.995 . . . . 0.88 109.958 175.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -109.44 13.47 24.08 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.524 -1.217 . . . . 1.85 109.385 176.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.506 ' HB2' ' NE2' ' A' ' 74' ' ' HIS . . . 65.71 -73.77 0.06 Allowed 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 114.791 -1.095 . . . . 1.29 111.453 -175.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.5 mt -65.5 -39.91 86.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 120.8 0.333 . . . . 1.89 111.282 -174.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.1 -29.1 68.37 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.021 -0.536 . . . . 2.99 112.176 -177.74 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.446 HD13 ' HA ' ' A' ' 68' ' ' LEU . 0.2 OUTLIER -120.18 7.11 10.75 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.941 -0.304 . . . . 1.66 111.785 -176.47 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 66.1 t30 61.84 48.82 5.14 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.292 0.568 . . . . 1.74 111.04 -179.428 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 5.3 mt -126.04 71.4 69.18 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.047 -0.524 . . . . 1.61 111.673 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -75.7 -27.62 8.76 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 121.928 1.752 . . . . 1.3 111.83 176.183 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.0 -4.97 59.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.257 -0.429 . . . . 1.97 110.882 -179.0 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -59.53 -49.6 77.16 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.805 -0.634 . . . . 1.13 110.494 179.603 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' HIS . . . . . 0.557 ' HD1' ' HG3' ' A' ' 80' ' ' PRO . 72.1 m-70 -77.98 8.28 4.93 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.51 -0.768 . . . . 0.91 111.457 -175.311 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 24.3 mttt -99.3 -19.96 16.79 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.453 0.644 . . . . 2.86 109.595 177.269 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.0 mt -114.93 -50.31 4.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.731 -0.668 . . . . 1.0 109.99 177.494 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 24.0 mm -95.48 103.38 14.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.826 -0.625 . . . . 0.75 109.767 179.081 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.0 mttt -83.08 -11.78 57.7 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.954 -0.567 . . . . 1.99 110.48 -178.496 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 16.1 m-80 -123.93 73.05 55.0 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.67 -0.696 . . . . 2.05 109.756 174.781 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.557 ' HG3' ' HD1' ' A' ' 74' ' ' HIS . 73.4 Cg_endo -80.76 102.15 1.36 Allowed 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.534 2.156 . . . . 0.89 112.759 -175.053 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.5 mmt -130.64 152.93 49.47 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.953 -0.567 . . . . 0.82 110.292 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.61 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 1.1 p30 -139.36 -116.23 0.14 Allowed 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.061 -0.972 . . . . 1.42 109.607 -174.603 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -125.22 -27.09 3.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.053 0.454 . . . . 0.8 110.189 177.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.505 ' O ' ' HG3' ' A' ' 88' ' ' LYS . . . -84.28 -31.75 24.55 Favored Glycine 0 N--CA 1.441 -0.999 0 N-CA-C 110.799 -0.92 . . . . 0.32 110.799 -177.712 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -70.51 -40.85 73.29 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.928 0.394 . . . . 0.95 110.503 177.264 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.542 HG23 ' SG ' ' A' ' 101' ' ' CYS . 34.7 mt -63.81 -42.51 96.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.657 -0.701 . . . . 0.97 109.938 176.047 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.87 -33.14 72.62 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.034 -0.53 . . . . 1.15 111.147 178.081 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' A' ' 84' ' ' GLY . 35.8 mttt -62.09 -50.48 71.76 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-O 121.115 0.483 . . . . 2.46 110.628 179.766 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 16.3 mtp180 -69.69 -32.93 71.81 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.676 -0.693 . . . . 1.16 111.415 -176.587 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 8.7 mt -66.53 -54.34 24.89 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.175 -0.466 . . . . 0.49 111.316 -179.556 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -69.59 -23.33 63.52 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.258 -0.428 . . . . 1.39 111.642 -175.615 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.424 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 0.5 OUTLIER -89.37 -2.46 58.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.653 -0.249 . . . . 1.3 110.895 -179.01 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 59.73 54.41 4.43 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.242 0.544 . . . . 1.75 111.164 -179.345 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' TYR . . . . . 0.58 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 78.0 t80 -80.35 -27.33 38.32 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.056 -0.52 . . . . 0.96 110.54 178.402 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.655 ' CD1' ' HB3' ' A' ' 100' ' ' GLU . 8.2 m-85 -96.88 178.32 5.33 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-O 121.844 0.831 . . . . 1.28 111.432 -178.496 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' TRP . . . . . 0.466 ' CZ3' ' HB2' ' A' ' 32' ' ' PRO . 2.2 t-105 -94.19 -56.12 2.95 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 113.703 -1.589 . . . . 1.05 108.872 170.372 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 67.3 m -129.19 167.98 16.83 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 114.919 -1.037 . . . . 1.0 109.597 -177.557 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -70.79 -12.29 61.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.774 0.321 . . . . 0.66 111.647 -177.229 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -21.49 66.31 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.068 -0.515 . . . . 0.85 110.591 177.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.655 ' HB3' ' CD1' ' A' ' 95' ' ' TYR . 2.0 tt0 -77.03 -33.22 57.41 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.054 -0.521 . . . . 2.44 109.922 179.445 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.542 ' SG ' HG23 ' A' ' 86' ' ' ILE . 0.1 OUTLIER -75.81 -22.08 56.7 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.383 -0.826 . . . . 0.95 110.724 -177.446 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 5.0 ttm -59.01 -30.95 68.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.084 -0.507 . . . . 1.13 110.454 178.083 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.07 -43.26 74.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.674 -0.694 . . . . 2.96 110.115 178.071 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -67.87 -43.39 79.51 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.756 -0.656 . . . . 1.87 110.82 -177.743 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.549 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.7 OUTLIER -60.42 -44.4 95.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.101 -0.5 . . . . 0.38 110.445 178.055 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 39.4 t30 -60.7 -39.64 89.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.048 -0.524 . . . . 0.97 110.301 177.438 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 85.3 m -68.53 -44.16 75.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.563 -0.744 . . . . 0.43 111.463 179.093 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.09 -44.09 70.91 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.174 -0.466 . . . . 0.88 111.08 178.29 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -70.3 -43.83 69.57 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.12 -0.491 . . . . 0.29 111.026 -177.313 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -66.33 -37.26 84.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.813 0.34 . . . . 0.66 110.665 -178.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -50.27 -51.58 43.59 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.481 -0.781 . . . . 1.84 110.901 176.785 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 2.0 t -60.86 -36.43 79.13 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.548 -0.296 . . . . 0.63 111.194 178.121 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -69.79 -27.65 65.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.434 -0.348 . . . . 0.81 111.536 -177.633 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 29.0 mt -92.13 -51.05 12.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.923 0.392 . . . . 0.55 111.618 -176.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -67.39 -38.25 84.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.28 0.562 . . . . 1.22 110.726 -177.152 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 38.8 m-20 -101.7 -172.12 2.1 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.88 -0.6 . . . . 1.04 109.669 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.31 147.28 51.82 Favored Pre-proline 0 C--N 1.32 -0.681 0 N-CA-C 110.213 -0.292 . . . . 3.47 110.213 -179.261 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' PRO . . . . . 0.821 ' HA ' HG11 ' A' ' 123' ' ' VAL . 52.0 Cg_exo -57.7 -20.13 41.29 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 123.013 2.475 . . . . 0.96 112.86 -179.452 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.0 21.11 2.83 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.802 -0.635 . . . . 1.23 111.687 -179.711 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 120' ' ' ASP . . . . . 0.582 ' OD1' ' HA ' ' B' ' 314' ' ' LYS . 4.4 t70 -118.5 165.73 13.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.166 0.508 . . . . 1.34 111.763 177.658 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' ASP . . . . . 0.419 ' HB2' ' O ' ' B' ' 315' ' ' ALY . 0.1 OUTLIER -67.49 -36.25 80.74 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.052 -0.976 . . . . 1.44 110.588 -179.683 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.1 tp -61.03 -40.56 86.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 CA-C-N 116.491 -0.322 . . . . 0.42 111.312 -177.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.821 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.2 t -70.18 -39.6 77.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 C-N-CA 120.57 -0.452 . . . . 0.35 110.011 177.729 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.0 -35.34 74.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.857 -0.61 . . . . 0.52 109.409 178.818 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' MET . . . . . 0.43 ' O ' HD13 ' A' ' 129' ' ' LEU . 38.0 mtt -68.67 -50.46 50.91 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.038 -0.983 . . . . 0.62 110.613 176.674 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -55.05 -38.57 68.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.361 -0.381 . . . . 0.31 111.106 179.299 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -60.35 -41.05 92.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.895 -0.593 . . . . 1.94 111.193 178.53 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -77.93 -39.17 43.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.997 0.427 . . . . 0.32 110.505 179.349 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.65 HD21 ' HA ' ' A' ' 56' ' ' ALA . 1.9 mp -58.99 -40.56 85.21 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.605 -0.725 . . . . 0.33 110.444 179.02 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -57.64 -29.71 64.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.294 -0.866 . . . . 1.47 111.996 -178.033 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.506 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -63.29 -39.34 94.32 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.829 0.347 . . . . 2.24 110.328 -176.778 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.666 HD12 HD23 ' A' ' 50' ' ' LEU . 11.1 mt -70.07 -28.31 35.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.981 -0.554 . . . . 1.23 110.851 -178.519 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.428 ' O ' HG23 ' A' ' 137' ' ' VAL . 26.9 t80 -62.48 -63.06 1.34 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.118 -0.492 . . . . 0.46 110.779 -179.374 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 134' ' ' LEU . . . . . 0.445 ' HG ' ' H ' ' A' ' 134' ' ' LEU . 0.0 OUTLIER -65.46 -26.53 67.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.172 0.511 . . . . 0.64 110.422 -179.102 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.506 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.94 -41.96 97.28 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.538 -0.756 . . . . 1.61 111.281 179.353 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 136' ' ' LYS . . . . . 0.603 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -92.82 -24.91 18.35 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.246 -0.434 . . . . 1.52 110.897 -177.41 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 133' ' ' PHE . 37.1 t -70.73 -33.64 53.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.316 -0.402 . . . . 0.35 110.833 -179.749 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -69.3 -12.55 61.76 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.13 0.491 . . . . 0.5 110.759 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -103.98 0.0 29.43 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.999 -0.546 . . . . 1.76 110.695 178.63 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' MET . . . . . 0.408 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 0.0 OUTLIER -59.89 146.84 80.88 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.109 -0.496 . . . . 0.86 110.812 178.465 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -74.47 94.61 0.92 Allowed 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 121.985 1.79 . . . . 0.67 111.034 178.848 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -84.77 31.86 0.53 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.456 0.646 . . . . 2.91 111.26 -175.495 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -116.41 -35.67 4.22 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 114.901 -1.045 . . . . 2.7 108.508 173.445 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 74.18 138.37 0.06 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 113.882 -1.508 . . . . 2.34 111.468 177.724 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 45.3 t -144.32 102.27 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.185 -0.916 . . . . 0.99 109.831 -177.705 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.587 ' HG3' HG22 ' A' ' 36' ' ' THR . 1.0 OUTLIER -67.15 138.29 56.92 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.665 -0.495 . . . . 1.53 109.665 176.576 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 6.5 mt . . . . . 0 C--O 1.251 1.135 0 CA-C-O 118.524 -0.75 . . . . 1.57 110.745 -176.786 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.777 0 N-CA-C 112.254 -0.338 . . . . 2.17 112.254 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 128.13 -22.02 5.42 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 120.669 -0.776 . . . . 1.97 111.578 -178.15 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 314' ' ' LYS . . . . . 0.582 ' HA ' ' OD1' ' A' ' 120' ' ' ASP . 0.1 OUTLIER -146.67 94.5 2.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.97 0.414 . . . . 3.58 109.967 176.949 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 315' ' ' ALY . . . . . 0.419 ' O ' ' HB2' ' A' ' 121' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 3.5 ptmt . . . . . 0 C--O 1.246 0.896 0 CA-C-O 118.667 -0.682 . . . . 4.6 109.493 177.707 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo . . . . . 0 N--CA 1.477 0.523 0 N-CA-C 110.285 -0.698 . . . . 6.18 110.285 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -125.66 141.14 52.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.599 -0.273 . . . . 5.71 110.353 179.153 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.69 -80.83 1.79 Allowed Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.916 -0.659 . . . . 3.45 112.378 177.226 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -145.41 155.12 42.95 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 110.034 -0.358 . . . . 2.44 110.034 -178.108 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.649 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 4.9 mt-10 -50.44 118.81 3.25 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 123.548 0.53 . . . . 1.64 111.533 176.558 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.2 p -98.36 -17.4 6.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-O 121.671 0.748 . . . . 0.93 108.991 177.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 54.0 m -167.42 146.55 5.02 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.425 -1.261 . . . . 1.61 108.745 178.449 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.528 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 18.4 t-20 -135.49 129.72 18.69 Favored Pre-proline 0 C--N 1.317 -0.82 0 N-CA-C 108.879 -0.785 . . . . 1.6 108.879 176.709 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -59.79 -48.5 12.55 Favored 'Trans proline' 0 N--CA 1.472 0.264 0 C-N-CA 123.368 2.712 . . . . 1.87 113.361 -174.217 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.7 m -81.83 -28.31 33.16 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.854 0.359 . . . . 2.18 111.337 -174.454 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.528 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 0.4 OUTLIER -77.38 116.58 58.95 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.106 -0.497 . . . . 2.75 110.387 178.708 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.473 ' HB2' ' CZ3' ' A' ' 96' ' ' TRP . 6.8 Cg_exo -71.53 151.51 58.97 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.224 1.949 . . . . 1.38 112.18 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -148.66 77.69 0.23 Allowed Glycine 0 N--CA 1.444 -0.793 0 CA-C-N 115.345 -0.843 . . . . 0.97 111.111 178.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.3 mtm-85 -80.32 132.77 35.86 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.699 0.285 . . . . 1.93 110.247 -177.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -72.1 109.97 6.25 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.211 -0.449 . . . . 2.64 110.285 -177.6 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.963 HG22 ' HG3' ' A' ' 146' ' ' GLU . 5.3 p -107.81 166.86 10.38 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.661 -0.416 . . . . 0.68 110.513 177.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -60.26 -43.92 95.73 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 116.22 -0.446 . . . . 1.47 110.739 -179.368 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -58.53 -40.19 82.27 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.658 0.266 . . . . 1.04 110.973 -179.343 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.43 ' HB2' ' HA ' ' A' ' 97' ' ' SER . 0.6 OUTLIER -62.62 -57.57 10.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.081 -0.509 . . . . 0.8 110.956 -179.164 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -65.85 -29.61 70.1 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 115.986 -0.552 . . . . 1.75 110.848 -179.152 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 53.0 t80 -59.04 -63.89 1.14 Allowed 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.904 -0.589 . . . . 0.64 110.48 177.258 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.566 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -58.73 -33.77 70.6 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 121.124 -0.23 . . . . 1.13 110.755 -174.896 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -57.57 -55.38 35.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.006 0.431 . . . . 1.3 110.885 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 51.3 m-80 -85.99 -29.93 23.12 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.067 -0.515 . . . . 0.5 111.805 -176.76 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 99.1 t -88.4 -56.89 4.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 N-CA-C 112.284 0.476 . . . . 0.3 112.284 -174.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.704 HG22 ' HB3' ' A' ' 136' ' ' LYS . 41.5 t -82.22 -66.57 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 111.814 0.301 . . . . 0.26 111.814 -172.096 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.447 HG13 ' O ' ' A' ' 42' ' ' MET . 1.3 m -63.37 -34.62 68.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 N-CA-C 111.604 0.224 . . . . 0.83 111.604 -173.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.35 -36.26 81.04 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.752 -0.379 . . . . 2.4 111.496 -179.301 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.4 m -76.06 -36.77 58.89 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.782 -0.367 . . . . 0.55 110.467 177.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.601 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -62.13 -42.48 99.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.29 0.566 . . . . 0.33 109.547 174.451 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 22.1 t-105 -55.91 -36.14 67.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.984 -1.007 . . . . 0.39 111.292 178.215 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 9.8 mmtp -90.57 22.02 3.68 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 112.445 0.535 . . . . 2.24 112.445 -172.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 34.3 t-80 -88.57 148.25 24.19 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 110.077 -0.342 . . . . 0.39 110.077 174.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -73.25 -16.15 61.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.315 -0.402 . . . . 1.91 111.931 -175.092 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 19.1 m-30 -106.72 3.24 26.44 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.924 0.392 . . . . 0.93 110.764 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.664 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -92.43 5.45 50.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.136 0.493 . . . . 0.28 111.003 -178.143 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.525 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 56.3 p-90 -63.84 -36.0 18.94 Favored Pre-proline 0 CA--C 1.548 0.897 0 N-CA-C 114.214 1.19 . . . . 0.58 114.214 -173.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.525 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 19.4 Cg_endo -79.99 -9.6 14.18 Favored 'Trans proline' 0 C--N 1.359 1.097 0 CA-C-N 121.407 1.538 . . . . 0.47 112.289 -178.609 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -98.19 9.09 43.77 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.058 -0.519 . . . . 1.11 110.347 -179.349 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 5.3 m-30 -70.96 -37.37 72.78 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.751 -0.659 . . . . 0.63 111.36 -178.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -101.95 134.36 20.15 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.898 -0.592 . . . . 1.63 110.846 -172.497 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.65 ' HA ' ' OD1' ' A' ' 82' ' ' ASP . 34.8 Cg_exo -57.62 147.73 77.7 Favored 'Trans proline' 0 C--O 1.239 0.54 0 C-N-CA 122.674 2.249 . . . . 0.87 112.099 176.442 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 3.8 t -68.19 106.67 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 121.785 0.802 . . . . 0.88 111.307 -178.002 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -114.92 130.19 56.86 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.716 -1.129 . . . . 1.85 108.071 168.506 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.17 -2.17 14.97 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 112.265 0.468 . . . . 1.29 112.265 -171.624 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 12.1 mt -113.74 -52.0 5.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.495 0.188 . . . . 1.89 111.012 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.6 tttp -59.37 -51.06 71.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.929 0.395 . . . . 2.99 111.211 -179.195 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.25 -7.83 50.12 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.25 -0.432 . . . . 1.66 110.298 179.252 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 56.51 63.26 2.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.267 -0.879 . . . . 1.74 110.667 -176.802 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.425 HD12 ' HA ' ' A' ' 70' ' ' LEU . 0.3 OUTLIER -114.62 72.02 2.56 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 115.542 -0.754 . . . . 1.61 109.804 178.315 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -77.85 -51.09 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.467 2.111 . . . . 1.3 112.979 -173.666 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -72.87 -13.07 61.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.369 0.604 . . . . 1.97 110.538 -178.244 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -58.98 -39.99 83.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.084 -0.962 . . . . 1.13 110.899 178.529 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -75.27 -2.42 28.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.691 -0.686 . . . . 0.91 111.755 -175.152 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -104.59 -53.59 2.67 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.072 0.463 . . . . 2.86 110.443 -177.265 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.1 mp -76.55 -38.82 32.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.733 -0.667 . . . . 1.0 110.752 -177.506 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.474 HD11 ' HB2' ' A' ' 115' ' ' TYR . 47.8 mm -94.51 125.77 47.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 109.941 -0.392 . . . . 0.75 109.941 179.355 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.68 -28.24 33.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.278 -0.419 . . . . 1.99 111.128 -175.39 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 18.9 m-80 -132.83 81.07 59.38 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.433 -0.349 . . . . 2.05 110.431 178.328 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -68.65 95.34 0.46 Allowed 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 123.028 2.485 . . . . 0.89 111.863 179.56 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 5.8 mmt -127.46 160.82 30.31 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-O 121.39 0.614 . . . . 0.82 110.313 -178.364 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.65 ' OD1' ' HA ' ' A' ' 62' ' ' PRO . 2.5 p-10 -136.62 -134.27 0.14 Allowed 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 114.65 -1.159 . . . . 1.42 109.61 -170.472 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -123.36 -14.75 7.35 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.172 0.511 . . . . 0.8 109.849 -177.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -89.54 -32.39 10.34 Favored Glycine 0 N--CA 1.442 -0.916 0 N-CA-C 109.65 -1.38 . . . . 0.32 109.65 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 94.5 m -67.19 -42.33 84.36 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 114.916 -0.642 . . . . 0.95 110.823 174.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 43.4 mt -62.22 -45.79 97.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.031 0.443 . . . . 0.97 110.116 177.126 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.491 ' HG3' ' N ' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -64.81 -31.66 72.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.133 -0.485 . . . . 1.15 110.712 178.316 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.491 ' N ' ' HG3' ' A' ' 87' ' ' LYS . 16.5 tttp -63.62 -43.31 97.21 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 121.278 0.561 . . . . 2.46 110.755 179.232 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 10.2 mtp180 -76.22 -31.03 58.17 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.812 -0.631 . . . . 1.16 111.1 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 4.5 mt -64.8 -51.46 62.05 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.028 -0.533 . . . . 0.49 111.011 177.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -66.83 -31.25 71.74 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.873 -0.603 . . . . 1.39 111.597 -177.109 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -92.68 5.08 52.35 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.923 -0.311 . . . . 1.3 111.455 -177.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 60.41 55.13 3.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.906 -0.588 . . . . 1.75 111.8 175.54 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' TYR . . . . . 0.649 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 63.4 t80 -82.08 -22.39 36.32 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.338 0.59 . . . . 0.96 110.133 175.509 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' TYR . . . . . 0.6 ' CD1' ' HB3' ' A' ' 100' ' ' GLU . 46.5 m-85 -99.02 169.52 9.36 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.723 0.773 . . . . 1.28 112.151 -174.62 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' TRP . . . . . 0.473 ' CZ3' ' HB2' ' A' ' 32' ' ' PRO . 2.0 t90 -96.72 -38.1 10.04 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-N 113.994 -1.457 . . . . 1.05 108.688 169.51 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.43 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 8.6 t -155.88 168.54 26.88 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 115.544 -0.753 . . . . 1.0 110.166 -175.711 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -72.67 -9.4 58.58 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.481 -0.327 . . . . 0.66 111.634 -175.322 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.15 -21.76 65.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.1 0.476 . . . . 0.85 109.89 175.094 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.6 ' HB3' ' CD1' ' A' ' 95' ' ' TYR . 1.0 OUTLIER -78.16 -42.57 31.27 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.757 -0.831 . . . . 2.44 108.757 175.341 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 29.9 m -61.91 -34.84 76.79 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.054 -0.975 . . . . 0.95 110.627 177.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 3.2 ttm -58.35 -35.27 71.68 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.604 -0.725 . . . . 1.13 110.582 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -70.73 -41.21 72.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.884 -0.598 . . . . 2.96 110.123 179.251 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -68.83 -43.73 74.91 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.753 -0.658 . . . . 1.87 110.47 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.601 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.6 OUTLIER -58.31 -46.04 86.89 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.026 -0.534 . . . . 0.38 110.058 176.421 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 14.6 t30 -56.71 -45.25 81.98 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.682 -0.69 . . . . 0.97 110.018 176.259 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 91.4 m -64.77 -45.99 84.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.974 -0.557 . . . . 0.43 111.504 179.42 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.06 -42.68 77.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.85 0.357 . . . . 0.88 110.66 178.233 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -72.89 -50.31 24.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.021 -0.536 . . . . 0.29 110.526 -178.013 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' THR . . . . . 0.41 ' O ' HG13 ' A' ' 114' ' ' ILE . 5.0 p -59.86 -35.98 75.91 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 116.373 -0.376 . . . . 0.66 111.047 -178.175 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -52.65 -42.9 65.1 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.136 -0.484 . . . . 1.84 110.679 178.571 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 112' ' ' CYS . . . . . 0.611 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 0.0 OUTLIER -73.81 -26.9 60.85 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.869 -0.605 . . . . 0.63 110.875 -179.207 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -85.47 -15.87 41.49 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.862 0.363 . . . . 0.81 111.194 -179.615 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ILE . . . . . 0.41 HG13 ' O ' ' A' ' 110' ' ' THR . 70.0 mt -89.19 -57.66 4.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.211 -0.45 . . . . 0.55 110.744 178.816 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' TYR . . . . . 0.474 ' HB2' HD11 ' A' ' 77' ' ' ILE . 45.4 t80 -67.55 -51.59 48.87 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.853 -0.612 . . . . 1.22 110.563 -176.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' ASN . . . . . 0.611 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 28.6 m120 -79.59 176.3 9.83 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.592 -0.731 . . . . 1.04 110.707 -178.194 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' LYS . . . . . 0.422 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 0.0 OUTLIER -101.1 153.24 37.87 Favored Pre-proline 0 C--N 1.321 -0.654 0 N-CA-C 109.329 -0.619 . . . . 3.47 109.329 177.786 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 118' ' ' PRO . . . . . 0.583 ' HA ' HG11 ' A' ' 123' ' ' VAL . 28.7 Cg_endo -64.44 2.74 1.06 Allowed 'Trans proline' 0 CA--C 1.535 0.548 0 C-N-CA 122.584 2.189 . . . . 0.96 112.686 178.168 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.31 5.03 13.51 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.165 -0.47 . . . . 1.23 110.609 177.299 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 120' ' ' ASP . . . . . 0.422 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 0.9 OUTLIER -75.5 164.08 26.73 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.215 0.531 . . . . 1.34 111.923 -173.407 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.7 -55.52 22.74 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.994 -1.003 . . . . 1.44 110.603 -178.134 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ILE . . . . . 0.406 ' H ' HG22 ' A' ' 122' ' ' ILE . 0.9 OUTLIER -62.78 -34.48 65.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.569 -0.741 . . . . 0.42 111.114 -179.627 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.583 HG11 ' HA ' ' A' ' 118' ' ' PRO . 1.5 t -64.75 -40.07 87.8 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-O 121.004 0.431 . . . . 0.35 110.312 178.763 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.1 -29.39 68.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.292 0.567 . . . . 0.52 110.055 176.736 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' MET . . . . . 0.44 ' O ' HD13 ' A' ' 129' ' ' LEU . 10.4 mtt -80.4 -48.04 13.5 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.591 -0.731 . . . . 0.62 110.438 178.563 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -53.91 -39.08 65.5 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.151 -0.477 . . . . 0.31 111.387 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -56.72 -42.87 79.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.31 -0.405 . . . . 1.94 111.301 178.077 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.99 -41.79 50.17 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.023 -0.535 . . . . 0.32 110.95 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.664 HD21 ' HA ' ' A' ' 56' ' ' ALA . 8.5 mp -57.88 -44.51 86.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.649 -0.705 . . . . 0.33 110.41 177.636 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -57.78 -26.96 62.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.116 -0.947 . . . . 1.47 111.902 -177.377 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.452 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -68.24 -41.46 81.16 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.648 -0.251 . . . . 2.24 110.479 -176.878 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 15.5 mt -69.24 -31.99 51.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.884 0.373 . . . . 1.23 110.17 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.413 ' O ' HG23 ' A' ' 137' ' ' VAL . 39.4 t80 -60.28 -61.94 2.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.776 -0.647 . . . . 0.46 110.599 178.347 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.8 pp -64.87 -28.12 69.33 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.907 0.384 . . . . 0.64 110.638 -177.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.452 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.7 OUTLIER -59.73 -56.58 20.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.688 -0.687 . . . . 1.61 110.778 178.726 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 136' ' ' LYS . . . . . 0.704 ' HB3' HG22 ' A' ' 46' ' ' VAL . 1.2 mptp? -76.75 -20.46 56.46 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.768 -0.651 . . . . 1.52 111.138 -176.793 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.513 ' HA ' ' HG3' ' A' ' 140' ' ' MET . 23.1 t -73.97 -32.27 32.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.848 0.356 . . . . 0.35 110.289 178.445 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -65.13 -20.28 66.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.093 0.473 . . . . 0.5 110.14 176.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -97.24 -0.64 46.37 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.767 -0.651 . . . . 1.76 110.954 -178.323 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' MET . . . . . 0.513 ' HG3' ' HA ' ' A' ' 137' ' ' VAL . 0.6 OUTLIER -68.54 151.31 97.31 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.258 -0.428 . . . . 0.86 111.397 -178.967 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -72.87 106.56 2.16 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.583 2.189 . . . . 0.67 111.207 177.814 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.45 27.52 1.08 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.196 0.522 . . . . 2.91 111.726 -173.331 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -115.2 -38.93 3.72 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 115.383 -0.826 . . . . 2.7 109.536 176.398 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 71.78 95.76 0.07 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 114.986 -1.007 . . . . 2.34 111.106 176.61 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 1.7 t -112.4 139.09 38.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.847 -0.615 . . . . 0.99 109.959 178.787 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.963 ' HG3' HG22 ' A' ' 36' ' ' THR . 1.2 mt-10 -80.06 146.45 31.93 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.791 0.329 . . . . 1.53 110.825 179.192 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 51.3 mt . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.575 -0.726 . . . . 1.57 110.689 -178.736 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.681 0 N-CA-C 111.394 -0.682 . . . . 2.17 111.394 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 79.33 -114.82 3.97 Favored Glycine 0 N--CA 1.445 -0.718 0 C-N-CA 120.849 -0.691 . . . . 1.97 112.52 175.836 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.05 138.78 31.34 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.943 0.401 . . . . 3.58 110.839 -175.595 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.93 0 CA-C-O 118.241 -0.885 . . . . 4.6 109.823 179.195 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PRO . . . . . 0.423 ' HB2' ' O ' ' A' ' 24' ' ' SER . 6.1 Cg_endo . . . . . 0 N--CA 1.477 0.545 0 N-CA-C 110.378 -0.662 . . . . 6.18 110.378 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -76.98 89.64 3.54 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.999 0.428 . . . . 5.71 110.514 179.699 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.62 -78.59 2.0 Allowed Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.889 -0.596 . . . . 3.45 112.182 179.772 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.423 ' O ' ' HB2' ' A' ' 21' ' ' PRO . 27.8 p -119.24 -177.4 3.34 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 110.449 -0.204 . . . . 2.44 110.449 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.422 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 4.2 mt-10 -51.93 144.55 11.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.275 -0.42 . . . . 1.64 110.818 172.598 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -119.81 -15.48 7.82 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-O 121.093 0.473 . . . . 0.93 110.165 174.732 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.3 m -166.3 135.61 3.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.624 -0.717 . . . . 1.61 110.086 -179.137 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -140.69 123.7 9.98 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 115.782 -0.645 . . . . 1.6 110.019 -179.008 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -79.91 -30.05 2.44 Favored 'Trans proline' 0 N--CA 1.475 0.41 0 C-N-CA 123.354 2.703 . . . . 1.87 112.8 177.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.4 t -76.43 -20.69 56.82 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.465 0.65 . . . . 2.18 109.571 -178.355 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.4 tttm -105.26 136.17 19.23 Favored Pre-proline 0 C--N 1.316 -0.865 0 CA-C-N 115.165 -0.925 . . . . 2.75 109.345 177.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.467 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 19.7 Cg_endo -60.21 137.87 77.78 Favored 'Trans proline' 0 C--O 1.239 0.53 0 C-N-CA 122.417 2.078 . . . . 1.38 112.274 178.873 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -141.12 78.04 0.29 Allowed Glycine 0 N--CA 1.446 -0.685 0 CA-C-N 115.089 -0.959 . . . . 0.97 110.869 -179.584 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.502 ' HG3' ' CE2' ' A' ' 96' ' ' TRP . 0.3 OUTLIER -93.86 174.26 7.26 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 110.291 -0.263 . . . . 1.93 110.291 -177.04 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.4 ttpp -120.53 107.02 12.35 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.821 0.344 . . . . 2.64 110.507 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.456 ' HB ' ' O ' ' A' ' 145' ' ' VAL . 7.3 p -107.5 165.39 11.44 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.689 -0.404 . . . . 0.68 110.232 177.188 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.474 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 62.5 t30 -58.15 -38.93 77.54 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.917 -0.583 . . . . 1.47 110.684 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -65.14 -39.53 93.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.03 -0.532 . . . . 1.04 110.996 -178.729 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.475 ' HB2' ' HA ' ' A' ' 97' ' ' SER . 0.9 OUTLIER -60.19 -58.84 6.78 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.216 -0.447 . . . . 0.8 110.809 -178.89 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 20.8 mt-30 -66.82 -26.51 66.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.961 -0.563 . . . . 1.75 110.981 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.474 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 56.6 t80 -60.25 -63.69 1.21 Allowed 'General case' 0 C--O 1.22 -0.498 0 CA-C-N 116.182 -0.463 . . . . 0.64 110.378 176.216 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.52 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -60.24 -28.56 68.13 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 116.593 -0.276 . . . . 1.13 111.0 -174.47 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.481 ' O ' HG13 ' A' ' 47' ' ' VAL . 6.0 tt0 -62.71 -55.9 22.51 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.034 0.445 . . . . 1.3 111.288 177.687 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -86.56 -26.44 24.5 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.857 0.361 . . . . 0.5 111.963 -176.514 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 94.7 t -88.8 -57.59 4.12 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 N-CA-C 111.928 0.344 . . . . 0.3 111.928 -177.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.708 HG22 ' HB3' ' A' ' 136' ' ' LYS . 58.5 t -81.97 -64.45 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 112.33 0.493 . . . . 0.26 112.33 -169.243 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' VAL . . . . . 0.481 HG13 ' O ' ' A' ' 43' ' ' GLN . 0.7 OUTLIER -66.81 -30.81 50.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 C-N-CA 120.21 -0.596 . . . . 0.83 110.967 -175.162 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -62.37 -42.25 99.27 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 120.919 -0.312 . . . . 2.4 111.304 177.555 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.441 HG21 ' HE2' ' A' ' 136' ' ' LYS . 2.8 p -69.42 -33.57 73.17 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 120.807 0.337 . . . . 0.55 110.876 179.513 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.611 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.2 OUTLIER -67.8 -41.48 83.11 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.997 -0.547 . . . . 0.33 109.698 176.439 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 15.0 t-105 -59.02 -36.78 75.54 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.153 -0.931 . . . . 0.39 111.538 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.8 mttm -82.98 7.69 14.86 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.025 0.38 . . . . 2.24 112.025 -174.745 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.444 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 13.1 t-80 -89.12 131.53 35.22 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.927 -0.397 . . . . 0.39 109.927 176.386 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -80.1 21.58 0.57 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.289 -0.414 . . . . 1.91 111.702 -175.257 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.444 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.2 OUTLIER -126.07 -6.43 6.64 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.3 0.571 . . . . 0.93 109.629 174.432 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.669 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -97.61 10.63 39.42 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.456 0.646 . . . . 0.28 110.264 179.514 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.467 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 57.4 p-90 -68.67 -31.68 3.14 Favored Pre-proline 0 CA--C 1.545 0.78 0 N-CA-C 113.954 1.094 . . . . 0.58 113.954 -175.608 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' PRO . . . . . 0.467 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 16.7 Cg_exo -68.52 -13.19 36.8 Favored 'Trans proline' 0 C--N 1.363 1.335 0 CA-C-N 121.193 1.462 . . . . 0.47 112.103 178.246 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.479 ' CE2' HD11 ' A' ' 122' ' ' ILE . 2.4 m-85 -104.19 11.64 34.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.272 -0.422 . . . . 1.11 110.964 -178.546 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.417 ' CD1' ' HA ' ' A' ' 57' ' ' TRP . 2.6 m-30 -66.08 -43.91 85.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.089 -0.505 . . . . 0.63 111.433 -178.839 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -95.7 133.49 25.51 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.873 -0.603 . . . . 1.63 110.432 -175.611 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.456 ' HA ' ' OD1' ' A' ' 82' ' ' ASP . 18.3 Cg_endo -61.11 133.33 46.38 Favored 'Trans proline' 0 C--O 1.237 0.448 0 C-N-CA 122.783 2.322 . . . . 0.87 112.232 -179.755 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 1.7 t -68.65 113.16 4.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.868 0.842 . . . . 0.88 110.784 179.34 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.434 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.3 OUTLIER -109.97 -0.88 17.97 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.803 -1.09 . . . . 1.85 109.39 177.216 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.434 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 78.03 -72.99 0.08 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 114.631 -1.168 . . . . 1.29 110.054 -171.189 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 31.1 mm -68.22 -44.64 83.93 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 116.577 -0.283 . . . . 1.89 111.585 -173.069 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 3.2 tptp -63.51 -19.9 65.16 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.307 0.484 . . . . 2.99 112.307 -176.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.458 ' HB3' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -114.02 10.16 17.47 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 122.19 -0.318 . . . . 1.66 111.173 -179.684 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 61.23 42.53 11.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.611 0.72 . . . . 1.74 110.637 179.241 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.633 HD21 ' HD3' ' B' ' 312' ' ' ALY . 0.2 OUTLIER -119.51 73.93 16.27 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 114.943 -1.026 . . . . 1.61 110.555 -175.618 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -79.51 -34.48 1.03 Allowed 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 121.731 1.621 . . . . 1.3 112.967 -176.5 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -89.71 1.86 55.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.345 0.593 . . . . 1.97 110.785 -176.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.451 ' HB2' ' HB3' ' A' ' 70' ' ' LEU . 8.7 t80 -61.85 -50.47 72.12 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.473 -0.785 . . . . 1.13 111.029 -178.803 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -75.75 2.9 10.91 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.536 -0.757 . . . . 0.91 111.529 -174.581 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.7 mttt -89.91 -25.23 21.06 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.317 0.58 . . . . 2.86 110.015 178.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.5 mt -111.91 -45.86 5.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.574 -0.739 . . . . 1.0 110.292 -178.571 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 35.1 mm -94.66 121.84 45.6 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-N 116.005 -0.543 . . . . 0.75 110.257 -178.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.513 ' O ' ' HD3' ' A' ' 80' ' ' PRO . 0.0 OUTLIER -88.87 -26.12 21.79 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.956 -0.565 . . . . 1.99 110.553 -177.654 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -113.18 84.72 7.54 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 115.953 -0.567 . . . . 2.05 109.922 177.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.513 ' HD3' ' O ' ' A' ' 78' ' ' LYS . 6.4 Cg_exo -73.32 94.17 0.83 Allowed 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.98 2.453 . . . . 0.89 112.137 -177.188 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -130.62 155.79 45.97 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.274 0.559 . . . . 0.82 110.739 -178.655 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.456 ' OD1' ' HA ' ' A' ' 62' ' ' PRO . 1.7 p-10 -140.61 -119.78 0.12 Allowed 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.876 -1.057 . . . . 1.42 109.098 -175.793 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 5.2 ttp -130.21 -20.0 3.09 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.912 0.387 . . . . 0.8 110.547 177.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -85.63 -30.25 24.64 Favored Glycine 0 N--CA 1.44 -1.068 0 N-CA-C 110.442 -1.063 . . . . 0.32 110.442 -179.36 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.77 -47.44 62.93 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.504 -0.348 . . . . 0.95 110.363 175.868 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.543 HG23 ' SG ' ' A' ' 101' ' ' CYS . 58.4 mt -56.3 -46.97 81.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.61 -0.723 . . . . 0.97 110.126 176.652 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.466 ' O ' ' HG2' ' A' ' 91' ' ' GLU . 0.0 OUTLIER -67.74 -34.89 77.73 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 115.772 -0.649 . . . . 1.15 110.614 -178.508 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.431 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 21.3 tptt -67.05 -34.77 78.39 Favored 'General case' 0 C--N 1.339 0.124 0 CA-C-O 120.828 0.347 . . . . 2.46 110.544 -178.567 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 7.4 mtp180 -73.25 -33.5 65.31 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.032 0.444 . . . . 1.16 110.468 177.324 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 9.3 mt -68.0 -51.34 48.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.901 -0.591 . . . . 0.49 111.239 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 0.5 OUTLIER -66.13 -26.03 67.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.934 0.397 . . . . 1.39 111.101 -178.089 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.431 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 1.7 m-80 -90.95 5.98 46.54 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.261 -0.427 . . . . 1.3 111.012 -179.022 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 49.7 51.67 16.05 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 121.381 0.61 . . . . 1.75 111.351 -178.843 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' TYR . . . . . 0.422 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 69.5 t80 -74.32 -21.96 59.47 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.429 0.633 . . . . 0.96 110.657 177.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -102.7 170.24 8.13 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.862 0.839 . . . . 1.28 112.017 -174.125 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' TRP . . . . . 0.502 ' CE2' ' HG3' ' A' ' 34' ' ' ARG . 2.1 t90 -85.73 -42.11 14.52 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 113.538 -1.664 . . . . 1.05 108.805 168.411 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.475 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 23.2 t -155.79 176.3 12.81 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.754 -1.112 . . . . 1.0 109.944 -171.782 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.26 -15.37 61.42 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.869 0.366 . . . . 0.66 110.793 -177.87 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.48 -30.91 69.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.131 0.491 . . . . 0.85 110.508 176.12 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -75.88 -30.83 58.98 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.541 -0.754 . . . . 2.44 109.883 -179.32 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' CYS . . . . . 0.543 ' SG ' HG23 ' A' ' 86' ' ' ILE . 0.5 OUTLIER -81.81 -22.11 37.28 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.596 -0.729 . . . . 0.95 110.43 -177.994 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 7.5 mmt -53.33 -35.29 60.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.655 -0.702 . . . . 1.13 110.617 177.558 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.13 -50.32 48.99 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.552 -0.749 . . . . 2.96 110.072 -178.738 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -64.53 -40.44 95.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.946 -0.57 . . . . 1.87 110.809 -176.772 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.611 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -61.8 -44.93 95.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.464 . . . . 0.38 110.629 177.791 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.13 -41.32 99.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.129 -0.487 . . . . 0.97 110.202 177.709 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 54.9 m -63.38 -47.68 81.04 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.722 -0.672 . . . . 0.43 111.71 -178.322 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.416 ' HG3' ' N ' ' A' ' 109' ' ' PHE . 0.0 OUTLIER -58.85 -35.72 73.39 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.601 0.239 . . . . 0.88 111.206 -177.907 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 109' ' ' PHE . . . . . 0.416 ' N ' ' HG3' ' A' ' 108' ' ' MET . 6.1 m-85 -72.3 -49.22 36.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.022 0.439 . . . . 0.29 110.802 -178.094 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -67.93 -33.36 74.53 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.099 -0.501 . . . . 0.66 110.792 -177.748 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -53.01 -42.79 65.97 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.382 -0.826 . . . . 1.84 111.023 177.582 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -67.61 -40.06 84.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.08 0.466 . . . . 0.63 110.419 179.806 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -69.38 -19.06 63.83 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.239 -0.437 . . . . 0.81 111.269 -178.497 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 69.5 mt -92.18 -49.64 12.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.26 -0.427 . . . . 0.55 110.847 179.604 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -68.55 -38.44 80.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.922 -0.581 . . . . 1.22 110.831 -176.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' ASN . . . . . 0.42 ' HB2' HG23 ' A' ' 123' ' ' VAL . 18.3 m120 -99.99 177.9 4.96 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.033 -0.531 . . . . 1.04 110.812 -176.611 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -104.37 158.33 32.18 Favored Pre-proline 0 C--N 1.322 -0.623 0 N-CA-C 109.252 -0.647 . . . . 3.47 109.252 175.527 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 118' ' ' PRO . . . . . 0.77 ' HA ' HG11 ' A' ' 123' ' ' VAL . 22.7 Cg_exo -63.11 -7.54 12.03 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.365 2.043 . . . . 0.96 112.681 178.718 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.56 5.37 47.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.048 -0.523 . . . . 1.23 111.284 177.855 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -91.54 146.99 23.34 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.088 0.47 . . . . 1.34 111.367 -174.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -57.34 -46.72 83.0 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.075 -0.966 . . . . 1.44 111.282 -176.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ILE . . . . . 0.479 HD11 ' CE2' ' A' ' 59' ' ' PHE . 0.9 OUTLIER -65.67 -32.16 56.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.132 -0.485 . . . . 0.42 111.075 -177.473 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.77 HG11 ' HA ' ' A' ' 118' ' ' PRO . 1.0 OUTLIER -66.1 -44.07 92.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.194 0.521 . . . . 0.35 109.686 176.192 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.81 -32.04 71.41 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.519 -0.764 . . . . 0.52 109.91 178.328 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' MET . . . . . 0.423 ' O ' HD13 ' A' ' 129' ' ' LEU . 23.3 mtt -73.13 -45.32 57.53 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.471 -0.786 . . . . 0.62 110.57 179.171 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.04 -36.1 67.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.894 0.378 . . . . 0.31 111.236 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' GLN . . . . . 0.418 ' O ' ' HD2' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.21 -49.17 78.69 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.063 -0.517 . . . . 1.94 111.099 178.618 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -70.57 -37.1 73.91 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.08 0.467 . . . . 0.32 110.516 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.669 HD21 ' HA ' ' A' ' 56' ' ' ALA . 1.8 mp -59.55 -45.49 91.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.352 -0.84 . . . . 0.33 111.247 -179.138 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -65.95 -22.05 66.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.287 -0.415 . . . . 1.47 111.917 -174.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' LYS . . . . . 0.508 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.6 OUTLIER -64.67 -39.81 94.32 Favored 'General case' 0 CA--C 1.518 -0.255 0 N-CA-C 109.789 -0.449 . . . . 2.24 109.789 179.858 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 132' ' ' ILE . . . . . 0.449 HD12 HD23 ' A' ' 50' ' ' LEU . 2.7 mt -73.74 -34.0 39.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.701 -0.682 . . . . 1.23 110.023 177.811 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 133' ' ' PHE . . . . . 0.512 ' O ' HG23 ' A' ' 137' ' ' VAL . 37.0 t80 -57.92 -62.19 1.99 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.627 -0.715 . . . . 0.46 110.556 178.619 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.36 -28.19 69.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.8 0.334 . . . . 0.64 110.755 -177.554 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.508 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.65 -51.24 70.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.793 -0.639 . . . . 1.61 111.337 178.055 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 136' ' ' LYS . . . . . 0.708 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -76.16 -29.01 57.59 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.912 -0.586 . . . . 1.52 110.786 -178.417 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 133' ' ' PHE . 53.9 t -70.8 -29.38 37.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.118 -0.492 . . . . 0.35 110.753 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -69.25 -17.57 63.77 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.095 0.474 . . . . 0.5 110.549 177.614 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -106.18 6.47 30.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.118 -0.492 . . . . 1.76 110.949 179.683 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 140' ' ' MET . . . . . 0.512 ' HG3' ' HA ' ' A' ' 137' ' ' VAL . 0.4 OUTLIER -70.15 149.33 96.11 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.082 -0.508 . . . . 0.86 110.322 177.214 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 141' ' ' PRO . . . . . 0.459 ' C ' ' H ' ' A' ' 143' ' ' GLU . 71.8 Cg_endo -75.9 102.96 1.66 Allowed 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 121.959 1.772 . . . . 0.67 111.753 -178.375 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -78.12 25.33 0.22 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.389 0.614 . . . . 2.91 110.39 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.459 ' H ' ' C ' ' A' ' 141' ' ' PRO . 3.4 mm-40 -101.4 -34.17 9.7 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 115.085 -0.961 . . . . 2.7 108.822 176.892 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 60.15 74.81 0.43 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 114.275 -1.329 . . . . 2.34 110.029 -178.682 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 145' ' ' VAL . . . . . 0.456 ' O ' ' HB ' ' A' ' 36' ' ' THR . 21.9 t -97.14 139.48 19.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.364 -0.834 . . . . 0.99 109.055 -176.221 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 146' ' ' GLU . . . . . 0.443 ' HA ' ' HA ' ' A' ' 36' ' ' THR . 11.8 tt0 -86.1 153.15 22.3 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 120.593 -0.443 . . . . 1.53 110.253 179.038 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 147' ' ' LEU . . . . . 0.453 HD11 ' HA ' ' A' ' 37' ' ' ASN . 89.5 mt . . . . . 0 C--O 1.251 1.168 0 CA-C-O 118.474 -0.774 . . . . 1.57 110.86 -176.481 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.745 0 N-CA-C 111.902 -0.479 . . . . 2.17 111.902 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 312' ' ' ALY . . . . . 0.633 ' HD3' HD21 ' A' ' 70' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 153.49 -33.5 0.76 Allowed Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 111.036 -0.826 . . . . 1.97 111.036 -178.133 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.28 107.1 5.65 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.651 -0.5 . . . . 3.58 109.651 176.765 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 1.6 mttm . . . . . 0 C--O 1.246 0.913 0 CA-C-O 118.531 -0.747 . . . . 4.6 110.338 -178.09 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 9.2 p . . . . . 0 N--CA 1.453 -0.315 0 CA-C-O 121.808 0.813 . . . . 0.93 108.853 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -147.8 132.7 18.08 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 114.504 -1.225 . . . . 1.61 109.06 177.218 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.415 ' O ' ' HE3' ' A' ' 31' ' ' LYS . 23.8 t-20 -153.05 125.85 4.05 Favored Pre-proline 0 C--N 1.316 -0.876 0 CA-C-N 116.037 -0.529 . . . . 1.6 109.933 -178.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -65.85 -46.44 4.92 Favored 'Trans proline' 0 N--CA 1.474 0.378 0 C-N-CA 123.421 2.747 . . . . 1.87 113.271 -176.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.8 m -66.11 -32.53 74.04 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.293 0.568 . . . . 2.18 110.535 -177.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.415 ' HE3' ' O ' ' A' ' 28' ' ' ASN . 0.8 OUTLIER -78.52 123.66 85.55 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 115.379 -0.828 . . . . 2.75 109.73 178.215 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -48.16 136.25 24.38 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.811 2.341 . . . . 1.38 112.97 178.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.449 ' HA2' ' O ' ' A' ' 95' ' ' TYR . . . -162.64 62.32 0.27 Allowed Glycine 0 N--CA 1.444 -0.809 0 N-CA-C 110.816 -0.914 . . . . 0.97 110.816 179.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -80.09 167.9 19.81 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.006 0.431 . . . . 1.93 110.488 -177.468 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.514 ' HB3' HD12 ' A' ' 147' ' ' LEU . 4.8 mmtm -102.95 108.44 19.63 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 116.332 -0.395 . . . . 2.64 110.048 178.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.673 HG22 ' HG3' ' A' ' 146' ' ' GLU . 5.7 p -109.0 171.65 7.31 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 120.774 -0.37 . . . . 0.68 110.826 174.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -61.69 -50.51 72.19 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.801 -0.636 . . . . 1.47 110.937 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.584 ' HG2' ' SD ' ' A' ' 140' ' ' MET . 1.3 mt-30 -56.68 -44.37 81.38 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.714 0.292 . . . . 1.04 110.983 179.115 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.445 ' HB2' ' HA ' ' A' ' 97' ' ' SER . 0.8 OUTLIER -59.42 -56.0 27.52 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.088 -0.505 . . . . 0.8 111.13 -178.53 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -65.54 -33.48 76.02 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.013 -0.539 . . . . 1.75 110.48 -179.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.658 ' CE1' ' HG2' ' A' ' 140' ' ' MET . 61.2 t80 -58.17 -63.89 1.1 Allowed 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.758 -0.656 . . . . 0.64 110.858 178.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.473 ' O ' HG12 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -62.65 -29.61 70.75 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.721 -0.392 . . . . 1.13 110.932 -171.961 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.484 ' HA ' HD13 ' A' ' 90' ' ' LEU . 4.5 tt0 -62.16 -55.83 24.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.778 -0.646 . . . . 1.3 110.874 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -87.2 -29.63 21.6 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.928 0.394 . . . . 0.5 111.91 -177.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.419 HG11 ' CZ ' ' A' ' 41' ' ' TYR . 93.7 t -88.39 -57.66 4.07 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 N-CA-C 112.443 0.534 . . . . 0.3 112.443 -174.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.483 HG22 ' HB3' ' A' ' 136' ' ' LYS . 81.7 t -79.24 -66.27 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 C-N-CA 120.782 -0.367 . . . . 0.26 111.953 -170.212 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.473 HG12 ' O ' ' A' ' 42' ' ' MET . 2.2 p -67.72 -35.43 72.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 C-N-CA 120.518 -0.473 . . . . 0.83 111.498 -174.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.8 mttt -67.31 -31.31 71.52 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 122.013 -0.43 . . . . 2.4 111.619 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 48.1 m -81.34 -36.88 29.16 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.84 -0.344 . . . . 0.55 110.634 176.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.633 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -55.45 -40.46 71.6 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 108.703 -0.851 . . . . 0.33 108.703 171.326 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 10.5 t-105 -60.14 -37.69 80.84 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.441 -1.254 . . . . 0.39 111.912 178.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -77.23 -5.15 48.21 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.212 0.449 . . . . 2.24 112.212 -172.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -72.62 130.41 40.51 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.672 -0.492 . . . . 0.39 109.672 176.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -75.55 -4.76 41.73 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.284 -0.416 . . . . 1.91 111.214 -174.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -100.06 -3.71 31.4 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.203 0.525 . . . . 0.93 109.866 175.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.792 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -93.81 10.06 34.67 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.856 -0.611 . . . . 0.28 110.913 -178.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.551 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 48.9 p-90 -65.46 -33.01 6.89 Favored Pre-proline 0 CA--C 1.548 0.889 0 N-CA-C 113.57 0.952 . . . . 0.58 113.57 -175.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.551 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 12.7 Cg_exo -71.54 -6.93 20.2 Favored 'Trans proline' 0 C--N 1.365 1.44 0 CA-C-N 121.088 1.424 . . . . 0.47 112.104 177.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -105.97 14.2 28.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.125 0.488 . . . . 1.11 110.137 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 10.4 m-30 -82.0 -11.21 58.95 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.839 -0.618 . . . . 0.63 110.714 179.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -122.19 125.09 26.7 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 116.281 -0.418 . . . . 1.63 111.06 -175.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.609 ' HA ' ' OD1' ' A' ' 82' ' ' ASP . 50.3 Cg_endo -71.07 150.93 61.06 Favored 'Trans proline' 0 C--O 1.236 0.422 0 C-N-CA 122.795 2.33 . . . . 0.87 112.49 -179.116 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 38.3 t -73.34 92.24 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 122.061 0.934 . . . . 0.88 110.395 176.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -87.11 -10.18 53.5 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.683 -1.144 . . . . 1.85 109.229 175.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 76.18 -45.26 0.51 Allowed 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 114.573 -1.194 . . . . 1.29 111.745 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 41.5 mm -80.04 -53.01 13.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 120.751 0.31 . . . . 1.89 110.639 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -53.28 -52.86 57.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.742 -0.663 . . . . 2.99 112.328 -177.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.524 HD23 HD11 ' A' ' 70' ' ' LEU . 2.2 tp -90.66 0.24 57.46 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.26 -0.427 . . . . 1.66 111.108 -177.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 57.23 56.6 5.05 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.688 -0.687 . . . . 1.74 112.083 178.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.524 HD11 HD23 ' A' ' 68' ' ' LEU . 7.5 mt -121.21 79.05 34.87 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 115.664 -0.698 . . . . 1.61 110.357 178.075 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -78.63 -37.52 0.65 Allowed 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.575 2.183 . . . . 1.3 113.131 -175.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.3 p-10 -86.62 -3.96 59.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.284 0.564 . . . . 1.97 110.604 -178.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -58.83 -39.34 80.94 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.328 -0.851 . . . . 1.13 110.496 175.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . 0.413 ' ND1' ' HG2' ' A' ' 80' ' ' PRO . 3.2 m-70 -76.94 0.77 19.82 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.228 -0.896 . . . . 0.91 111.417 -176.584 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.9 mttt -109.81 -41.38 4.53 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.448 -0.342 . . . . 2.86 111.099 -178.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.2 mt -86.43 -49.85 14.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 120.901 0.381 . . . . 1.0 111.082 -178.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.482 HD11 ' HB2' ' A' ' 115' ' ' TYR . 20.0 mm -80.57 131.8 33.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.329 -0.396 . . . . 0.75 110.324 -177.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.4 -56.68 8.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.029 -0.532 . . . . 1.99 111.214 -175.152 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.776 ' HB2' HG21 ' A' ' 107' ' ' THR . 0.3 OUTLIER -122.27 89.75 49.05 Favored Pre-proline 0 C--N 1.324 -0.538 0 N-CA-C 110.067 -0.345 . . . . 2.05 110.067 178.432 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.413 ' HG2' ' ND1' ' A' ' 74' ' ' HIS . 32.4 Cg_exo -60.99 91.97 0.1 OUTLIER 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 123.038 2.492 . . . . 0.89 112.345 177.617 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 1.7 mmt -134.05 167.29 20.9 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.736 -0.665 . . . . 0.82 109.763 -179.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.609 ' OD1' ' HA ' ' A' ' 62' ' ' PRO . 5.6 p-10 -143.05 -116.71 0.1 Allowed 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.289 -0.869 . . . . 1.42 109.696 -173.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -128.33 -22.95 3.31 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.954 0.407 . . . . 0.8 110.337 177.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -82.75 -23.12 56.77 Favored Glycine 0 N--CA 1.441 -1.026 0 N-CA-C 110.738 -0.945 . . . . 0.32 110.738 -178.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.85 -41.66 22.82 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.304 -0.448 . . . . 0.95 110.552 177.305 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.425 HD12 ' O ' ' A' ' 82' ' ' ASP . 47.0 mt -58.42 -51.0 76.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.827 -0.624 . . . . 0.97 110.153 175.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.53 -24.68 66.42 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.903 -0.59 . . . . 1.15 111.185 -178.69 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.35 -45.42 76.41 Favored 'General case' 0 C--O 1.23 0.045 0 CA-C-O 120.772 0.32 . . . . 2.46 110.752 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.588 ' HD2' ' CD2' ' A' ' 94' ' ' TYR . 6.3 mtm180 -69.31 -30.54 68.62 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.345 -0.388 . . . . 1.16 110.757 177.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.484 HD13 ' HA ' ' A' ' 43' ' ' GLN . 12.6 mt -70.54 -49.62 46.24 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.441 -0.345 . . . . 0.49 111.284 179.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -70.04 -21.53 63.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.812 0.339 . . . . 1.39 111.174 -177.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -96.53 5.66 50.33 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.181 -0.463 . . . . 1.3 110.618 179.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 53.36 54.25 10.46 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.84 -0.618 . . . . 1.75 111.478 178.295 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . 0.588 ' CD2' ' HD2' ' A' ' 89' ' ' ARG . 8.5 t80 -70.67 -44.19 67.56 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.292 -0.413 . . . . 0.96 111.786 -178.448 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.458 ' CD1' ' HB3' ' A' ' 100' ' ' GLU . 0.3 OUTLIER -91.7 -172.35 3.19 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.67 0.748 . . . . 1.28 111.39 -179.272 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -94.59 -42.81 8.61 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 114.132 -1.395 . . . . 1.05 108.898 175.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.445 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 9.4 t -145.95 170.66 16.16 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.014 -0.994 . . . . 1.0 109.619 -176.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -69.16 -12.12 61.4 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.978 0.362 . . . . 0.66 111.978 -174.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.27 -26.76 68.93 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.845 0.355 . . . . 0.85 111.094 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.458 ' HB3' ' CD1' ' A' ' 95' ' ' TYR . 4.4 tp10 -82.13 -22.92 35.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.014 0.435 . . . . 2.44 110.37 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.407 ' SG ' HG23 ' A' ' 86' ' ' ILE . 1.6 t -76.65 -21.76 55.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.75 -0.659 . . . . 0.95 110.112 178.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -21.18 59.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.798 -0.637 . . . . 1.13 110.778 178.402 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -73.64 -57.18 4.17 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 116.022 -0.536 . . . . 2.96 110.602 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.99 -36.98 80.94 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.042 -0.526 . . . . 1.87 111.005 -176.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.633 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -61.19 -39.59 90.74 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.062 0.458 . . . . 0.38 110.847 177.021 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -67.46 -39.37 85.31 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.921 -0.581 . . . . 0.97 110.709 -178.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . 0.776 HG21 ' HB2' ' A' ' 79' ' ' ASN . 47.5 m -70.69 -39.74 73.3 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.236 -0.438 . . . . 0.43 111.675 -177.444 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.511 ' HG3' ' N ' ' A' ' 109' ' ' PHE . 0.0 OUTLIER -54.05 -37.86 64.59 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.745 0.307 . . . . 0.88 111.278 -178.913 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . 0.511 ' N ' ' HG3' ' A' ' 108' ' ' MET . 7.3 m-85 -76.95 -43.73 34.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.362 -0.381 . . . . 0.29 110.98 -178.218 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -67.19 -39.96 86.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.042 0.449 . . . . 0.66 110.716 -177.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -49.85 -46.53 51.45 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.246 -0.888 . . . . 1.84 111.139 177.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.76 -39.98 91.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.325 -0.398 . . . . 0.63 110.773 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -67.14 -29.85 69.69 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.339 -0.391 . . . . 0.81 111.25 -177.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 37.0 mt -84.64 -54.95 7.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.174 -0.466 . . . . 0.55 111.739 -176.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . 0.482 ' HB2' HD11 ' A' ' 77' ' ' ILE . 45.0 t80 -67.4 -40.04 85.58 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.763 0.316 . . . . 1.22 110.849 -176.099 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -97.56 152.74 18.72 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.132 -0.486 . . . . 1.04 110.592 -176.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.52 151.71 85.22 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 116.228 -0.442 . . . . 3.47 110.264 179.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . 0.568 ' HA ' HG11 ' A' ' 123' ' ' VAL . 29.7 Cg_endo -64.49 -7.15 13.52 Favored 'Trans proline' 0 CA--C 1.533 0.435 0 C-N-CA 122.978 2.452 . . . . 0.96 113.068 -177.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -102.46 5.51 39.58 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.793 0.33 . . . . 1.23 111.281 178.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -82.93 155.4 24.06 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.098 0.475 . . . . 1.34 110.851 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.82 -40.54 88.05 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.458 -0.792 . . . . 1.44 110.423 -177.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.3 tp -62.04 -36.95 77.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.99 -0.55 . . . . 0.42 110.67 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.568 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.3 t -67.72 -46.38 82.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 109.877 -0.416 . . . . 0.35 109.877 177.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.37 -38.38 74.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.541 -0.754 . . . . 0.52 110.031 178.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . 0.488 ' O ' HD13 ' A' ' 129' ' ' LEU . 25.9 mtt -69.78 -48.81 57.81 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.309 -0.86 . . . . 0.62 110.785 178.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.27 -40.46 67.85 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.274 -0.421 . . . . 0.31 111.372 -179.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -58.23 -42.54 86.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.021 -0.536 . . . . 1.94 111.039 179.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -77.58 -38.26 48.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.985 0.422 . . . . 0.32 110.66 -179.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.792 HD21 ' HA ' ' A' ' 56' ' ' ALA . 4.6 mp -56.48 -38.1 71.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.52 -0.764 . . . . 0.33 110.676 177.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -62.23 -23.78 66.86 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.423 -0.808 . . . . 1.47 111.953 -178.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.42 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 1.3 mptt -68.18 -47.57 67.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.69 0.281 . . . . 2.24 110.46 -176.102 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.5 HD12 ' HA ' ' A' ' 50' ' ' LEU . 0.1 OUTLIER -71.98 -23.2 21.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.308 -0.405 . . . . 1.23 110.467 179.601 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.423 ' O ' HG23 ' A' ' 137' ' ' VAL . 24.7 t80 -61.56 -62.02 2.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.091 -0.504 . . . . 0.46 110.213 175.136 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 2.2 pp -65.98 -28.41 68.88 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.928 0.394 . . . . 0.64 110.818 -178.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.445 ' HB2' ' HA ' ' A' ' 132' ' ' ILE . 0.1 OUTLIER -54.62 -50.93 66.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.571 -0.741 . . . . 1.61 111.383 178.997 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . 0.483 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.2 OUTLIER -82.28 -24.42 34.71 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.47 -0.786 . . . . 1.52 110.981 -176.236 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.478 ' O ' ' HB2' ' A' ' 140' ' ' MET . 41.1 t -74.01 -36.4 44.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.809 -0.632 . . . . 0.35 110.852 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.19 -19.29 65.54 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.081 0.467 . . . . 0.5 110.238 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -100.42 6.04 44.36 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.55 -0.75 . . . . 1.76 110.447 -178.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . 0.658 ' HG2' ' CE1' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -61.18 150.38 79.43 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 115.865 -0.607 . . . . 0.86 110.898 177.218 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -61.23 103.22 0.24 Allowed 'Trans proline' 0 N--CA 1.461 -0.426 0 C-N-CA 122.161 1.907 . . . . 0.67 110.88 173.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -73.4 3.2 6.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.899 -0.591 . . . . 2.91 112.122 -173.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . 0.408 ' O ' ' HB3' ' A' ' 144' ' ' GLU . 0.9 OUTLIER -112.44 -36.72 5.18 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 116.049 -0.523 . . . . 2.7 110.949 -176.148 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.57 ' OE2' ' HB2' ' A' ' 38' ' ' GLN . 5.9 tp10 74.28 135.37 0.05 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 114.991 -1.004 . . . . 2.34 110.845 -178.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 39.5 t -139.39 108.6 3.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.23 -0.896 . . . . 0.99 109.268 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.673 ' HG3' HG22 ' A' ' 36' ' ' THR . 3.4 tt0 -67.27 130.92 44.64 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.464 -0.569 . . . . 1.53 109.464 177.206 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.514 HD12 ' HB3' ' A' ' 35' ' ' LYS . 11.1 mt . . . . . 0 C--O 1.252 1.216 0 CA-C-O 118.493 -0.765 . . . . 1.57 110.27 -175.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 7.9 p . . . . . 0 C--O 1.236 0.343 0 CA-C-O 121.784 0.802 . . . . 0.93 108.994 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -151.47 145.31 25.12 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 114.713 -1.131 . . . . 1.61 108.997 178.574 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.439 ' HB3' ' CB ' ' A' ' 31' ' ' LYS . 11.9 t-20 -156.15 125.52 3.13 Favored Pre-proline 0 C--N 1.314 -0.935 0 CA-C-N 116.568 -0.287 . . . . 1.6 110.41 176.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -73.94 -39.96 1.55 Allowed 'Trans proline' 0 N--CA 1.473 0.308 0 C-N-CA 123.23 2.62 . . . . 1.87 113.231 -178.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.5 m -80.25 -21.03 43.23 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.208 0.528 . . . . 2.18 110.529 -175.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.439 ' CB ' ' HB3' ' A' ' 28' ' ' ASN . 9.2 tttp -74.46 135.45 75.56 Favored Pre-proline 0 C--N 1.319 -0.734 0 CA-C-N 114.917 -1.038 . . . . 2.75 111.027 179.34 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -57.97 137.21 79.74 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.142 1.895 . . . . 1.38 111.49 169.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -173.17 90.93 0.09 OUTLIER Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 111.221 -0.752 . . . . 0.97 111.221 -176.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -110.35 177.9 4.55 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.923 0.392 . . . . 1.93 110.434 -177.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.439 ' HA ' HD22 ' A' ' 39' ' ' LEU . 7.4 mtpp -108.1 104.38 13.79 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.219 -0.446 . . . . 2.64 110.276 179.117 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.6 p -99.11 168.52 10.02 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.821 0.343 . . . . 0.68 110.466 177.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.496 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 6.7 t30 -62.08 -40.0 94.32 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 115.932 -0.576 . . . . 1.47 110.35 178.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -67.71 -40.6 84.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.764 0.316 . . . . 1.04 110.883 -178.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.551 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.5 OUTLIER -62.34 -49.83 74.01 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.117 0.484 . . . . 0.8 110.541 179.461 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 21.7 mm100 -70.38 -28.84 65.41 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.739 -0.664 . . . . 1.75 110.587 179.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.496 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 52.7 t80 -59.83 -63.9 1.14 Allowed 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.754 -0.657 . . . . 0.64 110.762 176.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.544 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -59.33 -31.9 69.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.579 0.228 . . . . 1.13 110.462 -174.901 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.468 ' O ' HG13 ' A' ' 47' ' ' VAL . 9.9 tt0 -56.12 -58.7 6.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.604 -0.726 . . . . 1.3 111.087 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -87.11 -27.19 23.25 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.105 -0.498 . . . . 0.5 112.323 -177.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 97.0 t -89.12 -57.59 4.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 112.347 0.499 . . . . 0.3 112.347 -175.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.544 HG23 ' HA ' ' A' ' 42' ' ' MET . 60.7 t -80.12 -65.93 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 C-N-CA 120.931 -0.308 . . . . 0.26 111.637 -170.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.468 HG13 ' O ' ' A' ' 43' ' ' GLN . 0.2 OUTLIER -66.1 -37.09 79.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.284 0 C-N-CA 120.7 -0.4 . . . . 0.83 111.266 -174.535 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -36.34 82.94 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.751 0.278 . . . . 2.4 111.751 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.442 HG21 ' HE2' ' A' ' 136' ' ' LYS . 9.9 m -79.05 -33.44 44.69 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.835 -0.346 . . . . 0.55 110.87 178.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.655 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -64.59 -36.17 83.36 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 121.486 0.66 . . . . 0.33 109.371 174.046 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 12.4 t-105 -61.96 -28.12 69.33 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.127 -0.942 . . . . 0.39 111.272 177.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 37.5 mtpt -92.41 28.81 1.85 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.104 0.478 . . . . 2.24 111.439 -176.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.517 ' HD2' HD11 ' A' ' 132' ' ' ILE . 14.5 t-80 -103.11 133.87 47.49 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.212 -0.449 . . . . 0.39 110.054 176.1 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.69 -11.4 60.92 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.306 -0.406 . . . . 1.91 111.789 -176.085 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.492 ' CG ' ' HG2' ' A' ' 125' ' ' MET . 0.2 OUTLIER -101.97 -4.46 26.08 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.912 0.387 . . . . 0.93 110.407 178.799 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.57 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -94.58 16.39 15.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.201 0.524 . . . . 0.28 110.802 -179.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.591 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 42.1 p-90 -70.44 -30.89 1.99 Allowed Pre-proline 0 CA--C 1.545 0.766 0 N-CA-C 113.706 1.002 . . . . 0.58 113.706 -174.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.591 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 6.4 Cg_exo -76.17 -4.92 15.71 Favored 'Trans proline' 0 C--N 1.359 1.108 0 C-N-CA 121.273 1.315 . . . . 0.47 111.252 172.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -109.15 45.81 1.03 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.246 -0.888 . . . . 1.11 109.893 -176.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.47 ' CE2' ' HA ' ' A' ' 57' ' ' TRP . 11.2 m-30 -120.99 -12.48 8.74 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.502 -0.772 . . . . 0.63 110.987 -176.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.424 ' HA ' ' HD2' ' A' ' 62' ' ' PRO . 1.1 mt-30 -123.28 113.37 29.48 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 116.252 -0.431 . . . . 1.63 110.816 -169.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.424 ' HD2' ' HA ' ' A' ' 61' ' ' GLN . 12.0 Cg_endo -56.45 129.81 36.72 Favored 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.418 2.079 . . . . 0.87 111.608 -178.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 20.5 t -65.02 103.39 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.708 0.766 . . . . 0.88 111.188 -176.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -110.21 30.54 6.66 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.029 -0.987 . . . . 1.85 109.283 174.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 55.68 -88.29 0.02 OUTLIER 'General case' 0 C--O 1.226 -0.18 0 CA-C-N 114.687 -1.142 . . . . 1.29 111.716 -178.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 40.7 mm -62.78 -34.47 65.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.475 -0.33 . . . . 1.89 111.397 -173.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -57.81 -29.83 65.23 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.952 -0.567 . . . . 2.99 112.025 -177.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.7 tp -128.06 14.91 6.81 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.864 0.364 . . . . 1.66 110.825 -177.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 61.26 56.08 2.78 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.474 -0.785 . . . . 1.74 111.351 179.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -120.15 71.4 16.68 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 115.959 -0.564 . . . . 1.61 110.564 174.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -84.43 -39.87 0.1 Allowed 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.638 2.225 . . . . 1.3 112.218 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -81.25 -14.69 57.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.337 0.589 . . . . 1.97 109.962 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.423 ' HE2' ' HA ' ' A' ' 80' ' ' PRO . 44.7 t80 -58.74 -40.51 84.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.139 -0.937 . . . . 1.13 110.593 177.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -77.72 1.9 18.53 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.49 -0.777 . . . . 0.91 111.557 -175.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -91.13 -47.42 7.54 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.397 0.618 . . . . 2.86 109.415 178.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.5 mp -88.92 -43.87 15.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.14 -0.936 . . . . 1.0 110.608 -177.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 35.2 mm -87.46 126.78 41.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.027 -0.533 . . . . 0.75 110.449 -178.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.9 mtmt -89.97 -23.34 21.57 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.725 -0.67 . . . . 1.99 110.948 -177.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -123.24 90.47 50.42 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 116.14 -0.482 . . . . 2.05 109.975 179.09 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.423 ' HA ' ' HE2' ' A' ' 73' ' ' TYR . 36.0 Cg_endo -67.19 93.44 0.34 Allowed 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.614 2.21 . . . . 0.89 112.5 -177.475 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 22.4 mmt -125.96 169.59 12.54 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.392 0.615 . . . . 0.82 111.036 -177.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.517 ' CG ' ' H ' ' A' ' 83' ' ' MET . 23.0 t70 -151.06 -142.15 0.12 Allowed 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.18 -1.373 . . . . 1.42 107.349 -177.16 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . 0.517 ' H ' ' CG ' ' A' ' 82' ' ' ASP . 0.1 OUTLIER -115.64 -15.17 11.42 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 108.3 -1.0 . . . . 0.8 108.3 176.177 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -80.04 -24.49 59.58 Favored Glycine 0 N--CA 1.441 -0.967 0 N-CA-C 109.653 -1.379 . . . . 0.32 109.653 178.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.99 -34.82 43.8 Favored 'General case' 0 N--CA 1.44 -0.953 0 CA-C-N 114.81 -0.695 . . . . 0.95 110.421 176.306 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 36.4 mm -58.3 -56.76 14.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.325 -0.852 . . . . 0.97 109.996 175.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.25 -34.49 66.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.247 -0.888 . . . . 1.15 110.891 177.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.608 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 0.1 OUTLIER -63.19 -52.98 60.16 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-O 120.599 0.238 . . . . 2.46 111.121 -176.868 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 8.0 mmm-85 -64.4 -32.98 74.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.516 -0.311 . . . . 1.16 111.135 -178.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 10.1 mt -69.81 -52.27 26.53 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.275 -0.42 . . . . 0.49 111.162 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -71.78 -26.23 62.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.911 0.386 . . . . 1.39 110.711 -177.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.608 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 1.2 t30 -76.14 -15.6 60.04 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.375 -0.375 . . . . 1.3 110.509 176.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 59.31 54.79 4.56 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 115.544 -0.753 . . . . 1.75 109.712 -176.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 25.1 t80 -74.72 -46.58 36.65 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.194 -0.912 . . . . 0.96 111.486 -176.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -107.17 -176.89 3.2 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.212 0.53 . . . . 1.28 111.208 -179.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -77.66 -43.34 31.63 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.228 -0.896 . . . . 1.05 111.307 -176.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -147.05 170.12 17.8 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-O 121.154 0.502 . . . . 1.0 111.825 -168.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.551 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -74.54 -10.55 59.66 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.788 -0.642 . . . . 0.66 111.527 -178.193 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 48.9 m -64.75 -24.09 67.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.273 0.559 . . . . 0.85 110.045 177.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -80.77 -38.56 28.35 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.785 -0.643 . . . . 2.44 110.195 175.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.424 ' HB3' ' HE3' ' A' ' 42' ' ' MET . 0.5 OUTLIER -69.11 -23.4 63.99 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.623 -0.717 . . . . 0.95 111.029 -178.05 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.4 ttm -61.29 -29.9 70.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.195 -0.457 . . . . 1.13 110.282 177.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -73.96 -34.69 64.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.868 -0.605 . . . . 2.96 109.935 178.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -71.78 -47.05 56.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.806 -0.634 . . . . 1.87 110.317 -179.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.655 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -55.3 -46.73 76.22 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.808 -0.633 . . . . 0.38 110.634 177.573 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -59.21 -44.95 92.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.747 -0.661 . . . . 0.97 110.611 178.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 80.9 m -62.2 -46.76 87.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.941 -0.572 . . . . 0.43 111.112 179.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.63 -41.09 69.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.19 -0.459 . . . . 0.88 111.108 178.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -73.06 -45.42 57.52 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.357 -0.383 . . . . 0.29 111.219 -177.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.1 p -67.45 -33.25 74.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.351 -0.386 . . . . 0.66 111.067 -177.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 -49.31 -47.41 47.09 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.643 -0.708 . . . . 1.84 111.192 178.122 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -65.69 -38.1 88.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.803 -0.635 . . . . 0.63 110.792 -178.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -72.6 -25.83 61.47 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.112 -0.494 . . . . 0.81 111.202 -177.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 62.0 mt -88.32 -50.82 13.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.059 0.457 . . . . 0.55 111.18 -179.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . 0.404 ' CE1' ' HA ' ' A' ' 73' ' ' TYR . 63.8 t80 -70.9 -34.87 71.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.136 -0.484 . . . . 1.22 111.495 -175.537 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 44.0 m-20 -110.85 157.81 19.42 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.891 0.377 . . . . 1.04 111.542 -172.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . 0.541 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 0.2 OUTLIER -74.3 149.8 87.02 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 115.771 -0.65 . . . . 3.47 110.767 -177.468 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . 0.439 ' HA ' HG11 ' A' ' 123' ' ' VAL . 24.6 Cg_endo -62.24 -16.64 52.33 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.933 2.422 . . . . 0.96 112.976 -178.612 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.52 6.42 48.14 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.994 0.426 . . . . 1.23 111.25 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . 0.541 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 0.5 OUTLIER -78.56 157.39 28.8 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 116.162 -0.472 . . . . 1.34 110.618 -178.414 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -67.5 -42.16 83.33 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.598 -0.728 . . . . 1.44 110.345 -177.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 5.5 tp -60.29 -35.84 64.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.972 -0.558 . . . . 0.42 111.009 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.439 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.4 t -68.97 -45.76 79.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.963 -0.384 . . . . 0.35 109.963 178.302 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.82 -29.69 67.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.906 -0.588 . . . . 0.52 110.13 177.617 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . 0.495 ' O ' HD13 ' A' ' 129' ' ' LEU . 32.8 mtt -76.42 -42.21 44.97 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.376 -0.829 . . . . 0.62 110.654 178.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.38 -45.17 72.77 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.073 -0.512 . . . . 0.31 112.095 -177.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . 0.431 ' HG3' ' H ' ' A' ' 127' ' ' GLN . 0.0 OUTLIER -59.44 -44.18 92.97 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.913 0.387 . . . . 1.94 110.86 179.888 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -68.38 -37.69 80.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 0.32 110.627 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.57 HD21 ' HA ' ' A' ' 56' ' ' ALA . 5.0 mp -64.83 -40.93 95.99 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.394 -0.821 . . . . 0.33 110.734 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -59.27 -24.75 63.51 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.662 -0.699 . . . . 1.47 111.849 -176.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.553 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -62.66 -44.0 97.37 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 110.158 -0.312 . . . . 2.24 110.158 -177.895 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.517 HD11 ' HD2' ' A' ' 53' ' ' HIS . 22.1 mt -66.96 -35.61 75.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.128 -0.487 . . . . 1.23 110.343 -179.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.468 ' O ' HG23 ' A' ' 137' ' ' VAL . 36.1 t80 -59.89 -62.71 1.67 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.819 -0.628 . . . . 0.46 110.77 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 2.0 pp -64.74 -28.38 69.55 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.954 0.407 . . . . 0.64 110.782 -177.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.553 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.3 OUTLIER -60.82 -51.72 68.14 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.673 -0.694 . . . . 1.61 111.024 178.992 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . 0.535 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -81.36 -26.51 35.47 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.852 -0.613 . . . . 1.52 110.885 -175.718 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 133' ' ' PHE . 52.4 t -68.86 -29.7 44.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.128 0.489 . . . . 0.35 110.262 176.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.51 -14.77 63.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.162 -0.472 . . . . 0.5 110.531 177.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -106.88 -0.57 23.17 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.895 -0.593 . . . . 1.76 110.325 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . 0.493 ' HG2' ' CE1' ' A' ' 41' ' ' TYR . 0.3 OUTLIER -70.07 147.29 95.63 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 115.874 -0.603 . . . . 0.86 110.752 -178.287 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . 0.434 ' C ' ' H ' ' A' ' 143' ' ' GLU . 50.6 Cg_endo -86.18 79.95 1.85 Allowed 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 122.308 2.005 . . . . 0.67 111.324 178.118 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -76.08 21.39 0.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.273 0.558 . . . . 2.91 111.234 -177.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . 0.434 ' H ' ' C ' ' A' ' 141' ' ' PRO . 2.4 mt-10 -90.62 -32.92 16.06 Favored 'General case' 0 N--CA 1.439 -0.982 0 N-CA-C 108.218 -1.031 . . . . 2.7 108.218 170.41 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 75.18 113.03 0.07 Allowed 'General case' 0 C--O 1.228 -0.064 0 CA-C-N 113.569 -1.651 . . . . 2.34 111.227 176.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 15.3 t -125.83 116.73 47.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.825 -0.625 . . . . 0.99 109.613 176.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -73.62 147.11 44.11 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.724 0.297 . . . . 1.53 110.499 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 64.6 mt . . . . . 0 C--O 1.247 0.931 0 CA-C-O 118.834 -0.603 . . . . 1.57 109.991 179.521 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.4 p . . . . . 0 N--CA 1.454 -0.27 0 CA-C-O 121.216 0.531 . . . . 0.93 110.387 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -178.44 154.01 0.77 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.341 -0.845 . . . . 1.61 109.661 177.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.544 ' HB3' ' HB2' ' A' ' 31' ' ' LYS . 42.8 t-20 -160.53 124.38 2.0 Allowed Pre-proline 0 C--N 1.318 -0.779 0 CA-C-N 115.846 -0.616 . . . . 1.6 109.52 -179.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -65.06 -33.87 48.96 Favored 'Trans proline' 0 N--CA 1.48 0.729 0 C-N-CA 123.407 2.738 . . . . 1.87 112.994 -177.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.4 t -74.3 -20.7 60.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.577 0.703 . . . . 2.18 109.678 -179.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.544 ' HB2' ' HB3' ' A' ' 28' ' ' ASN . 2.1 tttp -87.11 134.75 36.03 Favored Pre-proline 0 C--N 1.319 -0.736 0 CA-C-N 115.0 -1.0 . . . . 2.75 109.755 178.464 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.509 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 35.9 Cg_endo -65.66 137.72 51.14 Favored 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.256 1.971 . . . . 1.38 112.317 177.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -153.88 109.27 0.4 Allowed Glycine 0 N--CA 1.442 -0.939 0 N-CA-C 110.788 -0.925 . . . . 0.97 110.788 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -123.81 155.77 37.36 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.789 0.328 . . . . 1.93 110.57 -176.312 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.489 ' HA ' HD22 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -92.62 84.36 5.04 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.191 0.52 . . . . 2.64 110.292 176.486 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.634 HG22 ' HG3' ' A' ' 146' ' ' GLU . 1.2 p -92.02 165.55 13.13 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.228 -0.442 . . . . 0.68 110.826 -179.225 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.446 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 64.0 t30 -63.99 -40.88 97.38 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.282 -0.417 . . . . 1.47 110.591 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -64.51 -38.97 92.86 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 110.203 -0.295 . . . . 1.04 110.203 177.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.783 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.7 OUTLIER -63.52 -55.68 22.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.916 -0.584 . . . . 0.8 110.501 178.838 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.48 ' HA ' ' OE1' ' A' ' 43' ' ' GLN . 2.7 mm-40 -63.81 -31.53 72.73 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.966 -0.561 . . . . 1.75 110.891 -179.166 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.446 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 63.8 t80 -53.57 -62.68 1.5 Allowed 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.52 -0.764 . . . . 0.64 110.922 176.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.529 ' HA ' HG23 ' A' ' 46' ' ' VAL . 3.5 ttm -59.07 -29.98 67.73 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.428 -0.351 . . . . 1.13 111.645 -173.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.577 ' HG2' HD22 ' A' ' 90' ' ' LEU . 24.9 mt-30 -60.12 -58.56 7.98 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.097 0.475 . . . . 1.3 110.502 178.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -84.27 -29.7 26.23 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.702 -0.681 . . . . 0.5 111.534 -174.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 97.9 t -87.9 -56.63 5.02 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 N-CA-C 112.336 0.495 . . . . 0.3 112.336 -175.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.529 HG23 ' HA ' ' A' ' 42' ' ' MET . 53.6 t -83.03 -67.26 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 112.076 0.399 . . . . 0.26 112.076 -171.404 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.452 HG12 ' O ' ' A' ' 42' ' ' MET . 2.5 p -72.76 -34.13 46.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 C-N-CA 120.822 -0.351 . . . . 0.83 111.7 -171.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 43' ' ' GLN . 0.0 OUTLIER -61.48 -35.4 77.55 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.778 0.323 . . . . 2.4 110.779 179.196 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.419 HG21 ' HE3' ' A' ' 136' ' ' LYS . 27.3 m -80.75 -37.77 29.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.454 -0.339 . . . . 0.55 110.878 178.203 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.691 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -61.47 -40.78 95.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.903 0.383 . . . . 0.33 110.03 177.417 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 23.2 t-105 -64.73 -31.63 72.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.932 -0.576 . . . . 0.39 111.385 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.6 mttt -79.74 -9.83 59.7 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 111.815 0.302 . . . . 2.24 111.815 -175.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 10.5 t-80 -69.1 129.67 40.56 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.588 -0.523 . . . . 0.39 109.588 176.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -81.34 9.4 7.23 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.938 0.399 . . . . 1.91 111.658 -173.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -110.45 -3.52 16.02 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.303 0.573 . . . . 0.93 109.626 173.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.744 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -92.79 9.11 36.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.607 -0.724 . . . . 0.28 110.642 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.471 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 55.9 p-90 -64.31 -31.43 5.93 Favored Pre-proline 0 CA--C 1.546 0.803 0 N-CA-C 113.954 1.094 . . . . 0.58 113.954 -175.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.471 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 10.8 Cg_exo -73.11 -4.4 15.35 Favored 'Trans proline' 0 C--N 1.363 1.324 0 CA-C-N 121.151 1.447 . . . . 0.47 111.946 176.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -110.19 19.38 18.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.173 0.511 . . . . 1.11 110.008 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -85.84 -8.86 57.81 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.722 -0.672 . . . . 0.63 110.434 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.09 131.42 19.78 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.282 -0.417 . . . . 1.63 110.877 -172.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -67.58 154.74 72.68 Favored 'Trans proline' 0 C--O 1.236 0.398 0 C-N-CA 122.689 2.26 . . . . 0.87 113.044 -178.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 9.4 t -97.61 101.94 12.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.672 -0.694 . . . . 0.88 109.491 -178.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.444 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.0 OUTLIER -108.48 7.33 26.83 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.619 -0.719 . . . . 1.85 110.84 -178.26 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 86.05 -21.62 0.21 Allowed 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 114.737 -1.12 . . . . 1.29 112.29 178.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.7 mt -113.11 -42.69 4.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 O-C-N 122.224 -0.297 . . . . 1.89 111.105 -178.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 53.7 tptt -52.91 -54.61 32.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.14 -0.482 . . . . 2.99 110.975 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.405 ' HB3' HD22 ' A' ' 70' ' ' LEU . 9.4 tp -93.48 2.01 56.6 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.263 -0.426 . . . . 1.66 110.605 178.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 56.29 71.78 0.54 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.618 -0.719 . . . . 1.74 110.648 -177.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.538 ' HG ' ' CD1' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -132.35 75.01 74.98 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.168 -0.924 . . . . 1.61 109.921 -175.614 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -73.17 -37.06 3.65 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.561 2.174 . . . . 1.3 113.416 -173.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -91.48 -0.91 57.67 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.244 0.545 . . . . 1.97 110.937 -176.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.538 ' CD1' ' HG ' ' A' ' 70' ' ' LEU . 0.9 OUTLIER -65.71 -43.34 89.44 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.491 -0.777 . . . . 1.13 110.768 179.369 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -76.86 10.41 2.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.664 -0.698 . . . . 0.91 112.006 -173.573 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.6 mmtt -97.87 -47.85 5.4 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.125 -0.694 . . . . 2.86 109.125 176.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.7 mp -89.09 -52.63 10.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.322 -0.854 . . . . 1.0 110.608 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.9 mm -91.01 97.43 7.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.043 0.449 . . . . 0.75 109.879 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.3 mtmt -75.04 -11.19 60.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.887 -0.597 . . . . 1.99 111.13 -177.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -122.13 82.67 44.64 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 115.985 -0.552 . . . . 2.05 110.212 177.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -76.71 72.7 5.57 Favored 'Trans proline' 0 CA--C 1.53 0.28 0 C-N-CA 122.91 2.406 . . . . 0.89 112.016 -178.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -110.06 154.39 23.29 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.49 0.662 . . . . 0.82 110.924 -175.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.433 ' O ' HG12 ' A' ' 86' ' ' ILE . 13.9 p-10 -133.61 -129.21 0.17 Allowed 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 114.635 -1.166 . . . . 1.42 109.23 -173.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -120.44 -18.21 7.94 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.514 -0.55 . . . . 0.8 109.514 177.322 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -78.41 -35.59 32.79 Favored Glycine 0 N--CA 1.439 -1.13 0 N-CA-C 109.642 -1.383 . . . . 0.32 109.642 177.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 23.4 m -71.68 -35.54 70.31 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.254 -0.473 . . . . 0.95 110.63 174.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.433 HG12 ' O ' ' A' ' 82' ' ' ASP . 0.2 OUTLIER -62.83 -52.88 53.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.256 -0.646 . . . . 0.97 109.256 176.914 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.68 -25.5 67.36 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.945 -0.57 . . . . 1.15 111.104 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.477 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 14.9 tttp -68.54 -51.43 42.97 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 120.518 0.199 . . . . 2.46 110.65 179.386 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 11.4 mtp180 -66.54 -28.8 68.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.911 0.386 . . . . 1.16 110.683 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.717 ' HG ' ' SG ' ' A' ' 101' ' ' CYS . 5.6 mt -66.44 -58.55 5.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.936 -0.574 . . . . 0.49 110.96 173.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -68.19 -22.94 64.79 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.204 -0.453 . . . . 1.39 111.384 -176.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.477 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 7.6 t30 -89.38 -7.32 55.48 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.294 -0.412 . . . . 1.3 110.715 178.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 56.76 67.0 1.05 Allowed 'General case' 0 N--CA 1.464 0.251 0 O-C-N 123.648 0.593 . . . . 1.75 110.713 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . 0.424 ' HD2' ' CE2' ' A' ' 95' ' ' TYR . 14.1 t80 -77.87 -32.25 51.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.556 -0.747 . . . . 0.96 111.664 -178.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.424 ' CE2' ' HD2' ' A' ' 94' ' ' TYR . 0.0 OUTLIER -127.68 -172.72 2.74 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.612 0.72 . . . . 1.28 111.717 -175.897 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . 0.509 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 2.2 t-105 -76.17 -59.8 2.61 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 114.236 -1.347 . . . . 1.05 111.087 -177.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 8.2 m -128.31 166.37 18.75 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.999 0.428 . . . . 1.0 111.567 -172.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.783 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -70.5 -12.56 61.65 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.297 -0.411 . . . . 0.66 111.358 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . 0.4 ' HA ' ' SD ' ' A' ' 102' ' ' MET . 0.1 OUTLIER -62.13 -22.79 66.13 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.387 0.613 . . . . 0.85 109.887 174.499 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -81.14 -44.95 17.15 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.411 -0.813 . . . . 2.44 110.348 176.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.717 ' SG ' ' HG ' ' A' ' 90' ' ' LEU . 1.6 t -69.49 -25.21 63.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.106 -0.497 . . . . 0.95 111.53 -176.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.4 ' SD ' ' HA ' ' A' ' 99' ' ' SER . 1.1 ptm -66.74 -16.75 64.46 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.637 -0.425 . . . . 1.13 110.292 177.269 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -78.5 -44.01 25.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 2.96 110.594 177.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . 0.571 ' OD1' ' HA ' ' A' ' 101' ' ' CYS . 0.4 OUTLIER -75.07 -31.27 61.21 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.847 -0.427 . . . . 1.87 109.847 177.95 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.691 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -54.71 -51.54 65.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.807 -0.633 . . . . 0.38 109.945 170.336 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 -60.43 -46.01 91.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.398 -0.819 . . . . 0.97 110.026 176.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 63.3 m -54.69 -45.97 74.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.595 -0.73 . . . . 0.43 111.742 -177.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -54.26 -45.68 72.48 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 120.769 0.318 . . . . 0.88 110.73 176.094 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -64.94 -47.3 78.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.834 -0.621 . . . . 0.29 111.049 -178.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.31 -41.29 96.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.944 0.402 . . . . 0.66 110.686 -178.644 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -52.06 -46.05 64.98 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.374 -0.83 . . . . 1.84 110.547 177.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . 0.475 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 0.0 OUTLIER -70.32 -37.74 74.78 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.92 -0.582 . . . . 0.63 110.855 -178.68 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -71.7 -32.77 68.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.625 -0.261 . . . . 0.81 111.353 -177.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 76.9 mt -73.32 -57.98 5.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.531 -0.304 . . . . 0.55 111.33 -177.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -70.32 -41.55 73.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.381 -0.372 . . . . 1.22 111.318 -174.202 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . 0.475 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 71.7 m-80 -86.28 168.14 14.18 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.926 0.393 . . . . 1.04 111.031 -174.273 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.04 147.27 83.4 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.984 -0.553 . . . . 3.47 110.397 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_endo -60.35 -21.24 66.52 Favored 'Trans proline' 0 C--N 1.343 0.241 0 C-N-CA 122.447 2.098 . . . . 0.96 111.959 177.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.15 34.82 4.79 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.059 -0.519 . . . . 1.23 110.638 176.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -83.84 167.48 17.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.882 -0.599 . . . . 1.34 110.673 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -67.28 -49.67 63.4 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.868 -0.605 . . . . 1.44 110.49 -177.285 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -64.3 -40.05 87.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.046 -0.525 . . . . 0.42 110.655 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 6.6 t -65.45 -38.68 83.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.057 0.456 . . . . 0.35 110.681 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.31 -28.29 68.0 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.029 -0.532 . . . . 0.52 110.276 177.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . 0.472 ' O ' HD13 ' A' ' 129' ' ' LEU . 3.1 mtt -82.52 -44.98 15.26 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.764 -0.653 . . . . 0.62 110.582 177.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.41 -33.24 58.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.679 -0.691 . . . . 0.31 111.697 -179.21 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -59.21 -45.87 89.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.373 -0.376 . . . . 1.94 110.986 178.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -73.86 -35.5 64.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.104 -0.498 . . . . 0.32 110.509 179.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.744 HD21 ' HA ' ' A' ' 56' ' ' ALA . 5.6 mp -61.37 -46.14 91.44 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.42 -0.809 . . . . 0.33 110.615 179.132 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -62.7 -23.87 67.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.321 -0.854 . . . . 1.47 111.831 -176.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.536 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -62.97 -49.63 73.97 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 109.914 -0.402 . . . . 2.24 109.914 -176.77 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.528 HD12 HD23 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -68.94 -30.09 45.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.953 -0.567 . . . . 1.23 110.481 179.577 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.484 ' O ' HG23 ' A' ' 137' ' ' VAL . 34.8 t80 -61.72 -62.88 1.49 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.984 -0.553 . . . . 0.46 110.99 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.8 pp -66.62 -29.91 70.05 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.821 0.343 . . . . 0.64 110.534 -175.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.536 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.3 OUTLIER -63.39 -48.79 76.41 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.623 -0.717 . . . . 1.61 111.203 -179.549 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . 0.419 ' HE3' HG21 ' A' ' 49' ' ' THR . 2.8 mttm -80.89 -14.03 58.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.403 -0.362 . . . . 1.52 111.285 -177.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 133' ' ' PHE . 30.9 t -82.53 -34.99 12.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.052 0.453 . . . . 0.35 109.882 178.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -66.44 -19.38 65.78 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.197 0.522 . . . . 0.5 110.432 178.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -100.05 10.61 41.01 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.991 -0.55 . . . . 1.76 111.172 -179.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -61.21 152.08 73.46 Favored Pre-proline 0 N--CA 1.466 0.341 0 CA-C-N 116.267 -0.424 . . . . 0.86 111.055 175.167 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -68.61 121.38 8.3 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.384 2.056 . . . . 0.67 112.074 179.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -71.97 1.95 6.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.32 -0.4 . . . . 2.91 112.065 -176.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . 0.441 ' HB2' HG23 ' A' ' 145' ' ' VAL . 1.2 mt-10 -97.69 -41.3 8.17 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 116.387 -0.37 . . . . 2.7 111.678 -171.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 60.55 65.7 1.02 Allowed 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.66 0.6 . . . . 2.34 109.979 -175.553 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . 0.441 HG23 ' HB2' ' A' ' 143' ' ' GLU . 16.6 t -98.21 127.78 50.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.699 -0.682 . . . . 0.99 110.294 -177.524 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.634 ' HG3' HG22 ' A' ' 36' ' ' THR . 8.8 tt0 -71.24 138.86 49.79 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.892 -0.41 . . . . 1.53 109.892 175.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 40.7 mt . . . . . 0 C--O 1.247 0.953 0 CA-C-O 118.395 -0.812 . . . . 1.57 110.516 -176.146 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.7 p . . . . . 0 N--CA 1.453 -0.296 0 CA-C-O 121.169 0.509 . . . . 0.93 110.158 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 73.1 m -166.95 142.57 4.26 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.551 -0.749 . . . . 1.61 109.347 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.463 ' HB3' ' CB ' ' A' ' 31' ' ' LYS . 34.8 t-20 -145.97 127.91 7.73 Favored Pre-proline 0 C--N 1.319 -0.754 0 N-CA-C 109.663 -0.495 . . . . 1.6 109.663 178.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -63.42 -36.12 57.06 Favored 'Trans proline' 0 N--CA 1.478 0.587 0 C-N-CA 123.224 2.616 . . . . 1.87 112.783 -177.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.5 m -80.35 -19.68 45.89 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 115.576 -0.738 . . . . 2.18 110.324 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.463 ' CB ' ' HB3' ' A' ' 28' ' ' ASN . 11.1 tttp -90.33 129.27 46.02 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.114 -0.948 . . . . 2.75 110.254 179.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.455 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 35.6 Cg_endo -69.17 135.72 32.63 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 121.96 1.773 . . . . 1.38 112.284 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -145.46 86.05 0.18 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.317 -0.856 . . . . 0.97 111.002 -178.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.498 ' HG3' ' CE2' ' A' ' 96' ' ' TRP . 1.7 mmm180 -97.97 163.38 12.8 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.879 0.371 . . . . 1.93 110.498 -176.161 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.424 ' HA ' HD22 ' A' ' 39' ' ' LEU . 4.3 mtmt -104.93 108.92 20.69 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.084 -0.507 . . . . 2.64 110.121 178.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.447 HG22 ' HG3' ' A' ' 146' ' ' GLU . 1.3 p -111.94 166.89 10.82 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.889 0.376 . . . . 0.68 110.864 176.227 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.544 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 60.3 t30 -59.75 -37.41 78.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.928 -0.578 . . . . 1.47 110.893 178.249 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -71.07 -37.47 72.48 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.854 0.359 . . . . 1.04 110.409 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.424 HD22 ' HA ' ' A' ' 35' ' ' LYS . 0.6 OUTLIER -63.18 -53.27 55.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.117 -0.492 . . . . 0.8 110.557 178.507 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -69.48 -21.43 63.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.093 -0.503 . . . . 1.75 110.81 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.544 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 52.8 t80 -64.36 -63.41 1.15 Allowed 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.003 -0.544 . . . . 0.64 110.868 178.307 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.609 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.5 OUTLIER -57.91 -31.45 66.79 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.534 -0.303 . . . . 1.13 110.867 -174.633 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -59.69 -55.24 36.83 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.909 -0.587 . . . . 1.3 111.209 178.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -86.56 -28.89 23.04 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 112.28 0.474 . . . . 0.5 112.28 -176.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 95.1 t -89.23 -57.51 4.19 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 N-CA-C 112.479 0.548 . . . . 0.3 112.479 -175.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.609 HG23 ' HA ' ' A' ' 42' ' ' MET . 39.7 t -81.47 -65.63 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 111.739 0.274 . . . . 0.26 111.739 -169.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.459 HG12 ' O ' ' A' ' 42' ' ' MET . 2.6 p -67.53 -34.26 67.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 C-N-CA 120.851 -0.34 . . . . 0.83 111.548 -174.253 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.4 mmtt -60.03 -39.5 86.08 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 122.243 -0.285 . . . . 2.4 111.574 177.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.3 m -75.97 -36.12 59.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.67 0.272 . . . . 0.55 110.713 178.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.597 HD23 HD12 ' A' ' 132' ' ' ILE . 0.1 OUTLIER -59.88 -37.51 79.58 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.406 0.622 . . . . 0.33 109.541 174.312 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 16.7 t-105 -63.9 -27.36 69.1 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.041 -0.982 . . . . 0.39 112.096 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.1 mtpt -88.97 0.79 56.34 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.038 0.384 . . . . 2.24 112.038 -174.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.449 ' CD2' HD11 ' A' ' 132' ' ' ILE . 8.7 t-80 -76.76 134.51 39.13 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.893 -0.41 . . . . 0.39 109.893 177.028 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 40.1 mm-40 -72.42 -13.39 61.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.417 -0.356 . . . . 1.91 111.743 -175.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.424 ' HB2' ' ND1' ' A' ' 53' ' ' HIS . 3.1 m-85 -96.08 -1.79 47.97 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.152 0.501 . . . . 0.93 110.341 178.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.594 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -97.28 13.9 27.91 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.411 0.624 . . . . 0.28 110.311 -179.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.623 ' HA ' ' CE2' ' A' ' 60' ' ' TYR . 54.3 p-90 -65.91 -33.6 7.45 Favored Pre-proline 0 CA--C 1.545 0.775 0 N-CA-C 113.787 1.032 . . . . 0.58 113.787 -174.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.477 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 1.3 Cg_endo -85.13 12.0 3.2 Favored 'Trans proline' 0 C--N 1.359 1.115 0 C-N-CA 121.695 1.597 . . . . 0.47 111.325 176.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -110.57 -0.39 17.32 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.389 -0.823 . . . . 1.11 110.781 -177.241 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.623 ' CE2' ' HA ' ' A' ' 57' ' ' TRP . 16.3 m-30 -82.21 -23.24 35.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.878 0.37 . . . . 0.63 111.179 -178.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.98 127.53 27.82 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.214 -0.448 . . . . 1.63 110.717 -174.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -69.79 158.22 57.65 Favored 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 122.835 2.357 . . . . 0.87 112.843 -177.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 41.7 t -77.07 94.45 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.618 0.723 . . . . 0.88 110.167 178.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.408 ' CG ' ' H ' ' A' ' 67' ' ' LYS . 0.4 OUTLIER -91.82 -10.24 40.54 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.103 -0.953 . . . . 1.85 110.507 178.499 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 80.37 -32.27 0.12 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.882 0.873 . . . . 1.29 112.646 176.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 24.0 mt -99.94 -57.24 4.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 O-C-N 122.122 -0.361 . . . . 1.89 111.724 -175.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.408 ' H ' ' CG ' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -66.99 -33.46 75.62 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.98 0.419 . . . . 2.99 110.92 -176.701 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.448 HD12 ' HA ' ' A' ' 68' ' ' LEU . 2.8 tp -90.27 -5.85 55.84 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.121 -0.49 . . . . 1.66 110.843 177.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 57.44 57.15 4.55 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.843 -0.617 . . . . 1.74 111.242 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.423 ' O ' ' HB2' ' A' ' 73' ' ' TYR . 25.9 mt -129.07 64.51 71.07 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.564 -0.744 . . . . 1.61 110.812 176.486 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -77.23 -27.74 6.37 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.322 2.015 . . . . 1.3 111.891 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -84.52 2.98 38.65 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.653 -0.703 . . . . 1.97 110.114 -179.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.442 ' HA ' ' CE1' ' A' ' 115' ' ' TYR . 1.5 t80 -65.19 -45.46 84.71 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.418 -0.81 . . . . 1.13 110.929 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -78.45 5.97 9.54 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.595 -0.73 . . . . 0.91 111.59 -172.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.0 mmmt -89.77 -22.84 21.95 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 108.989 -0.745 . . . . 2.86 108.989 178.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 53.6 mt -118.3 -56.09 3.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 CA-C-N 115.257 -0.883 . . . . 1.0 110.332 179.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 37.5 mm -88.83 107.46 17.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.959 -0.564 . . . . 0.75 110.564 -177.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.95 -10.43 59.27 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.895 -0.593 . . . . 1.99 110.889 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -117.58 82.94 16.45 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.004 -0.544 . . . . 2.05 110.109 176.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -76.32 91.05 1.14 Allowed 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.755 2.304 . . . . 0.89 112.0 -176.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -129.94 171.22 12.99 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.457 0.646 . . . . 0.82 111.245 -175.016 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.424 ' O ' HG12 ' A' ' 86' ' ' ILE . 12.9 p-10 -153.98 -134.81 0.05 OUTLIER 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.519 -1.219 . . . . 1.42 108.248 -174.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.2 ttm -113.25 -19.92 11.6 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.123 -0.695 . . . . 0.8 109.123 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.425 ' O ' ' HB2' ' A' ' 88' ' ' LYS . . . -79.81 -30.88 41.84 Favored Glycine 0 N--CA 1.44 -1.093 0 N-CA-C 109.863 -1.295 . . . . 0.32 109.863 178.006 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 28.5 m -77.14 -29.83 54.82 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.441 -0.379 . . . . 0.95 111.047 174.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.539 HD12 ' HB2' ' A' ' 104' ' ' ASP . 0.2 OUTLIER -65.52 -51.7 60.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 109.305 -0.628 . . . . 0.97 109.305 177.076 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.539 ' O ' ' HG2' ' A' ' 91' ' ' GLU . 0.0 OUTLIER -63.91 -27.35 69.09 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.156 -0.474 . . . . 1.15 110.164 177.548 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.558 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 0.8 OUTLIER -63.09 -52.27 63.31 Favored 'General case' 0 C--O 1.227 -0.09 0 CA-C-N 116.129 -0.487 . . . . 2.46 110.616 177.454 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.2 mmm-85 -63.91 -33.88 76.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.748 0.309 . . . . 1.16 110.724 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.8 mt -66.58 -57.89 6.31 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.936 -0.575 . . . . 0.49 111.598 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 11.4 pt-20 -78.55 -14.99 59.07 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.197 0.443 . . . . 1.39 112.197 -173.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.558 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 1.0 OUTLIER -90.41 -4.02 57.3 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 110.058 -0.349 . . . . 1.3 110.058 174.977 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.49 58.99 2.75 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.408 -0.815 . . . . 1.75 111.347 179.361 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -71.85 -45.12 62.46 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.999 0.428 . . . . 0.96 110.773 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -108.59 -171.71 1.91 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.9 -0.591 . . . . 1.28 110.896 -175.263 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . 0.498 ' CE2' ' HG3' ' A' ' 34' ' ' ARG . 2.0 t90 -86.9 -41.59 13.86 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.556 -0.747 . . . . 1.05 110.394 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 28.6 t -148.96 175.67 11.09 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.255 0.55 . . . . 1.0 111.62 -172.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.41 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -75.0 -10.93 59.94 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.618 -0.719 . . . . 0.66 110.653 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.66 -33.25 72.54 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.792 0.806 . . . . 0.85 109.493 173.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -82.19 -35.31 28.46 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 114.647 -1.16 . . . . 2.44 110.144 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.511 ' HA ' ' OD1' ' A' ' 104' ' ' ASP . 48.5 t -64.76 -24.61 67.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.984 -0.553 . . . . 0.95 110.709 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.5 mtt -59.73 -25.9 65.2 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.079 -0.509 . . . . 1.13 110.282 176.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.404 ' OE1' ' HA ' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -75.61 -47.36 26.92 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.025 -0.534 . . . . 2.96 110.896 179.981 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . 0.539 ' HB2' HD12 ' A' ' 86' ' ' ILE . 0.2 OUTLIER -70.77 -37.21 73.36 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.806 -0.357 . . . . 1.87 110.472 -179.367 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.573 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -56.09 -48.22 76.53 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.153 0.502 . . . . 0.38 110.043 173.543 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -64.54 -47.29 79.33 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.619 -0.719 . . . . 0.97 110.508 177.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 90.1 m -52.27 -45.4 65.44 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.372 -0.376 . . . . 0.43 111.332 -178.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 6.2 ttp -54.64 -38.97 67.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.348 -0.387 . . . . 0.88 111.453 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -78.78 -51.82 9.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.739 0.304 . . . . 0.29 110.605 -175.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.45 -39.72 73.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.171 -0.468 . . . . 0.66 111.165 178.267 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -53.82 -49.3 68.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.073 -0.512 . . . . 1.84 110.964 178.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.46 -38.16 90.04 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 116.391 -0.368 . . . . 0.63 110.612 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . 0.414 ' HD1' HG22 ' A' ' 123' ' ' VAL . 15.2 m-85 -67.85 -33.19 74.28 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.288 -0.414 . . . . 0.81 111.135 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 70.0 mt -80.79 -50.65 16.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.36 -0.382 . . . . 0.55 111.971 -176.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . 0.442 ' CE1' ' HA ' ' A' ' 73' ' ' TYR . 64.3 t80 -68.3 -34.37 76.02 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.862 0.363 . . . . 1.22 111.154 -175.491 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 -98.7 -163.73 1.07 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.991 -0.549 . . . . 1.04 110.892 -175.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.67 156.51 44.72 Favored Pre-proline 0 C--N 1.325 -0.464 0 N-CA-C 109.999 -0.371 . . . . 3.47 109.999 179.545 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -59.41 -21.64 62.16 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.333 2.022 . . . . 0.96 111.99 176.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.94 8.64 42.17 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.55 -0.75 . . . . 1.23 111.56 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . 0.531 ' OD1' HG22 ' A' ' 122' ' ' ILE . 3.3 t70 -76.04 155.98 34.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.186 0.517 . . . . 1.34 111.401 -175.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.47 -42.73 74.45 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.144 -0.935 . . . . 1.44 109.889 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . 0.531 HG22 ' OD1' ' A' ' 120' ' ' ASP . 2.4 tp -66.17 -33.75 65.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 115.977 -0.556 . . . . 0.42 110.535 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.414 HG22 ' HD1' ' A' ' 113' ' ' TYR . 2.8 t -69.94 -41.4 79.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.128 0.49 . . . . 0.35 110.131 177.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.29 -33.52 71.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.92 -0.582 . . . . 0.52 109.968 177.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . 0.462 ' O ' HD13 ' A' ' 129' ' ' LEU . 21.5 mtt -76.49 -46.6 26.0 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.524 -0.762 . . . . 0.62 110.746 178.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -52.83 -36.71 59.02 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.284 -0.416 . . . . 0.31 111.634 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -60.73 -39.11 87.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.132 -0.486 . . . . 1.94 111.272 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.91 -36.9 35.76 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.153 0.501 . . . . 0.32 110.438 178.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.594 HD21 ' HA ' ' A' ' 56' ' ' ALA . 5.2 mp -60.46 -40.2 90.33 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.46 -0.791 . . . . 0.33 110.697 179.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -60.52 -24.54 65.43 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.943 -0.571 . . . . 1.47 111.961 -178.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.475 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -65.15 -39.41 92.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.681 0.277 . . . . 2.24 110.41 -177.521 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.597 HD12 HD23 ' A' ' 50' ' ' LEU . 11.3 mt -67.47 -28.55 42.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 1.23 110.846 -178.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.438 ' O ' HG23 ' A' ' 137' ' ' VAL . 33.3 t80 -61.46 -63.05 1.41 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.955 -0.566 . . . . 0.46 110.487 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.3 pp -65.89 -25.3 67.1 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.334 0.588 . . . . 0.64 110.51 -178.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.475 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -63.95 -34.15 77.33 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.484 -0.78 . . . . 1.61 111.446 -179.339 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . 0.577 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -102.13 -21.98 14.31 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.891 0.377 . . . . 1.52 111.036 -178.459 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 133' ' ' PHE . 40.9 t -73.13 -31.28 34.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.078 0.466 . . . . 0.35 110.518 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -72.25 -6.35 42.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.322 0.582 . . . . 0.5 110.36 178.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -111.55 2.79 17.58 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.541 -0.754 . . . . 1.76 110.117 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . 0.424 ' HG3' ' HA ' ' A' ' 137' ' ' VAL . 0.1 OUTLIER -65.54 149.85 96.73 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 115.941 -0.572 . . . . 0.86 111.623 -179.736 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -84.84 87.26 1.07 Allowed 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.435 2.09 . . . . 0.67 111.165 177.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 6.6 mm-40 -70.47 11.03 0.39 Allowed 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.407 0.521 . . . . 2.91 112.407 -174.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -83.76 -39.6 19.86 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 108.85 -0.796 . . . . 2.7 108.85 173.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 67.82 98.55 0.05 Allowed 'General case' 0 C--O 1.231 0.115 0 CA-C-N 114.263 -1.335 . . . . 2.34 111.017 -177.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 9.4 t -100.55 107.47 21.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.746 -0.661 . . . . 0.99 109.304 175.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.447 ' HG3' HG22 ' A' ' 36' ' ' THR . 5.7 tt0 -66.21 140.13 58.15 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.741 -0.466 . . . . 1.53 109.741 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 11.1 mt . . . . . 0 C--O 1.246 0.906 0 CA-C-O 118.661 -0.685 . . . . 1.57 110.205 -177.308 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.456 ' O ' ' HB2' ' A' ' 94' ' ' TYR . 4.4 p . . . . . 0 N--CA 1.453 -0.324 0 N-CA-C 109.157 -0.683 . . . . 0.93 109.157 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.7 m -173.66 116.4 0.25 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 114.976 -1.011 . . . . 1.61 108.855 -179.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.469 ' OD1' ' HD2' ' A' ' 29' ' ' PRO . 20.3 t30 -140.5 132.69 14.39 Favored Pre-proline 0 C--N 1.319 -0.734 0 C-N-CA 120.918 -0.313 . . . . 1.6 110.75 -173.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . 0.469 ' HD2' ' OD1' ' A' ' 28' ' ' ASN . 70.7 Cg_endo -69.42 -38.76 8.08 Favored 'Trans proline' 0 N--CA 1.474 0.368 0 C-N-CA 123.044 2.496 . . . . 1.87 112.002 177.332 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 7.2 m -71.65 -17.22 62.27 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.392 -0.822 . . . . 2.18 110.571 -179.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.8 tmtm? -101.55 110.29 61.39 Favored Pre-proline 0 C--N 1.318 -0.802 0 CA-C-N 115.348 -0.842 . . . . 2.75 109.453 175.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.633 ' HB2' ' CZ3' ' A' ' 96' ' ' TRP . 24.5 Cg_endo -63.54 133.95 42.2 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 121.549 1.5 . . . . 1.38 111.978 -179.01 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -160.18 80.67 0.15 Allowed Glycine 0 N--CA 1.44 -1.099 0 CA-C-N 115.023 -0.989 . . . . 0.97 110.917 -177.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.1 mtm180 -73.92 -117.09 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.95 0.405 . . . . 1.93 110.186 -179.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -175.06 129.04 0.29 Allowed 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.447 -0.575 . . . . 2.64 109.447 178.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.779 HG22 ' HG3' ' A' ' 146' ' ' GLU . 4.1 p -118.94 159.76 23.22 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 109.841 -0.429 . . . . 0.68 109.841 174.002 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -57.71 -36.47 72.06 Favored 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 110.091 -0.337 . . . . 1.47 110.091 178.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.429 ' OE1' ' HB3' ' A' ' 140' ' ' MET . 0.9 OUTLIER -57.05 -44.09 82.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.696 -0.683 . . . . 1.04 110.922 178.32 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.515 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.4 OUTLIER -63.41 -55.63 22.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.059 -0.518 . . . . 0.8 110.822 -179.052 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -62.98 -33.98 76.55 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.849 -0.614 . . . . 1.75 110.516 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -57.74 -63.38 1.26 Allowed 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 115.973 -0.558 . . . . 0.64 110.388 176.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.561 ' HB2' ' SD ' ' A' ' 140' ' ' MET . 8.6 ttp -59.81 -30.66 69.07 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.41 -0.359 . . . . 1.13 110.54 -175.656 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.552 ' HB2' HD22 ' A' ' 90' ' ' LEU . 3.0 tt0 -61.5 -55.92 25.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.665 -0.698 . . . . 1.3 111.101 178.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 62.6 m-80 -85.72 -27.24 25.41 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.092 0.404 . . . . 0.5 112.092 -176.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 94.9 t -89.36 -57.73 4.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 N-CA-C 112.305 0.483 . . . . 0.3 112.305 -177.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.668 HG22 ' HB3' ' A' ' 136' ' ' LYS . 48.0 t -82.15 -66.66 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 112.143 0.423 . . . . 0.26 112.143 -169.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.462 HG12 ' O ' ' A' ' 42' ' ' MET . 0.9 OUTLIER -65.97 -37.18 79.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 C-N-CA 120.707 -0.397 . . . . 0.83 111.248 -174.248 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.533 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 0.2 OUTLIER -56.7 -39.95 74.76 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.544 0.212 . . . . 2.4 111.164 178.702 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 12.2 m -77.47 -35.78 53.44 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 121.131 -0.228 . . . . 0.55 111.158 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.684 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -62.02 -39.05 90.95 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.269 0.557 . . . . 0.33 109.581 175.012 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 33.1 t-105 -62.74 -29.35 70.62 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.549 -0.751 . . . . 0.39 111.235 177.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.533 ' HG3' ' O ' ' A' ' 48' ' ' LYS . 12.7 mtpt -82.5 -5.54 58.78 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 111.949 0.352 . . . . 2.24 111.949 -175.394 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.525 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 4.7 t-80 -74.71 128.19 34.95 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.01 0.433 . . . . 0.39 110.028 177.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -82.61 15.7 2.47 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.247 -0.433 . . . . 1.91 111.445 -176.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.525 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.4 OUTLIER -112.15 -7.42 14.05 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.175 -0.676 . . . . 0.93 109.175 171.296 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.597 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -96.24 11.42 34.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.63 -0.713 . . . . 0.28 110.498 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.489 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 42.9 p-90 -63.27 -33.33 10.32 Favored Pre-proline 0 CA--C 1.545 0.778 0 N-CA-C 113.849 1.055 . . . . 0.58 113.849 -175.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.489 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 10.3 Cg_exo -73.37 -13.76 25.35 Favored 'Trans proline' 0 C--N 1.356 0.956 0 C-N-CA 121.423 1.415 . . . . 0.47 111.88 176.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -94.91 -0.89 53.58 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.986 -0.552 . . . . 1.11 110.665 -178.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 12.5 m-30 -66.64 -34.53 78.07 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.017 -0.538 . . . . 0.63 110.987 -179.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -94.68 138.35 22.26 Favored Pre-proline 0 C--N 1.325 -0.479 0 CA-C-N 115.857 -0.611 . . . . 1.63 110.663 -175.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.617 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 41.2 Cg_endo -69.38 141.95 48.23 Favored 'Trans proline' 0 C--O 1.237 0.468 0 C-N-CA 122.523 2.149 . . . . 0.87 112.65 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.414 HG11 ' CD2' ' A' ' 73' ' ' TYR . 53.1 t -77.32 87.93 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.798 0.809 . . . . 0.88 109.319 177.243 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.45 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.0 OUTLIER -102.98 1.92 34.29 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.286 -0.87 . . . . 1.85 110.41 -178.015 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.45 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 85.72 -21.31 0.22 Allowed 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 114.804 -1.089 . . . . 1.29 112.186 177.091 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 35.0 mm -112.26 -49.37 5.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 120.859 0.361 . . . . 1.89 111.002 -178.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.43 -36.32 73.46 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.004 -0.544 . . . . 2.99 111.699 -178.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -108.58 4.8 24.43 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.328 -0.396 . . . . 1.66 110.456 178.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 55.33 52.27 11.69 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.349 -0.842 . . . . 1.74 111.597 -179.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 19.2 mt -127.05 64.9 62.37 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 116.058 -0.519 . . . . 1.61 111.61 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . 0.42 ' HA ' ' HB1' ' A' ' 65' ' ' ALA . 64.6 Cg_endo -75.76 -20.23 15.59 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 121.956 1.771 . . . . 1.3 110.865 176.667 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -75.78 -19.8 58.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.958 -1.019 . . . . 1.97 110.361 179.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.469 ' OH ' ' HB3' ' A' ' 111' ' ' ASN . 0.5 OUTLIER -64.77 -39.07 93.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.336 -0.847 . . . . 1.13 110.299 178.98 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . 0.414 ' HE1' HG12 ' A' ' 63' ' ' VAL . 0.3 OUTLIER -78.29 6.28 8.59 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.507 -0.769 . . . . 0.91 111.456 -174.44 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -97.36 -53.99 3.29 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.096 0.474 . . . . 2.86 109.727 -179.291 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.9 mp -90.53 -47.02 14.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.563 -0.744 . . . . 1.0 110.878 -178.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 26.8 mm -78.18 114.83 19.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.964 -0.562 . . . . 0.75 110.353 -177.187 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.9 mtmm -72.86 -27.01 61.67 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.677 -0.692 . . . . 1.99 111.441 -176.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -127.13 81.78 69.32 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 116.276 -0.42 . . . . 2.05 110.817 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -65.95 93.63 0.27 Allowed 'Trans proline' 0 C--O 1.236 0.392 0 C-N-CA 122.601 2.201 . . . . 0.89 111.94 178.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 1.6 mmt -126.26 157.55 38.02 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.893 -0.594 . . . . 0.82 110.335 -178.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.617 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 1.2 p-10 -139.65 -121.72 0.12 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.023 -0.989 . . . . 1.42 109.427 -172.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . 0.422 ' SD ' HD13 ' A' ' 50' ' ' LEU . 3.6 ttp -130.72 -17.31 3.23 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.033 0.444 . . . . 0.8 110.434 178.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -88.71 -27.76 23.44 Favored Glycine 0 N--CA 1.442 -0.944 0 N-CA-C 110.235 -1.146 . . . . 0.32 110.235 -179.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -74.23 -36.0 63.9 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.271 -0.464 . . . . 0.95 110.655 176.138 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.438 HG23 ' SG ' ' A' ' 101' ' ' CYS . 75.5 mt -61.73 -53.05 53.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.796 -0.638 . . . . 0.97 110.093 175.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.526 ' O ' ' HG2' ' A' ' 91' ' ' GLU . 0.2 OUTLIER -63.08 -28.18 69.9 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.157 -0.474 . . . . 1.15 111.247 178.843 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.409 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 2.3 tptt -64.36 -47.18 80.3 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.894 0.378 . . . . 2.46 110.581 178.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.505 ' HB3' ' CE2' ' A' ' 95' ' ' TYR . 6.9 mtp180 -65.33 -29.71 70.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.008 -0.542 . . . . 1.16 110.447 178.222 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.552 HD22 ' HB2' ' A' ' 43' ' ' GLN . 12.4 mt -73.22 -54.92 7.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.759 -0.655 . . . . 0.49 111.674 -179.139 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.526 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 2.6 pt-20 -66.77 -31.56 72.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.432 -0.349 . . . . 1.39 111.215 -175.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.409 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 0.7 OUTLIER -81.32 -4.78 56.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.33 -0.395 . . . . 1.3 110.507 178.877 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.5 t30 56.82 58.56 4.0 Favored 'General case' 0 CA--C 1.522 -0.097 0 CA-C-N 115.731 -0.668 . . . . 1.75 111.363 -179.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . 0.456 ' HB2' ' O ' ' A' ' 26' ' ' VAL . 62.1 t80 -87.54 -35.2 18.28 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.31 -0.404 . . . . 0.96 111.067 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.505 ' CE2' ' HB3' ' A' ' 89' ' ' ARG . 54.1 m-85 -77.71 168.8 19.36 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-O 121.823 0.821 . . . . 1.28 111.624 -176.031 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . 0.633 ' CZ3' ' HB2' ' A' ' 32' ' ' PRO . 2.0 t90 -87.48 -44.25 11.45 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 114.116 -1.402 . . . . 1.05 109.432 168.166 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.479 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 3.3 t -153.22 170.89 19.45 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 114.949 -1.023 . . . . 1.0 110.265 -170.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.515 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -65.43 -23.43 66.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.746 0.308 . . . . 0.66 111.121 -177.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.3 -25.25 67.76 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.09 -0.505 . . . . 0.85 111.03 178.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.406 ' HB3' ' CD1' ' A' ' 95' ' ' TYR . 16.6 tt0 -83.86 -29.5 27.19 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.227 0.537 . . . . 2.44 109.653 179.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.438 ' SG ' HG23 ' A' ' 86' ' ' ILE . 5.2 t -82.45 -30.98 29.7 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.715 -0.675 . . . . 0.95 111.076 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.02 -30.96 69.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.258 -0.428 . . . . 1.13 110.775 -179.533 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -63.59 -43.07 98.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.13 -0.486 . . . . 2.96 110.261 175.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -68.31 -43.16 78.23 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.036 -0.529 . . . . 1.87 109.715 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.684 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -54.92 -52.18 63.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.478 -0.783 . . . . 0.38 110.508 176.138 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -59.78 -40.65 88.98 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.838 -0.619 . . . . 0.97 110.67 178.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . 0.433 ' HA ' ' OG1' ' A' ' 110' ' ' THR . 97.3 m -63.34 -43.71 96.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.118 -0.492 . . . . 0.43 111.276 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.49 -44.3 68.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.987 0.422 . . . . 0.88 110.82 177.024 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -71.63 -41.08 69.29 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.124 -0.489 . . . . 0.29 111.24 -179.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.433 ' OG1' ' HA ' ' A' ' 107' ' ' THR . 0.1 OUTLIER -65.0 -42.15 94.73 Favored 'General case' 0 CA--C 1.52 -0.21 0 C-N-CA 120.88 -0.328 . . . . 0.66 110.623 -179.851 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . 0.469 ' HB3' ' OH ' ' A' ' 73' ' ' TYR . 59.6 m-20 -48.75 -52.55 23.1 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.656 -0.702 . . . . 1.84 111.114 178.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 1.8 t -56.26 -46.42 79.68 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.694 -0.684 . . . . 0.63 111.573 177.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -73.58 -20.81 60.52 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.83 0.307 . . . . 0.81 111.83 -174.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 89.0 mt -91.8 -55.93 5.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.653 0.263 . . . . 0.55 111.301 -176.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -76.19 -39.98 53.48 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.823 0.344 . . . . 1.22 110.905 -175.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -93.01 150.9 20.22 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.339 -0.391 . . . . 1.04 110.414 -176.232 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 2.9 ttpp -64.98 142.03 98.55 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.859 -0.609 . . . . 3.47 110.195 178.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . 0.44 ' HA ' HG11 ' A' ' 123' ' ' VAL . 16.7 Cg_endo -59.46 -13.1 19.31 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.832 2.355 . . . . 0.96 112.376 178.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -111.45 26.91 10.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.119 -0.491 . . . . 1.23 110.811 178.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . 0.412 ' OD1' HG22 ' A' ' 122' ' ' ILE . 6.2 t70 -88.09 158.7 18.5 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.178 -0.465 . . . . 1.34 110.76 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -61.81 -43.66 98.41 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.153 -0.93 . . . . 1.44 110.611 -179.313 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . 0.412 HG22 ' OD1' ' A' ' 120' ' ' ASP . 1.0 OUTLIER -69.16 -36.65 74.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-O 120.998 0.428 . . . . 0.42 110.872 -178.688 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.44 HG11 ' HA ' ' A' ' 118' ' ' PRO . 3.1 t -67.66 -36.52 76.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.075 0.464 . . . . 0.35 110.302 -179.187 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.34 -33.78 71.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.812 -0.631 . . . . 0.52 110.112 178.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . 0.421 ' O ' HD13 ' A' ' 129' ' ' LEU . 16.9 mtt -79.61 -42.93 23.86 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.819 -0.628 . . . . 0.62 110.677 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.94 -36.79 65.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.042 -0.526 . . . . 0.31 111.755 -178.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -62.43 -40.91 98.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.471 . . . . 1.94 111.055 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.04 -37.71 61.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.078 0.466 . . . . 0.32 110.523 179.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.597 HD21 ' HA ' ' A' ' 56' ' ' ALA . 1.6 mp -58.85 -39.59 81.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.416 -0.811 . . . . 0.33 110.536 179.037 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -61.47 -25.12 67.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.517 -0.765 . . . . 1.47 112.075 -177.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.517 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -66.45 -39.45 88.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.777 0.322 . . . . 2.24 110.433 -176.924 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.573 HD12 HD23 ' A' ' 50' ' ' LEU . 8.9 mt -70.06 -30.9 45.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.069 -0.514 . . . . 1.23 110.416 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.54 ' O ' HG23 ' A' ' 137' ' ' VAL . 61.5 t80 -59.78 -62.87 1.55 Allowed 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.835 -0.621 . . . . 0.46 110.491 179.447 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.61 -30.26 71.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.937 0.398 . . . . 0.64 110.665 -177.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.517 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -57.16 -47.42 81.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.491 -0.777 . . . . 1.61 111.267 179.724 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . 0.668 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -89.18 -18.55 26.91 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.91 -0.587 . . . . 1.52 111.139 -176.304 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 133' ' ' PHE . 40.5 t -72.34 -31.79 40.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 109.77 -0.455 . . . . 0.35 109.77 177.174 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -60.3 -27.38 67.26 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.48 -0.782 . . . . 0.5 110.588 175.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -91.02 -8.86 47.89 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.054 -0.975 . . . . 1.76 111.123 -173.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . 0.561 ' SD ' ' HB2' ' A' ' 42' ' ' MET . 0.9 OUTLIER -64.81 144.59 98.93 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.11 -0.495 . . . . 0.86 111.171 -178.208 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . 0.435 ' C ' ' H ' ' A' ' 143' ' ' GLU . 57.9 Cg_endo -70.34 107.38 1.96 Allowed 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.453 2.102 . . . . 0.67 111.324 178.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.78 29.45 0.11 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.273 0.559 . . . . 2.91 111.759 -173.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . 0.435 ' H ' ' C ' ' A' ' 141' ' ' PRO . 22.3 mt-10 -105.33 -39.71 6.07 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.782 -0.644 . . . . 2.7 109.631 174.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 63.27 73.27 0.46 Allowed 'General case' 0 C--N 1.334 -0.089 0 CA-C-N 114.788 -1.096 . . . . 2.34 109.829 -174.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 1.5 t -89.62 122.01 40.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.698 -0.683 . . . . 0.99 109.734 -176.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.779 ' HG3' HG22 ' A' ' 36' ' ' THR . 7.9 tt0 -70.71 147.58 48.91 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.758 0.313 . . . . 1.53 110.698 -179.291 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 64.9 mt . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.584 -0.722 . . . . 1.57 110.239 -178.856 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.5 p . . . . . 0 N--CA 1.448 -0.552 0 CA-C-O 121.303 0.573 . . . . 0.93 109.48 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.2 m -177.11 138.78 0.25 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-N 114.957 -1.02 . . . . 1.61 109.827 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.5 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 35.3 t-20 -135.34 127.17 17.73 Favored Pre-proline 0 C--N 1.322 -0.625 0 N-CA-C 109.472 -0.566 . . . . 1.6 109.472 178.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -61.46 -38.3 64.55 Favored 'Trans proline' 0 N--CA 1.475 0.426 0 C-N-CA 123.239 2.626 . . . . 1.87 113.034 -178.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.1 m -80.34 -19.65 46.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.216 0.531 . . . . 2.18 110.49 -178.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.5 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 5.6 tttp -96.61 107.07 34.15 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.522 -0.763 . . . . 2.75 110.502 178.432 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.461 ' HB2' ' CZ3' ' A' ' 96' ' ' TRP . 3.2 Cg_exo -72.85 149.02 46.99 Favored 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 122.413 2.075 . . . . 1.38 112.391 -178.119 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -145.92 85.68 0.18 Allowed Glycine 0 N--CA 1.442 -0.965 0 N-CA-C 110.746 -0.941 . . . . 0.97 110.746 178.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -74.54 159.25 32.44 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.15 0.5 . . . . 1.93 110.976 -175.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.59 104.74 17.19 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.241 -0.436 . . . . 2.64 109.886 179.382 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.589 HG22 ' HG3' ' A' ' 146' ' ' GLU . 1.5 p -104.36 164.29 11.84 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.048 -0.524 . . . . 0.68 110.513 178.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -60.46 -41.37 93.99 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.268 -0.424 . . . . 1.47 110.551 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -61.92 -44.66 96.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.238 -0.437 . . . . 1.04 110.565 178.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.16 -52.96 63.11 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.824 -0.625 . . . . 0.8 111.092 -178.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 20.7 mm100 -69.26 -28.25 66.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.042 -0.526 . . . . 1.75 110.919 -179.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.466 ' CE1' ' HG2' ' A' ' 140' ' ' MET . 53.2 t80 -61.23 -63.84 1.15 Allowed 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.994 -0.548 . . . . 0.64 110.137 177.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.517 ' O ' HG12 ' A' ' 47' ' ' VAL . 0.3 OUTLIER -61.52 -30.52 70.68 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.946 -0.301 . . . . 1.13 110.611 -173.091 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -58.71 -59.18 5.81 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.684 -0.689 . . . . 1.3 111.245 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 63.4 m-80 -87.81 -25.95 23.09 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 112.231 0.456 . . . . 0.5 112.231 -177.016 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.404 HG11 ' CZ ' ' A' ' 41' ' ' TYR . 97.4 t -89.1 -57.97 3.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 112.386 0.513 . . . . 0.3 112.386 -175.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.475 HG23 ' HA ' ' A' ' 42' ' ' MET . 59.6 t -81.97 -66.25 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 111.941 0.348 . . . . 0.26 111.941 -170.06 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.517 HG12 ' O ' ' A' ' 42' ' ' MET . 2.1 p -66.99 -32.7 59.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 C-N-CA 120.925 -0.31 . . . . 0.83 111.345 -174.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.2 -34.0 75.63 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.775 -0.37 . . . . 2.4 111.001 176.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 38.2 m -79.89 -36.59 36.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.725 0.297 . . . . 0.55 110.302 177.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.653 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -60.5 -44.7 95.7 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.169 -0.469 . . . . 0.33 109.768 175.399 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 17.6 t-105 -62.76 -30.43 71.44 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.457 -0.792 . . . . 0.39 111.556 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.9 mtpp -90.7 7.62 38.6 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.018 0.377 . . . . 2.24 112.018 -174.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.493 ' HB3' ' HB2' ' A' ' 56' ' ' ALA . 41.3 t-80 -75.61 143.55 42.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.913 0.387 . . . . 0.39 110.133 177.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -69.12 -25.09 64.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.166 -0.47 . . . . 1.91 112.205 -175.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.568 ' HB3' ' HB2' ' A' ' 125' ' ' MET . 21.7 m-85 -105.23 8.42 33.96 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.065 0.459 . . . . 0.93 110.619 -178.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.609 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -93.15 8.13 41.4 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.135 0.493 . . . . 0.28 110.837 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.419 ' CG ' ' HD3' ' A' ' 58' ' ' PRO . 62.3 p-90 -62.44 -34.47 15.06 Favored Pre-proline 0 CA--C 1.548 0.872 0 N-CA-C 113.873 1.064 . . . . 0.58 113.873 -175.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.643 ' HG2' ' SD ' ' A' ' 125' ' ' MET . 5.6 Cg_exo -80.14 3.66 7.44 Favored 'Trans proline' 0 C--N 1.36 1.173 0 C-N-CA 121.636 1.557 . . . . 0.47 112.221 179.219 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 31.4 m-85 -113.9 47.05 1.23 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.702 0.763 . . . . 1.11 109.166 178.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -114.18 -13.61 12.38 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.146 -0.934 . . . . 0.63 109.903 -178.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.76 117.0 24.43 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 115.268 -0.878 . . . . 1.63 110.602 -169.377 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.32 143.23 93.55 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 122.337 2.024 . . . . 0.87 112.196 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.479 HG11 ' CD2' ' A' ' 73' ' ' TYR . 2.9 t -67.5 106.09 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-O 121.715 0.769 . . . . 0.88 110.047 178.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.404 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.0 OUTLIER -107.51 0.93 23.06 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.859 -1.064 . . . . 1.85 109.379 178.774 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.404 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 77.31 -55.73 0.53 Allowed 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 114.274 -1.33 . . . . 1.29 111.595 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.0 mt -77.77 -49.41 21.99 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.817 0 N-CA-C 111.635 0.235 . . . . 1.89 111.635 -173.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.71 -19.73 64.38 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.805 0.298 . . . . 2.99 111.805 -175.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.46 HD12 ' HA ' ' A' ' 68' ' ' LEU . 1.4 tp -109.84 -0.86 18.17 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.888 -0.325 . . . . 1.66 111.288 179.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 61.88 42.78 9.98 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.711 -0.677 . . . . 1.74 112.129 178.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -126.51 68.37 67.74 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 115.969 -0.56 . . . . 1.61 110.683 176.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -72.1 -26.0 18.61 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.093 1.862 . . . . 1.3 111.869 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 -84.28 -4.14 58.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.741 -0.663 . . . . 1.97 110.484 -178.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.479 ' CD2' HG11 ' A' ' 63' ' ' VAL . 27.0 t80 -65.29 -30.89 71.79 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.699 -0.682 . . . . 1.13 110.307 178.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -80.89 2.93 24.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.548 -0.751 . . . . 0.91 111.613 -171.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.7 mtpt -96.75 -51.08 4.43 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.078 0.466 . . . . 2.86 109.859 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.7 mp -81.58 -45.0 20.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.865 -0.607 . . . . 1.0 110.539 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 45.0 mm -89.56 123.32 41.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.192 -0.458 . . . . 0.75 110.019 -178.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.468 ' O ' ' HD3' ' A' ' 80' ' ' PRO . 0.9 OUTLIER -86.44 -36.12 19.29 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.263 -0.426 . . . . 1.99 111.295 -175.235 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -112.33 90.4 14.15 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 109.708 -0.479 . . . . 2.05 109.708 176.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.468 ' HD3' ' O ' ' A' ' 78' ' ' LYS . 13.1 Cg_exo -69.11 87.11 0.47 Allowed 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.996 2.464 . . . . 0.89 111.937 -178.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.0 mmt -124.0 164.38 19.47 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.888 -0.596 . . . . 0.82 110.766 -176.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.46 ' CG ' ' H ' ' A' ' 83' ' ' MET . 19.9 t70 -143.18 -144.64 0.16 Allowed 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 106.755 -1.572 . . . . 1.42 106.755 -177.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . 0.46 ' H ' ' CG ' ' A' ' 82' ' ' ASP . 0.5 OUTLIER -107.84 -18.06 13.91 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 107.924 -1.139 . . . . 0.8 107.924 177.758 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -74.98 -26.26 67.16 Favored Glycine 0 N--CA 1.439 -1.135 0 N-CA-C 109.398 -1.481 . . . . 0.32 109.398 177.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -83.9 -37.22 22.65 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 114.868 -0.666 . . . . 0.95 111.079 177.324 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -61.11 -49.96 82.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.003 -0.544 . . . . 0.97 109.719 178.095 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.415 ' HG3' ' N ' ' A' ' 88' ' ' LYS . 0.1 OUTLIER -66.58 -26.44 67.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.863 -0.608 . . . . 1.15 111.001 179.957 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.415 ' N ' ' HG3' ' A' ' 87' ' ' LYS . 1.2 tptt -67.47 -51.36 52.26 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-O 120.688 0.28 . . . . 2.46 110.703 -179.327 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.453 HH22 ' CG ' ' A' ' 104' ' ' ASP . 10.0 mtm-85 -67.66 -24.05 65.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.944 0.402 . . . . 1.16 110.81 -179.153 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 4.0 mt -73.33 -59.52 2.67 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.957 -0.565 . . . . 0.49 111.041 177.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 19.9 pt-20 -66.63 -36.73 83.29 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.738 -0.665 . . . . 1.39 111.114 -175.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -79.26 -4.41 50.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.384 -0.371 . . . . 1.3 110.6 -179.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 58.25 72.04 0.55 Allowed 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.428 0.632 . . . . 1.75 110.731 176.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -93.97 -49.94 5.56 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.002 -0.544 . . . . 0.96 110.98 179.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.438 ' CE1' ' HB2' ' A' ' 101' ' ' CYS . 0.2 OUTLIER -96.07 -179.67 4.76 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.846 0.355 . . . . 1.28 110.94 -177.933 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . 0.461 ' CZ3' ' HB2' ' A' ' 32' ' ' PRO . 2.1 t-105 -82.58 -46.52 13.23 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.74 -0.664 . . . . 1.05 111.878 -174.055 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.4 t -144.93 172.3 13.24 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 120.424 -0.511 . . . . 1.0 110.929 -173.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -68.16 -17.88 64.46 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.081 -0.508 . . . . 0.66 111.458 -176.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.06 -33.81 73.91 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 121.019 0.437 . . . . 0.85 109.976 175.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.4 -37.35 63.4 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.877 -0.601 . . . . 2.44 109.571 177.179 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.438 ' HB2' ' CE1' ' A' ' 95' ' ' TYR . 41.3 t -68.01 -39.49 83.17 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.565 -0.743 . . . . 0.95 111.322 -178.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.23 -22.99 67.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.359 -0.382 . . . . 1.13 110.912 -177.029 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -67.2 -44.29 79.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.064 0.459 . . . . 2.96 110.466 175.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . 0.453 ' CG ' HH22 ' A' ' 89' ' ' ARG . 0.6 OUTLIER -78.76 -29.97 45.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.36 -0.382 . . . . 1.87 110.194 -179.348 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.653 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -60.84 -40.72 93.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.77 -0.65 . . . . 0.38 109.647 173.145 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -68.72 -34.52 75.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.771 -0.65 . . . . 0.97 110.126 174.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 86.3 m -63.02 -51.93 64.86 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.891 -0.595 . . . . 0.43 111.265 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 10.7 ptm -59.57 -32.75 70.65 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.783 0.325 . . . . 0.88 111.291 -178.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -73.13 -47.51 43.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.509 -0.314 . . . . 0.29 110.764 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.1 p -64.84 -38.97 92.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.756 0.312 . . . . 0.66 110.589 179.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.0 m-20 -47.83 -53.08 16.65 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.529 -0.759 . . . . 1.84 110.731 177.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 10.6 t -60.84 -43.81 97.78 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.312 -0.858 . . . . 0.63 111.02 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -66.14 -33.98 77.02 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.492 -0.322 . . . . 0.81 111.541 -177.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 70.6 mt -80.32 -55.46 8.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.575 -0.284 . . . . 0.55 111.622 -176.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . 0.475 ' CE1' ' HA ' ' A' ' 73' ' ' TYR . 57.6 t80 -68.3 -35.87 78.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.908 0.385 . . . . 1.22 111.43 -174.048 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 63.6 m-80 -94.23 -170.23 2.24 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.137 -0.483 . . . . 1.04 110.725 -175.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.31 154.5 40.54 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 116.32 -0.4 . . . . 3.47 110.363 -177.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -61.9 -25.54 78.21 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.415 2.076 . . . . 0.96 111.67 176.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.26 22.07 12.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.787 -0.642 . . . . 1.23 111.018 178.273 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . 0.41 ' OD1' HG22 ' A' ' 122' ' ' ILE . 3.8 t70 -87.23 155.57 20.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 1.34 110.341 179.431 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -68.83 -42.36 77.31 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.728 -0.669 . . . . 1.44 110.244 -178.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . 0.707 ' HA ' ' SD ' ' A' ' 125' ' ' MET . 1.4 tp -65.21 -32.81 59.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.853 -0.612 . . . . 0.42 110.743 -177.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 2.7 t -74.09 -37.71 47.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.145 0.498 . . . . 0.35 110.105 178.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.14 -38.45 79.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.681 -0.691 . . . . 0.52 110.515 -178.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . 0.707 ' SD ' ' HA ' ' A' ' 122' ' ' ILE . 0.0 OUTLIER -82.5 -39.28 22.67 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.325 -0.398 . . . . 0.62 111.311 177.991 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.23 -32.24 64.26 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.753 0.311 . . . . 0.31 111.566 -178.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -63.98 -44.39 92.84 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.17 -0.468 . . . . 1.94 110.692 177.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.63 -41.23 84.23 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.236 -0.438 . . . . 0.32 110.565 177.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.609 HD21 ' HA ' ' A' ' 56' ' ' ALA . 9.3 mp -56.73 -45.34 82.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.81 -0.632 . . . . 0.33 110.549 177.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -65.05 -23.32 67.15 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.649 -0.705 . . . . 1.47 111.551 -177.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.2 -49.16 53.07 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 110.17 -0.308 . . . . 2.24 110.17 -177.11 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.442 HG13 ' O ' ' A' ' 129' ' ' LEU . 1.0 OUTLIER -72.41 -24.92 22.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.41 -0.359 . . . . 1.23 110.324 178.07 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -60.76 -62.07 2.12 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.97 -0.559 . . . . 0.46 110.406 174.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.82 -25.58 67.28 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.897 0.379 . . . . 0.64 110.629 -177.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -60.84 -44.06 97.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.68 -0.691 . . . . 1.61 111.042 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 30.6 mttm -91.73 -13.0 32.36 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.955 0.407 . . . . 1.52 111.017 -177.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 19.5 t -81.73 -29.12 10.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.207 0.527 . . . . 0.35 110.04 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -71.76 -7.76 50.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.436 0.636 . . . . 0.5 110.324 176.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -107.68 2.87 24.12 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.237 -0.892 . . . . 1.76 110.378 179.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . 0.466 ' HG2' ' CE1' ' A' ' 41' ' ' TYR . 0.6 OUTLIER -61.77 149.51 84.85 Favored Pre-proline 0 C--O 1.232 0.182 0 CA-C-N 115.669 -0.696 . . . . 0.86 110.676 177.022 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -74.02 90.68 0.96 Allowed 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 121.902 1.734 . . . . 0.67 110.832 175.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -63.79 -4.15 2.94 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.996 -0.547 . . . . 2.91 111.736 -175.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -79.06 -34.77 43.42 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.771 -0.649 . . . . 2.7 110.066 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 67.68 93.26 0.08 Allowed 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 114.813 -1.085 . . . . 2.34 109.524 -177.024 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -113.04 118.73 58.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.818 -0.628 . . . . 0.99 110.142 -176.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.589 ' HG3' HG22 ' A' ' 36' ' ' THR . 2.4 tt0 -74.28 132.59 42.23 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.676 -0.49 . . . . 1.53 109.676 178.291 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 34.3 mt . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.744 -0.646 . . . . 1.57 110.133 -177.062 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 7.9 p . . . . . 0 N--CA 1.452 -0.368 0 CA-C-O 121.897 0.856 . . . . 0.93 108.696 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -146.43 138.42 24.88 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 114.32 -1.309 . . . . 1.61 108.416 177.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.527 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 16.4 t-20 -143.01 122.33 7.6 Favored Pre-proline 0 C--N 1.313 -0.98 0 C-N-CA 120.786 -0.366 . . . . 1.6 110.459 176.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -67.39 -46.29 2.97 Favored 'Trans proline' 0 N--CA 1.475 0.439 0 C-N-CA 123.43 2.753 . . . . 1.87 113.351 -177.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.8 m -71.81 -39.52 69.79 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.975 -0.557 . . . . 2.18 110.502 -175.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.527 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 0.2 OUTLIER -66.38 130.37 94.2 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.338 -0.846 . . . . 2.75 110.005 179.638 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -60.97 156.79 42.11 Favored 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.7 2.267 . . . . 1.38 112.554 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -160.67 63.11 0.29 Allowed Glycine 0 N--CA 1.446 -0.667 0 N-CA-C 110.658 -0.977 . . . . 0.97 110.658 -179.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.461 ' HG3' ' CZ2' ' A' ' 96' ' ' TRP . 5.8 mtm-85 -79.53 132.54 36.34 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.848 0.356 . . . . 1.93 110.142 -174.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.4 ttmt -80.33 119.75 23.47 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.104 -0.498 . . . . 2.64 110.438 -173.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.758 HG22 ' HG3' ' A' ' 146' ' ' GLU . 0.6 OUTLIER -112.76 160.34 18.06 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.815 -0.354 . . . . 0.68 111.154 178.421 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.648 ' ND2' ' HG3' ' A' ' 141' ' ' PRO . 11.9 t30 -55.51 -46.56 76.96 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 115.786 -0.643 . . . . 1.47 110.321 176.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -54.32 -46.31 72.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.648 -0.706 . . . . 1.04 110.925 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.0 -57.96 10.75 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.643 -0.708 . . . . 0.8 111.561 -177.409 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -70.86 -25.29 62.74 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.066 -0.515 . . . . 1.75 110.79 -176.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.584 ' CE1' ' HG2' ' A' ' 140' ' ' MET . 54.0 t80 -61.85 -62.39 1.83 Allowed 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 116.064 -0.516 . . . . 0.64 110.345 175.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.578 ' O ' HG13 ' A' ' 47' ' ' VAL . 0.1 OUTLIER -59.15 -35.22 73.14 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 120.792 0.33 . . . . 1.13 110.15 -175.329 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -56.75 -54.66 43.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.567 -0.742 . . . . 1.3 111.159 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.454 ' O ' ' HB2' ' A' ' 48' ' ' LYS . 69.5 m-80 -87.02 -28.62 22.51 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.362 0.504 . . . . 0.5 112.362 -177.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 74.8 t -89.19 -58.24 3.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 112.3 0.482 . . . . 0.3 112.3 -175.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.697 HG22 ' HB3' ' A' ' 136' ' ' LYS . 43.3 t -79.52 -62.67 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 116.482 -0.326 . . . . 0.26 111.359 -170.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.578 HG13 ' O ' ' A' ' 42' ' ' MET . 1.5 m -62.92 -33.22 59.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 111.669 0.248 . . . . 0.83 111.669 -175.146 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -67.48 -35.24 78.79 Favored 'General case' 0 CA--C 1.528 0.118 0 C-N-CA 120.936 -0.305 . . . . 2.4 111.488 179.275 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.4 m -74.24 -37.76 63.7 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.78 -0.368 . . . . 0.55 110.51 178.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.716 HD23 HD12 ' A' ' 132' ' ' ILE . 0.1 OUTLIER -66.59 -37.61 85.27 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.255 0.55 . . . . 0.33 109.844 175.253 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 9.7 t-105 -65.41 -25.72 67.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.47 -0.786 . . . . 0.39 111.623 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -89.74 3.16 53.65 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 120.61 -0.436 . . . . 2.24 111.665 -177.107 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.525 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 15.7 t-80 -89.1 129.96 35.63 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.647 -0.501 . . . . 0.39 109.647 175.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.97 -3.27 41.1 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.188 0.44 . . . . 1.91 112.188 -172.198 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.525 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 2.1 m-30 -93.05 -10.38 36.36 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.157 0.503 . . . . 0.93 110.114 175.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.513 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -92.4 19.93 6.67 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.972 -0.558 . . . . 0.28 110.514 178.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.642 ' HA ' ' CE2' ' A' ' 60' ' ' TYR . 44.8 p-90 -67.89 -34.45 6.34 Favored Pre-proline 0 CA--C 1.543 0.675 0 N-CA-C 113.309 0.855 . . . . 0.58 113.309 -175.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.601 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 3.4 Cg_exo -82.31 10.15 3.68 Favored 'Trans proline' 0 C--N 1.358 1.055 0 C-N-CA 121.711 1.607 . . . . 0.47 111.203 174.129 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -112.57 -15.65 13.0 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.546 -0.752 . . . . 1.11 111.182 -177.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.642 ' CE2' ' HA ' ' A' ' 57' ' ' TRP . 12.5 m-85 -66.6 -28.58 68.61 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.389 0.614 . . . . 0.63 110.147 177.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -98.35 116.57 65.48 Favored Pre-proline 0 C--N 1.32 -0.693 0 CA-C-N 115.063 -0.971 . . . . 1.63 110.431 -172.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.653 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 18.0 Cg_endo -62.56 133.08 40.77 Favored 'Trans proline' 0 C--O 1.24 0.597 0 C-N-CA 122.564 2.176 . . . . 0.87 112.52 -178.589 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.401 HG11 ' CD2' ' A' ' 73' ' ' TYR . 5.1 t -62.33 111.14 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 CA-C-O 121.893 0.854 . . . . 0.88 109.846 178.066 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.415 ' HB3' ' HG2' ' A' ' 67' ' ' LYS . 0.2 OUTLIER -122.5 -3.53 8.84 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.684 -1.144 . . . . 1.85 109.717 -175.058 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 74.95 -40.43 0.44 Allowed 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 114.967 -1.015 . . . . 1.29 111.596 -178.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.8 mt -86.43 -60.92 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 120.677 0.275 . . . . 1.89 111.25 -176.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.415 ' HG2' ' HB3' ' A' ' 64' ' ' ASP . 6.1 pttt -71.5 -10.6 60.01 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.246 0.462 . . . . 2.99 112.246 -175.342 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.461 HD13 ' HA ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -114.58 -1.57 13.34 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.921 0.391 . . . . 1.66 110.596 175.949 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 52.9 50.33 18.24 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.849 -0.614 . . . . 1.74 111.735 -178.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.442 HD11 ' HG ' ' A' ' 68' ' ' LEU . 12.7 mt -120.81 71.07 19.32 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.804 -0.634 . . . . 1.61 109.628 174.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.71 -31.47 20.7 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.805 2.337 . . . . 1.3 113.458 -170.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.456 ' OD1' ' HG3' ' A' ' 75' ' ' LYS . 0.4 OUTLIER -100.11 10.86 40.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.925 0.393 . . . . 1.97 111.316 -176.763 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.401 ' CD2' HG11 ' A' ' 63' ' ' VAL . 15.8 t80 -63.46 -37.41 87.19 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.073 -0.512 . . . . 1.13 110.266 178.071 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 8.6 m-70 -78.99 -1.11 33.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.678 -0.692 . . . . 0.91 111.415 -175.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.456 ' HG3' ' OD1' ' A' ' 72' ' ' ASP . 13.0 mmtm -96.24 -18.01 20.35 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.216 0.531 . . . . 2.86 110.159 -179.272 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.3 mp -114.82 -45.43 4.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.66 -0.7 . . . . 1.0 110.171 178.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 33.3 mm -93.72 116.38 34.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 120.953 0.406 . . . . 0.75 110.116 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.85 -28.41 60.66 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.904 -0.589 . . . . 1.99 111.282 -177.028 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -122.33 85.33 47.4 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 116.23 -0.441 . . . . 2.05 110.842 -177.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -68.34 89.95 0.39 Allowed 'Trans proline' 0 CA--C 1.528 0.209 0 C-N-CA 122.527 2.152 . . . . 0.89 112.198 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 10.2 mmt -131.73 157.38 43.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.067 -0.515 . . . . 0.82 110.331 -178.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.653 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 1.2 p-10 -151.67 -115.39 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.699 -0.682 . . . . 1.42 109.637 -172.227 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . 0.421 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 11.6 ttp -129.45 -22.28 3.06 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 121.922 -0.486 . . . . 0.8 110.789 176.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -83.3 -25.88 46.0 Favored Glycine 0 N--CA 1.444 -0.816 0 N-CA-C 110.607 -0.997 . . . . 0.32 110.607 179.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.442 HG23 ' HB3' ' A' ' 62' ' ' PRO . 0.6 OUTLIER -76.82 -44.86 30.83 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.375 -0.413 . . . . 0.95 110.504 175.76 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.404 HG12 ' HB3' ' A' ' 104' ' ' ASP . 83.6 mt -58.5 -48.68 84.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.732 -0.667 . . . . 0.97 110.257 175.199 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.421 ' HB3' ' O ' ' A' ' 83' ' ' MET . 0.0 OUTLIER -59.6 -32.93 70.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.116 -0.493 . . . . 1.15 110.902 178.397 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 8.6 tppt? -67.4 -50.39 59.81 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 120.601 0.239 . . . . 2.46 110.696 -179.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.706 ' HB3' ' CE1' ' A' ' 95' ' ' TYR . 15.2 mtp180 -68.22 -28.25 67.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.911 0.386 . . . . 1.16 110.643 179.29 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 5.8 mt -68.14 -56.59 8.24 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.86 -0.609 . . . . 0.49 111.635 177.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -65.92 -26.36 67.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.982 0.42 . . . . 1.39 111.24 -176.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -87.96 -4.68 58.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.989 -0.551 . . . . 1.3 110.715 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 50.63 61.66 3.1 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.739 -0.664 . . . . 1.75 110.766 -176.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 72.4 t80 -85.07 -32.83 22.64 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 115.913 -0.585 . . . . 0.96 111.014 179.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.706 ' CE1' ' HB3' ' A' ' 89' ' ' ARG . 0.1 OUTLIER -80.71 -145.15 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.797 0.808 . . . . 1.28 110.398 178.885 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . 0.461 ' CZ2' ' HG3' ' A' ' 34' ' ' ARG . 2.3 t-105 -126.83 -53.59 1.43 Allowed 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 114.479 -1.237 . . . . 1.05 108.091 174.397 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 12.6 t -133.93 -173.06 3.14 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 115.043 -0.98 . . . . 1.0 110.072 -177.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.81 -5.49 58.24 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.611 0.243 . . . . 0.66 111.345 -177.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.45 -41.92 98.65 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.902 0.382 . . . . 0.85 110.552 177.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -69.66 -28.68 66.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.332 0.587 . . . . 2.44 109.593 177.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 4.2 t -71.77 -30.75 65.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.305 -0.862 . . . . 0.95 110.543 177.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.6 ttm -64.89 -40.37 94.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.08 -0.509 . . . . 1.13 109.935 177.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.2 -37.37 83.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.73 -0.668 . . . . 2.96 110.123 176.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . 0.404 ' HB3' HG12 ' A' ' 86' ' ' ILE . 1.1 m-20 -58.6 -55.58 33.28 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.601 -0.727 . . . . 1.87 110.509 177.14 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.642 ' HE2' HD12 ' A' ' 50' ' ' LEU . 3.5 m-85 -58.31 -44.58 88.65 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.782 -0.645 . . . . 0.38 110.913 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -56.87 -44.98 82.77 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.28 -0.418 . . . . 0.97 110.294 177.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 54.3 m -65.12 -47.53 76.81 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.125 -0.489 . . . . 0.43 111.037 178.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.72 -41.57 74.05 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.083 -0.508 . . . . 0.88 111.313 -179.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -73.41 -45.79 52.59 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.422 -0.354 . . . . 0.29 110.633 -177.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.0 p -63.81 -35.6 81.14 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.607 -0.27 . . . . 0.66 110.871 -179.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 49.2 m-20 -46.28 -52.08 13.3 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.638 -0.71 . . . . 1.84 111.348 176.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 7.4 t -61.02 -38.42 86.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.451 -0.795 . . . . 0.63 111.085 -178.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -75.97 -16.21 60.03 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.336 -0.393 . . . . 0.81 111.71 -175.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 57.1 mt -92.39 -51.66 11.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.95 0.405 . . . . 0.55 110.816 178.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -71.52 -35.6 70.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.841 -0.618 . . . . 1.22 111.654 -175.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -105.3 -179.82 4.05 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.912 0.387 . . . . 1.04 110.982 -175.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.4 154.83 39.27 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.195 -0.457 . . . . 3.47 110.921 -177.027 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -61.48 -17.8 55.81 Favored 'Trans proline' 0 N--CA 1.476 0.49 0 C-N-CA 122.733 2.289 . . . . 0.96 112.373 177.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.16 0.42 51.22 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.832 -0.622 . . . . 1.23 111.515 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -71.43 156.25 39.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.446 0.641 . . . . 1.34 111.734 -173.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -69.58 -41.59 75.61 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.91 -1.041 . . . . 1.44 109.884 -179.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 3.1 tp -67.46 -28.11 40.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.602 -0.727 . . . . 0.42 110.627 -179.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 1.3 t -70.48 -45.61 73.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 109.794 -0.447 . . . . 0.35 109.794 176.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.68 -33.23 71.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.668 -0.696 . . . . 0.52 109.736 177.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 30.5 mtt -71.15 -46.62 61.12 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.475 -0.784 . . . . 0.62 110.506 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.58 -40.42 75.2 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.253 -0.43 . . . . 0.31 111.481 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -44.96 96.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.468 -0.333 . . . . 1.94 111.217 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -70.68 -36.89 73.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.074 0.464 . . . . 0.32 110.564 178.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.513 HD21 ' HA ' ' A' ' 56' ' ' ALA . 0.6 OUTLIER -64.29 -44.06 92.82 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.567 -0.742 . . . . 0.33 110.667 179.589 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -62.18 -25.91 68.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.744 -0.662 . . . . 1.47 111.349 -178.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.46 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 17.0 ttpt -64.25 -42.39 96.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.22 -0.445 . . . . 2.24 110.029 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.716 HD12 HD23 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -77.27 -23.69 14.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.09 -0.505 . . . . 1.23 110.501 -179.625 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.491 ' O ' HG23 ' A' ' 137' ' ' VAL . 30.3 t80 -62.09 -62.1 2.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.074 -0.512 . . . . 0.46 110.168 176.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.11 -26.46 68.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.126 0.489 . . . . 0.64 110.205 -178.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.46 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.01 -33.66 72.3 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.385 -0.825 . . . . 1.61 111.762 179.314 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . 0.697 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -97.96 -25.14 15.09 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.135 0.493 . . . . 1.52 110.597 -179.692 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.517 ' O ' ' HB2' ' A' ' 140' ' ' MET . 53.9 t -69.79 -32.35 51.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.948 -0.569 . . . . 0.35 110.619 179.176 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.59 -16.98 64.03 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.124 -0.489 . . . . 0.5 110.49 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -100.29 0.03 39.37 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.741 -0.663 . . . . 1.76 110.223 -179.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . 0.584 ' HG2' ' CE1' ' A' ' 41' ' ' TYR . 0.1 OUTLIER -71.65 161.2 79.86 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.69 -0.686 . . . . 0.86 110.195 176.903 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . 0.648 ' HG3' ' ND2' ' A' ' 37' ' ' ASN . 65.3 Cg_endo -74.7 107.67 2.52 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 121.714 1.609 . . . . 0.67 109.796 173.306 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -72.29 2.39 6.12 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.801 0.334 . . . . 2.91 111.881 -171.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -100.22 -111.52 0.19 Allowed 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 108.652 -0.87 . . . . 2.7 108.652 171.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 178.3 131.35 0.07 Allowed 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.606 -0.887 . . . . 2.34 108.606 173.164 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 2.8 t -129.04 94.05 2.27 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.705 -0.48 . . . . 0.99 109.705 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.758 ' HG3' HG22 ' A' ' 36' ' ' THR . 4.8 tt0 -67.99 146.28 53.7 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 110.148 -0.316 . . . . 1.53 110.148 177.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 9.8 mt . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.427 -0.797 . . . . 1.57 110.133 -178.598 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.471 ' O ' ' HB2' ' A' ' 94' ' ' TYR . 5.1 p . . . . . 0 N--CA 1.445 -0.686 0 CA-C-O 121.49 0.662 . . . . 0.93 109.216 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -160.52 142.14 12.38 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.305 -0.861 . . . . 1.61 109.053 175.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.45 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 23.0 t-20 -134.92 127.12 18.16 Favored Pre-proline 0 C--N 1.316 -0.871 0 CA-C-O 120.639 0.257 . . . . 1.6 110.57 -179.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -72.97 -44.89 0.52 Allowed 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 122.837 2.358 . . . . 1.87 112.344 175.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.0 m -74.15 -38.22 63.81 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.743 -0.662 . . . . 2.18 110.719 -175.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.45 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 0.2 OUTLIER -85.78 130.31 51.22 Favored Pre-proline 0 C--N 1.322 -0.612 0 N-CA-C 109.055 -0.72 . . . . 2.75 109.055 177.183 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.448 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 18.6 Cg_endo -57.5 137.8 83.14 Favored 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.794 2.329 . . . . 1.38 112.907 -175.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -150.67 84.66 0.16 Allowed Glycine 0 N--CA 1.446 -0.656 0 CA-C-N 114.775 -1.102 . . . . 0.97 110.503 -178.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -100.78 -177.84 3.59 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.101 0.477 . . . . 1.93 111.338 -172.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.3 ttmt -123.76 100.0 6.56 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.712 -0.676 . . . . 2.64 110.09 177.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.542 HG22 ' HG3' ' A' ' 146' ' ' GLU . 18.0 p -101.13 173.94 6.23 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 116.41 -0.359 . . . . 0.68 110.042 175.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.567 HD21 ' HG2' ' A' ' 141' ' ' PRO . 0.0 OUTLIER -65.68 -38.4 89.18 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.252 -0.431 . . . . 1.47 110.598 178.779 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.517 ' NE2' ' HG2' ' A' ' 144' ' ' GLU . 1.5 tt0 -62.9 -42.77 99.89 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 120.619 0.247 . . . . 1.04 110.856 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.432 ' HB2' ' HA ' ' A' ' 97' ' ' SER . 0.8 OUTLIER -61.07 -54.09 49.03 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.165 -0.471 . . . . 0.8 110.601 179.917 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.3 mm-40 -63.36 -35.55 80.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.988 -0.551 . . . . 1.75 110.781 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -58.39 -64.05 1.06 Allowed 'General case' 0 C--O 1.217 -0.641 0 CA-C-N 116.181 -0.463 . . . . 0.64 110.359 177.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.569 ' SD ' ' HB3' ' A' ' 101' ' ' CYS . 3.3 ttm -60.15 -32.84 71.42 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.414 -0.217 . . . . 1.13 110.414 -174.479 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -59.31 -58.11 10.06 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.904 -0.589 . . . . 1.3 111.056 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.4 m-80 -86.19 -28.04 24.14 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.146 -0.479 . . . . 0.5 112.054 -175.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.422 HG12 ' HD3' ' A' ' 136' ' ' LYS . 95.7 t -88.63 -56.57 5.06 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.926 0 CA-C-N 116.093 -0.503 . . . . 0.3 111.641 -176.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.507 HG23 ' HA ' ' A' ' 42' ' ' MET . 92.5 t -80.08 -65.74 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.395 -0.366 . . . . 0.26 111.892 -170.703 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -63.57 -34.45 67.69 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 C-N-CA 120.601 -0.439 . . . . 0.83 111.526 -174.425 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.89 -32.0 73.25 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.935 -0.306 . . . . 2.4 111.442 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 51.1 m -75.64 -37.5 59.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.842 0.353 . . . . 0.55 110.329 177.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.629 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -63.56 -40.81 97.94 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.162 -0.681 . . . . 0.33 109.162 174.031 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 12.4 t-105 -59.12 -37.56 77.51 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.115 -0.948 . . . . 0.39 111.494 178.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 14.3 mttm -88.86 9.27 25.37 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.178 0.436 . . . . 2.24 112.178 -175.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 16.3 t-80 -79.51 144.98 33.46 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.422 -0.584 . . . . 0.39 109.422 174.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -79.9 -12.75 59.72 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.616 0.246 . . . . 1.91 111.543 -174.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 3.7 m-30 -99.43 -8.16 25.12 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.992 0.425 . . . . 0.93 110.653 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.434 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -95.36 16.34 17.07 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.084 0.469 . . . . 0.28 110.808 -179.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.447 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 60.3 p-90 -62.38 -34.14 14.14 Favored Pre-proline 0 CA--C 1.548 0.867 0 N-CA-C 114.282 1.216 . . . . 0.58 114.282 -174.577 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.447 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 59.4 Cg_endo -90.58 9.88 3.05 Favored 'Trans proline' 0 C--N 1.36 1.148 0 CA-C-N 121.204 1.466 . . . . 0.47 112.866 -178.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -106.39 6.97 30.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.184 -0.462 . . . . 1.11 110.88 -177.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.8 m-30 -75.66 -24.87 56.4 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.212 -0.449 . . . . 0.63 111.966 -175.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.16 128.15 31.43 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 116.482 -0.326 . . . . 1.63 111.325 -171.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.499 ' HA ' ' OD2' ' A' ' 82' ' ' ASP . 27.0 Cg_endo -63.12 133.22 39.91 Favored 'Trans proline' 0 C--O 1.236 0.424 0 C-N-CA 122.667 2.244 . . . . 0.87 111.482 178.037 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.7 t -59.62 110.48 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 122.189 0.995 . . . . 0.88 111.676 -178.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -121.17 125.89 48.3 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 113.848 -1.524 . . . . 1.85 106.977 167.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.561 ' HB2' ' NE2' ' A' ' 74' ' ' HIS . . . -63.09 -12.49 27.26 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.62 0.6 . . . . 1.29 112.62 -170.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.9 mp -106.58 -42.44 6.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 120.84 0.352 . . . . 1.89 110.497 -177.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 36.1 tptt -67.09 -44.12 80.81 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.056 -0.52 . . . . 2.99 111.076 179.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.767 ' HB3' HD22 ' A' ' 70' ' ' LEU . 0.2 OUTLIER -97.54 -3.77 39.12 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.374 -0.375 . . . . 1.66 110.693 -179.123 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 53.37 63.04 2.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.607 -0.724 . . . . 1.74 110.689 -176.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.767 HD22 ' HB3' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -119.81 70.09 13.58 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 115.749 -0.66 . . . . 1.61 110.235 -179.037 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.79 -24.78 8.34 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.388 2.059 . . . . 1.3 112.622 -175.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -96.76 -8.18 31.9 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.004 0.43 . . . . 1.97 110.708 -178.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.578 ' O ' ' HB ' ' A' ' 77' ' ' ILE . 17.6 t80 -61.91 -40.17 94.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.762 -0.654 . . . . 1.13 110.208 178.209 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . 0.561 ' NE2' ' HB2' ' A' ' 65' ' ' ALA . 9.5 m-70 -80.33 3.82 19.83 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.877 -0.601 . . . . 0.91 111.174 -178.336 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -108.16 -50.12 3.09 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.032 0.444 . . . . 2.86 110.114 179.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.0 mt -78.71 -36.95 20.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.74 -0.664 . . . . 1.0 110.692 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.578 ' HB ' ' O ' ' A' ' 73' ' ' TYR . 28.1 mm -99.79 135.6 34.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.903 -0.59 . . . . 0.75 109.819 -178.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.66 -40.64 14.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.813 0.339 . . . . 1.99 111.019 -176.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 10.1 m-20 -113.26 95.73 36.5 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.196 -0.456 . . . . 2.05 110.03 177.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -68.59 92.87 0.42 Allowed 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.924 2.416 . . . . 0.89 112.306 -178.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 13.3 mmt -135.79 167.28 21.46 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.121 -0.49 . . . . 0.82 110.633 -178.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.499 ' OD2' ' HA ' ' A' ' 62' ' ' PRO . 3.0 p-10 -151.49 -123.19 0.04 OUTLIER 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.044 -0.98 . . . . 1.42 108.788 -177.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -125.31 -17.77 5.55 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.082 0.467 . . . . 0.8 110.301 177.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.459 ' O ' ' HB2' ' A' ' 88' ' ' LYS . . . -88.65 -23.97 34.57 Favored Glycine 0 N--CA 1.44 -1.088 0 N-CA-C 110.304 -1.118 . . . . 0.32 110.304 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -76.89 -39.98 49.08 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.332 -0.434 . . . . 0.95 110.442 175.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.606 HG23 ' SG ' ' A' ' 101' ' ' CYS . 38.9 mt -59.8 -49.09 85.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.707 -0.679 . . . . 0.97 110.369 176.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.421 ' HG3' ' O ' ' A' ' 84' ' ' GLY . 0.2 OUTLIER -67.14 -28.94 68.55 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.367 -0.379 . . . . 1.15 110.682 179.138 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.459 ' HB2' ' O ' ' A' ' 84' ' ' GLY . 11.1 tttt -64.89 -41.73 95.38 Favored 'General case' 0 N--CA 1.457 -0.089 0 CA-C-O 121.049 0.452 . . . . 2.46 110.691 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 10.0 mtp180 -75.25 -32.35 61.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.012 -0.54 . . . . 1.16 110.68 178.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 8.1 mt -63.52 -53.17 56.09 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.863 -0.608 . . . . 0.49 111.167 178.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -66.79 -30.38 70.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.079 -0.51 . . . . 1.39 111.211 -176.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 12.4 m-80 -84.15 0.0 50.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.151 -0.477 . . . . 1.3 111.184 -177.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 60.52 50.97 5.42 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.705 0.628 . . . . 1.75 111.393 178.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . 0.471 ' HB2' ' O ' ' A' ' 26' ' ' VAL . 61.3 t80 -82.87 -33.59 26.99 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.082 -0.508 . . . . 0.96 111.193 179.279 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.689 ' CD1' ' HB3' ' A' ' 100' ' ' GLU . 41.0 m-85 -90.78 169.45 10.94 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 121.541 0.686 . . . . 1.28 111.607 -176.148 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . 0.448 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 2.0 t90 -88.3 -44.7 10.62 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 114.526 -1.215 . . . . 1.05 109.2 169.314 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.432 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 35.3 t -152.12 177.18 10.77 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.139 -0.937 . . . . 1.0 110.224 -172.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -69.29 -18.05 63.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.928 0.394 . . . . 0.66 111.284 -177.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.57 -18.44 64.87 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.075 -0.511 . . . . 0.85 110.874 178.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.689 ' HB3' ' CD1' ' A' ' 95' ' ' TYR . 1.5 mt-10 -86.32 -39.95 15.96 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 109.435 -0.58 . . . . 2.44 109.435 177.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.606 ' SG ' HG23 ' A' ' 86' ' ' ILE . 0.1 OUTLIER -68.58 -30.84 69.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.432 -0.804 . . . . 0.95 110.758 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 9.6 ttm -56.78 -33.43 66.63 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.031 -0.532 . . . . 1.13 110.595 177.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -66.28 -41.35 89.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.847 -0.615 . . . . 2.96 110.539 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -76.51 -38.91 54.44 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.089 -0.505 . . . . 1.87 110.494 -178.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.629 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -59.7 -47.0 87.36 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.159 -0.473 . . . . 0.38 110.194 177.06 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -57.53 -47.1 82.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.852 -0.613 . . . . 0.97 109.823 175.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 89.1 m -59.95 -50.15 74.88 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.657 -0.701 . . . . 0.43 111.077 179.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.03 -41.69 68.33 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 122.594 0.357 . . . . 0.88 111.496 -178.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -70.31 -47.5 60.84 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.0 0.429 . . . . 0.29 110.043 -177.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 38.1 p -66.63 -30.52 70.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.883 -0.599 . . . . 0.66 111.144 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 23.3 m-20 -54.9 -45.54 74.72 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-O 121.188 0.518 . . . . 1.84 110.127 178.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 18.6 t -61.76 -41.5 97.76 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.252 -0.885 . . . . 0.63 110.808 179.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . 0.492 ' HD1' HG22 ' A' ' 123' ' ' VAL . 22.8 m-85 -71.16 -22.96 61.98 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.168 -0.469 . . . . 0.81 111.531 -176.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 51.7 mt -93.15 -52.3 10.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.968 0.413 . . . . 0.55 111.609 -179.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -66.31 -35.31 80.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.685 -0.689 . . . . 1.22 111.474 -173.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -106.49 -174.41 2.53 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.119 -0.491 . . . . 1.04 110.73 -176.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . 0.45 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 0.0 OUTLIER -80.93 145.73 57.83 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 116.585 -0.28 . . . . 3.47 110.257 178.978 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -64.29 -9.08 18.55 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.671 2.248 . . . . 0.96 112.628 179.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.35 26.68 7.28 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.037 -0.528 . . . . 1.23 110.369 177.154 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 0.4 OUTLIER -84.18 171.35 12.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.499 . . . . 1.34 111.197 -177.518 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -65.03 -53.05 51.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.745 -0.661 . . . . 1.44 110.607 -177.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 3.1 tp -63.97 -29.61 47.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.629 -0.714 . . . . 0.42 111.104 -178.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.492 HG22 ' HD1' ' A' ' 113' ' ' TYR . 2.0 t -70.35 -43.62 78.19 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-O 121.085 0.469 . . . . 0.35 110.02 177.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.32 -37.29 74.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.508 -0.769 . . . . 0.52 109.55 177.315 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . 0.495 ' O ' HD13 ' A' ' 129' ' ' LEU . 33.1 mtt -70.54 -45.68 65.05 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.179 -0.919 . . . . 0.62 110.825 178.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.84 -34.91 63.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 0.31 111.973 -178.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.39 -47.06 85.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.69 -0.232 . . . . 1.94 111.054 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -70.81 -39.27 73.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.061 0.457 . . . . 0.32 110.606 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.495 HD13 ' O ' ' A' ' 125' ' ' MET . 4.7 mp -56.9 -41.37 77.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.431 -0.804 . . . . 0.33 110.491 177.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -59.82 -30.34 68.86 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.281 -0.872 . . . . 1.47 112.355 -178.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.517 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 9.3 mmtp -63.25 -49.1 75.45 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 120.629 0.252 . . . . 2.24 110.605 -171.26 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -72.49 -24.57 21.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.359 -0.382 . . . . 1.23 110.86 -179.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.463 ' O ' HG23 ' A' ' 137' ' ' VAL . 26.4 t80 -63.16 -62.58 1.6 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.247 -0.433 . . . . 0.46 110.564 178.165 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.59 -22.75 62.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.888 0.375 . . . . 0.64 110.689 -175.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.517 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -65.03 -51.16 63.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.849 -0.614 . . . . 1.61 110.447 179.798 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . 0.422 ' HD3' HG12 ' A' ' 45' ' ' VAL . 40.8 mttt -80.8 -15.31 56.74 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.058 -0.519 . . . . 1.52 111.146 -175.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 133' ' ' PHE . 38.8 t -80.49 -35.22 15.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.227 -0.442 . . . . 0.35 110.083 177.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -69.51 -11.17 60.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.215 0.531 . . . . 0.5 110.793 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -97.48 -8.63 28.81 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.84 -0.618 . . . . 1.76 110.616 179.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -71.71 139.66 83.51 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 116.094 -0.503 . . . . 0.86 111.018 -177.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . 0.567 ' HG2' HD21 ' A' ' 37' ' ' ASN . 56.2 Cg_endo -72.0 98.43 0.9 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.653 2.235 . . . . 0.67 111.969 177.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . 0.427 ' HA ' ' NE2' ' A' ' 38' ' ' GLN . 0.3 OUTLIER -73.66 -8.45 56.04 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.014 0.435 . . . . 2.91 110.604 -179.996 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -66.81 -35.46 80.11 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.082 -0.71 . . . . 2.7 109.082 174.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.517 ' HG2' ' NE2' ' A' ' 38' ' ' GLN . 0.0 OUTLIER 74.72 143.17 0.07 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 114.037 -1.438 . . . . 2.34 112.651 174.31 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . 0.439 ' O ' ' HB3' ' A' ' 37' ' ' ASN . 2.9 t -140.62 104.16 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-N 114.321 -1.309 . . . . 0.99 108.86 176.025 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.542 ' HG3' HG22 ' A' ' 36' ' ' THR . 16.8 tt0 -72.29 141.32 48.88 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.877 -0.416 . . . . 1.53 109.877 178.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 34.8 mt . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.495 -0.764 . . . . 1.57 109.829 -178.543 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.452 -0.331 0 CA-C-O 121.257 0.551 . . . . 0.93 110.218 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.2 m -156.21 138.92 15.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.502 -0.772 . . . . 1.61 109.204 178.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.493 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 19.6 t-20 -144.5 138.01 14.27 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-O 120.696 0.284 . . . . 1.6 110.412 178.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -69.94 -48.25 0.72 Allowed 'Trans proline' 0 CA--C 1.531 0.366 0 C-N-CA 123.138 2.559 . . . . 1.87 113.287 177.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.513 ' O ' ' HD3' ' A' ' 32' ' ' PRO . 28.2 t -77.1 -33.07 57.01 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.952 0.406 . . . . 2.18 110.729 -175.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.493 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 0.6 OUTLIER -92.01 104.22 10.11 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.82 -0.627 . . . . 2.75 109.85 177.981 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.513 ' HD3' ' O ' ' A' ' 30' ' ' SER . 16.2 Cg_exo -68.64 154.13 72.05 Favored 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 122.69 2.26 . . . . 1.38 112.845 -177.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -131.27 121.85 3.29 Favored Glycine 0 N--CA 1.441 -0.973 0 N-CA-C 110.291 -1.124 . . . . 0.97 110.291 178.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.479 ' HG3' ' CE2' ' A' ' 96' ' ' TRP . 1.5 mmm180 -131.47 171.91 12.83 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.895 0.379 . . . . 1.93 110.576 -174.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.485 ' HA ' HD22 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -108.94 103.32 12.34 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.105 -0.498 . . . . 2.64 110.134 179.341 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.687 HG22 ' HG3' ' A' ' 146' ' ' GLU . 23.9 p -109.05 170.18 8.21 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.182 -0.463 . . . . 0.68 111.066 178.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.444 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 55.6 t30 -62.67 -49.78 73.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.964 -0.562 . . . . 1.47 110.8 -179.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.8 tt0 -61.6 -37.43 83.88 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 120.689 0.281 . . . . 1.04 110.781 -179.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.779 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.6 OUTLIER -61.2 -59.2 5.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.932 -0.576 . . . . 0.8 110.884 -179.954 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -67.37 -29.44 68.97 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 116.081 -0.509 . . . . 1.75 110.742 -178.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.444 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 44.7 t80 -60.63 -63.39 1.32 Allowed 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.796 -0.638 . . . . 0.64 110.872 177.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.493 ' O ' HG12 ' A' ' 47' ' ' VAL . 23.6 ttp -61.04 -28.62 69.19 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.851 0.358 . . . . 1.13 110.358 -173.217 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.536 ' HB2' HD22 ' A' ' 90' ' ' LEU . 12.4 tt0 -61.41 -58.48 8.02 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.54 -0.755 . . . . 1.3 111.273 177.159 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -86.01 -26.59 25.33 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.364 -0.38 . . . . 0.5 111.777 -175.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.685 HG12 ' HG2' ' A' ' 136' ' ' LYS . 93.6 t -89.37 -57.84 3.94 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 N-CA-C 112.382 0.512 . . . . 0.3 112.382 -176.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.794 HG22 ' HB3' ' A' ' 136' ' ' LYS . 67.9 t -81.82 -66.59 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 112.016 0.376 . . . . 0.26 112.016 -170.385 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.493 HG12 ' O ' ' A' ' 42' ' ' MET . 0.9 OUTLIER -66.43 -34.21 68.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 120.477 -0.489 . . . . 0.83 111.298 -174.016 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.461 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -59.53 -38.04 79.95 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 121.012 -0.275 . . . . 2.4 111.437 178.456 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.7 m -74.6 -35.83 62.97 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.865 -0.334 . . . . 0.55 110.711 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.62 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -67.26 -33.86 76.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.266 0.555 . . . . 0.33 109.574 176.767 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 18.2 t-105 -65.06 -31.18 72.27 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.472 -0.786 . . . . 0.39 110.877 177.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.461 ' HG3' ' O ' ' A' ' 48' ' ' LYS . 13.6 mtpp -83.65 14.87 3.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.888 0.375 . . . . 2.24 111.646 -176.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.432 ' CD2' HD11 ' A' ' 132' ' ' ILE . 4.6 t-80 -98.82 128.43 45.03 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.095 -0.705 . . . . 0.39 109.095 173.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.415 ' NE2' ' HA ' ' A' ' 54' ' ' GLN . 0.0 OUTLIER -85.57 9.74 15.15 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.698 -0.401 . . . . 1.91 111.797 -173.991 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -103.35 -6.95 21.43 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.26 -0.644 . . . . 0.93 109.26 170.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.517 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -94.64 14.99 19.29 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.43 -0.804 . . . . 0.28 110.11 177.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.567 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 48.9 p-90 -66.92 -34.54 7.57 Favored Pre-proline 0 CA--C 1.544 0.74 0 N-CA-C 113.467 0.914 . . . . 0.58 113.467 -175.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.567 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 7.6 Cg_exo -73.79 -2.67 12.55 Favored 'Trans proline' 0 C--N 1.364 1.357 0 CA-C-N 121.108 1.431 . . . . 0.47 111.512 177.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.439 ' HB3' ' HB2' ' A' ' 83' ' ' MET . 1.9 m-85 -105.64 0.16 26.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.824 -0.626 . . . . 1.11 110.462 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 6.2 m-30 -66.47 -40.47 89.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.331 0.586 . . . . 0.63 110.88 -178.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.64 129.48 28.76 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-N 115.467 -0.788 . . . . 1.63 110.179 -176.587 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.572 ' HA ' ' OD2' ' A' ' 82' ' ' ASP . 19.5 Cg_endo -59.95 147.12 94.03 Favored 'Trans proline' 0 C--O 1.238 0.512 0 C-N-CA 122.964 2.443 . . . . 0.87 113.475 -176.233 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.411 ' O ' HG12 ' A' ' 63' ' ' VAL . 2.5 t -86.84 98.88 7.56 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 N-CA-C 108.408 -0.96 . . . . 0.88 108.408 177.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -109.78 12.12 24.14 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 114.812 -1.085 . . . . 1.85 110.896 -174.328 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 77.93 -17.55 0.56 Allowed 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 114.721 -1.127 . . . . 1.29 112.526 177.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.6 mt -109.29 -49.11 7.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 120.811 0.339 . . . . 1.89 110.762 -177.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.6 ttmm -56.96 -43.38 81.53 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.96 -0.563 . . . . 2.99 110.95 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.585 ' HB3' HD22 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -95.2 0.99 54.56 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.038 -0.528 . . . . 1.66 111.086 179.043 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 53.16 60.43 3.76 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 109.106 -0.701 . . . . 1.74 109.106 -174.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.585 HD22 ' HB3' ' A' ' 68' ' ' LEU . 0.4 OUTLIER -128.6 66.07 73.52 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 115.497 -0.774 . . . . 1.61 111.662 -170.124 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -77.49 -27.79 6.03 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.186 1.924 . . . . 1.3 111.828 177.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -76.83 -23.99 52.74 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.591 -0.731 . . . . 1.97 110.448 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.46 -43.59 93.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.452 -0.795 . . . . 1.13 110.468 178.254 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -77.66 6.31 7.56 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.254 -0.885 . . . . 0.91 111.195 -175.323 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -108.93 -57.98 2.08 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 120.869 0.366 . . . . 2.86 110.046 -179.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 26.9 mt -73.45 -42.7 56.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.835 -0.62 . . . . 1.0 110.852 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.487 HD11 ' HB2' ' A' ' 115' ' ' TYR . 27.1 mm -87.54 126.39 41.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.188 0.518 . . . . 0.75 110.004 -178.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.05 -53.99 45.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.515 -0.766 . . . . 1.99 110.879 -176.67 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.742 ' HB2' HG21 ' A' ' 107' ' ' THR . 0.3 OUTLIER -120.48 95.3 49.02 Favored Pre-proline 0 C--N 1.324 -0.539 0 N-CA-C 109.75 -0.463 . . . . 2.05 109.75 178.01 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -67.87 100.25 0.6 Allowed 'Trans proline' 0 CA--C 1.528 0.206 0 C-N-CA 122.19 1.926 . . . . 0.89 111.775 178.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.81 159.64 34.22 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.449 0.642 . . . . 0.82 111.428 -176.234 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.572 ' OD2' ' HA ' ' A' ' 62' ' ' PRO . 2.3 p-10 -136.99 -116.21 0.16 Allowed 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.383 -1.281 . . . . 1.42 108.649 -177.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . 0.439 ' HB2' ' HB3' ' A' ' 59' ' ' PHE . 3.5 ttp -132.71 -19.51 2.34 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.795 0.331 . . . . 0.8 110.645 176.045 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -84.1 -29.13 31.97 Favored Glycine 0 N--CA 1.442 -0.905 0 N-CA-C 110.556 -1.018 . . . . 0.32 110.556 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.19 -39.01 68.93 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.925 0.393 . . . . 0.95 110.492 176.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.513 HG23 ' SG ' ' A' ' 101' ' ' CYS . 62.1 mt -59.76 -50.41 80.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.559 -0.746 . . . . 0.97 110.304 177.015 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.505 ' O ' ' HG2' ' A' ' 91' ' ' GLU . 0.0 OUTLIER -70.6 -21.9 62.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.337 -0.392 . . . . 1.15 111.37 -178.6 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.533 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 12.5 tppt? -65.09 -42.6 93.93 Favored 'General case' 0 CA--C 1.526 0.043 0 CA-C-O 120.714 0.292 . . . . 2.46 110.765 179.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.484 HH21 ' HE2' ' A' ' 94' ' ' TYR . 63.4 mtp180 -68.26 -32.33 72.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.96 0.409 . . . . 1.16 110.456 176.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.63 ' HG ' ' OH ' ' A' ' 95' ' ' TYR . 4.7 mt -69.13 -59.72 2.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.543 -0.753 . . . . 0.49 111.662 -177.195 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.505 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 16.6 pt-20 -73.95 -15.98 61.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.044 -0.526 . . . . 1.39 111.819 -173.031 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.533 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 0.9 OUTLIER -94.9 -3.39 48.79 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.997 -0.281 . . . . 1.3 110.363 176.962 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 52.3 57.43 6.46 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.653 -0.703 . . . . 1.75 111.186 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . 0.484 ' HE2' HH21 ' A' ' 89' ' ' ARG . 27.6 t80 -75.7 -48.91 19.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.322 -0.399 . . . . 0.96 110.888 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.63 ' OH ' ' HG ' ' A' ' 90' ' ' LEU . 0.1 OUTLIER -97.92 177.65 5.37 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.211 0.529 . . . . 1.28 111.212 -175.212 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . 0.479 ' CE2' ' HG3' ' A' ' 34' ' ' ARG . 1.9 t-105 -77.92 -48.03 17.28 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.277 -0.874 . . . . 1.05 110.761 -179.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 17.3 t -142.42 168.47 19.66 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.862 0.363 . . . . 1.0 110.892 -173.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.779 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -78.23 -11.71 59.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.033 -0.53 . . . . 0.66 111.613 -175.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.98 -27.39 66.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.002 0.43 . . . . 0.85 110.581 178.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.98 -36.19 59.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.073 -0.512 . . . . 2.44 110.245 177.537 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.513 ' SG ' HG23 ' A' ' 86' ' ' ILE . 0.5 OUTLIER -70.75 -19.81 62.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 0.95 110.897 179.678 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.582 ' HE1' HG22 ' A' ' 137' ' ' VAL . 11.3 mmt -55.95 -26.12 46.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.191 0.519 . . . . 1.13 110.144 173.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.16 -39.88 60.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.751 -0.659 . . . . 2.96 109.995 176.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.88 -53.98 51.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.817 -0.629 . . . . 1.87 110.345 178.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.62 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.6 OUTLIER -57.26 -47.7 80.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.497 -0.774 . . . . 0.38 110.605 -179.934 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -56.85 -44.01 81.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.787 -0.642 . . . . 0.97 110.256 177.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . 0.742 HG21 ' HB2' ' A' ' 79' ' ' ASN . 90.5 m -64.3 -47.47 79.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.02 -0.537 . . . . 0.43 111.317 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.402 ' HG3' ' O ' ' A' ' 82' ' ' ASP . 0.3 OUTLIER -51.12 -44.4 61.34 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.734 0.302 . . . . 0.88 111.011 179.298 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -72.68 -47.55 46.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.02 -0.536 . . . . 0.29 110.953 -177.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.4 p -64.75 -37.5 87.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.46 -0.336 . . . . 0.66 110.91 -178.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . 0.467 ' OD1' HG13 ' A' ' 77' ' ' ILE . 0.4 OUTLIER -54.33 -45.43 72.67 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.803 -0.635 . . . . 1.84 110.32 178.1 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . 0.588 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 1.2 m -60.93 -40.58 93.78 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.948 -0.569 . . . . 0.63 110.813 176.328 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -74.6 -19.7 60.21 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.265 -0.425 . . . . 0.81 111.094 -176.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 68.0 mt -93.42 -61.41 2.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.49 -0.323 . . . . 0.55 111.557 -179.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . 0.487 ' HB2' HD11 ' A' ' 77' ' ' ILE . 43.2 t80 -68.89 -49.62 56.68 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.062 0.458 . . . . 1.22 110.446 -175.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . 0.588 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 14.0 m120 -80.02 167.58 20.27 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.654 -0.703 . . . . 1.04 110.214 177.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . 0.484 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 6.4 mttp -98.0 160.73 27.7 Favored Pre-proline 0 C--N 1.318 -0.769 0 N-CA-C 109.739 -0.467 . . . . 3.47 109.739 177.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . 0.691 ' HA ' HG11 ' A' ' 123' ' ' VAL . 18.9 Cg_endo -61.51 -13.63 30.56 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.474 2.116 . . . . 0.96 111.762 175.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.82 -4.11 44.39 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.251 -0.886 . . . . 1.23 111.284 178.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . 0.484 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 1.9 m-20 -74.06 148.3 42.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.987 0.422 . . . . 1.34 110.471 -176.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.77 -43.56 98.6 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.612 -0.722 . . . . 1.44 111.105 -175.537 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 2.0 tp -66.4 -33.1 61.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.874 -0.603 . . . . 0.42 111.291 -178.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.691 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.1 t -66.09 -42.06 90.69 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.109 0.48 . . . . 0.35 109.792 178.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.81 -32.14 70.37 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.549 -0.75 . . . . 0.52 110.05 178.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . 0.505 ' O ' HD13 ' A' ' 129' ' ' LEU . 11.2 mtt -79.24 -46.07 18.54 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.591 -0.731 . . . . 0.62 110.518 177.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -55.46 -41.69 73.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.361 -0.381 . . . . 0.31 111.711 -178.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.66 -31.79 73.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.801 0.334 . . . . 1.94 111.235 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -78.06 -38.88 43.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.094 0.473 . . . . 0.32 110.121 176.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.517 HD21 ' HA ' ' A' ' 56' ' ' ALA . 2.2 mp -59.47 -42.46 92.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.414 -0.812 . . . . 0.33 110.172 177.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -52.16 -29.36 21.79 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 114.953 -1.021 . . . . 1.47 112.867 -176.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.509 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.1 OUTLIER -60.64 -44.21 96.64 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 120.667 0.27 . . . . 2.24 110.757 -173.955 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.44 ' H ' HG13 ' A' ' 132' ' ' ILE . 0.4 OUTLIER -77.77 -23.61 14.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.159 -0.473 . . . . 1.23 111.105 -176.449 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.553 ' O ' HG23 ' A' ' 137' ' ' VAL . 34.1 t80 -65.92 -63.05 1.17 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.504 -0.316 . . . . 0.46 110.578 -179.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.446 ' H ' ' HG ' ' A' ' 134' ' ' LEU . 0.4 OUTLIER -68.97 -21.74 64.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.948 0.404 . . . . 0.64 110.657 -176.298 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.509 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -68.01 -45.47 73.94 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.697 -0.683 . . . . 1.61 110.185 178.089 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . 0.794 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -79.25 -28.51 42.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.042 -0.526 . . . . 1.52 111.082 -179.216 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.582 HG22 ' HE1' ' A' ' 102' ' ' MET . 54.2 t -65.08 -34.47 70.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.135 0.493 . . . . 0.35 110.573 178.019 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.79 -12.61 61.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.308 0.575 . . . . 0.5 110.509 177.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -105.02 0.37 27.59 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.765 -0.652 . . . . 1.76 110.343 179.013 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . 0.472 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 11.3 mtp -75.74 141.73 72.57 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.955 -0.566 . . . . 0.86 110.924 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -73.44 92.43 0.85 Allowed 'Trans proline' 0 N--CA 1.462 -0.355 0 C-N-CA 122.324 2.016 . . . . 0.67 110.964 177.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -74.24 -1.65 21.5 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.042 -0.526 . . . . 2.91 111.648 -173.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -82.1 -39.37 23.45 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.65 -0.5 . . . . 2.7 109.65 175.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 72.93 134.23 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 114.504 -1.226 . . . . 2.34 111.697 178.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 34.4 t -142.49 112.24 2.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.299 -0.864 . . . . 0.99 109.14 179.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.687 ' HG3' HG22 ' A' ' 36' ' ' THR . 31.1 tt0 -63.13 138.51 58.57 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.719 -0.392 . . . . 1.53 110.396 179.463 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 96.5 mt . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.528 -0.749 . . . . 1.57 110.618 -174.03 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.4 p . . . . . 0 N--CA 1.453 -0.303 0 CA-C-O 121.718 0.77 . . . . 0.93 109.235 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.4 m -162.97 135.38 5.4 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 114.979 -1.01 . . . . 1.61 109.375 175.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.427 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 23.4 t-20 -126.94 125.86 24.3 Favored Pre-proline 0 C--N 1.321 -0.633 0 N-CA-C 109.742 -0.466 . . . . 1.6 109.742 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -66.06 -46.63 4.36 Favored 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 123.057 2.505 . . . . 1.87 113.017 -176.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.8 m -77.93 -22.02 50.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.987 0.422 . . . . 2.18 110.97 -176.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.427 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 4.6 ttmt -81.94 113.38 42.64 Favored Pre-proline 0 C--N 1.325 -0.484 0 N-CA-C 109.172 -0.677 . . . . 2.75 109.172 173.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.457 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 12.6 Cg_exo -65.34 147.17 87.28 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 121.778 1.652 . . . . 1.38 111.767 -179.234 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -127.81 130.27 6.66 Favored Glycine 0 N--CA 1.442 -0.913 0 CA-C-N 115.417 -0.811 . . . . 0.97 111.197 -176.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 34' ' ' ARG . 1.1 ttp180 -140.3 -179.96 6.3 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 120.975 0.417 . . . . 1.93 110.167 -178.4 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.3 106.06 10.76 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.835 -0.62 . . . . 2.64 109.602 177.565 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.524 HG22 ' HG3' ' A' ' 146' ' ' GLU . 1.3 p -109.14 166.68 10.67 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 120.711 -0.396 . . . . 0.68 110.281 175.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.667 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 0.2 OUTLIER -66.83 -26.56 66.98 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.859 -0.609 . . . . 1.47 110.661 -178.211 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -75.38 -39.29 59.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.817 0.341 . . . . 1.04 110.3 177.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.52 -53.45 56.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.924 -0.58 . . . . 0.8 110.555 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.9 mm100 -70.85 -24.11 62.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.825 -0.625 . . . . 1.75 110.682 -178.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.667 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 35.7 t80 -61.14 -64.11 1.06 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 116.169 -0.468 . . . . 0.64 110.905 177.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.511 ' O ' HG12 ' A' ' 47' ' ' VAL . 2.2 ttm -60.28 -31.71 70.5 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.813 -0.355 . . . . 1.13 110.506 -174.093 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -59.07 -57.27 13.81 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.734 -0.666 . . . . 1.3 110.997 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -86.28 -29.53 22.99 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.104 0.409 . . . . 0.5 112.104 -176.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 99.3 t -88.31 -57.82 3.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 112.161 0.43 . . . . 0.3 112.161 -175.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.653 HG22 ' HB3' ' A' ' 136' ' ' LYS . 60.2 t -82.14 -66.8 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 112.11 0.411 . . . . 0.26 112.11 -169.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.511 HG12 ' O ' ' A' ' 42' ' ' MET . 1.5 p -68.91 -32.9 56.49 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.326 0 C-N-CA 120.711 -0.395 . . . . 0.83 111.411 -174.099 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.11 -26.1 68.1 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 122.092 -0.38 . . . . 2.4 111.084 177.178 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 35.2 m -85.65 -38.1 18.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.77 0.319 . . . . 0.55 110.503 177.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.66 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -66.48 -39.94 89.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.039 0.447 . . . . 0.33 110.211 177.687 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 29.2 t-105 -60.37 -35.52 75.91 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.47 -0.787 . . . . 0.39 111.662 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.59 -4.1 52.83 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.064 0.394 . . . . 2.24 112.064 -174.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.589 ' ND1' ' HB2' ' A' ' 55' ' ' PHE . 10.0 t-80 -75.56 128.71 35.88 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.265 -0.643 . . . . 0.39 109.265 176.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -81.08 7.13 11.66 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.83 0.348 . . . . 1.91 111.46 -174.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.589 ' HB2' ' ND1' ' A' ' 53' ' ' HIS . 2.3 m-30 -103.36 -8.51 20.19 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.514 -0.55 . . . . 0.93 109.514 172.361 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.616 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -91.18 9.98 28.93 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.786 -0.643 . . . . 0.28 110.641 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.495 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 57.8 p-90 -61.9 -35.38 21.22 Favored Pre-proline 0 CA--C 1.547 0.842 0 N-CA-C 113.916 1.08 . . . . 0.58 113.916 -175.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.495 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 3.0 Cg_exo -76.98 -10.78 18.08 Favored 'Trans proline' 0 C--N 1.364 1.358 0 CA-C-N 121.016 1.399 . . . . 0.47 111.733 178.716 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -101.6 10.84 39.84 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.702 -0.681 . . . . 1.11 110.431 -177.028 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 2.9 m-30 -73.23 -31.67 64.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.794 -0.639 . . . . 0.63 111.001 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -114.59 144.7 32.35 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 115.77 -0.65 . . . . 1.63 110.564 -173.634 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.549 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 33.3 Cg_endo -66.35 151.46 83.24 Favored 'Trans proline' 0 C--O 1.237 0.474 0 C-N-CA 122.885 2.39 . . . . 0.87 112.905 -178.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.467 ' O ' HG12 ' A' ' 63' ' ' VAL . 1.4 t -70.42 101.79 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 CA-C-O 122.258 1.028 . . . . 0.88 109.253 173.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -96.16 6.1 49.57 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.336 -1.302 . . . . 1.85 108.993 176.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 69.4 -71.68 0.12 Allowed 'General case' 0 C--O 1.226 -0.137 0 CA-C-N 114.525 -1.216 . . . . 1.29 110.555 -175.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 5.7 mt -65.0 -39.68 86.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 116.372 -0.376 . . . . 1.89 111.09 -176.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.41 -24.25 65.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.034 -0.53 . . . . 2.99 111.766 -179.593 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.488 HD13 ' HA ' ' A' ' 68' ' ' LEU . 0.2 OUTLIER -117.06 5.74 12.83 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.636 0.255 . . . . 1.66 111.513 -178.662 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 65.24 35.37 7.76 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.826 -0.624 . . . . 1.74 111.576 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 2.6 mt -120.19 74.03 21.01 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 115.86 -0.609 . . . . 1.61 110.303 177.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.19 -29.85 25.88 Favored 'Trans proline' 0 C--O 1.233 0.25 0 C-N-CA 122.413 2.075 . . . . 1.3 113.216 -173.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -101.74 13.37 35.06 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.263 0.554 . . . . 1.97 111.057 -177.142 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.401 ' CD2' HG11 ' A' ' 63' ' ' VAL . 13.9 t80 -57.52 -41.25 80.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.68 -0.691 . . . . 1.13 110.442 177.323 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 18.7 m-70 -76.2 3.42 10.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.738 -0.665 . . . . 0.91 111.744 -176.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.0 mmpt? -97.28 -38.32 9.72 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.05 0.452 . . . . 2.86 109.972 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.9 mt -94.81 -47.7 13.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.962 -0.563 . . . . 1.0 110.037 177.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 41.9 mm -91.66 102.42 13.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.822 -0.626 . . . . 0.75 109.469 179.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.1 mtmt -72.35 -29.15 63.53 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.375 -0.83 . . . . 1.99 111.308 -174.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -116.22 80.17 9.36 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 115.719 -0.673 . . . . 2.05 110.315 178.109 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -69.16 97.69 0.6 Allowed 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.9 2.4 . . . . 0.89 111.865 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.6 mmt -133.36 155.02 50.21 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-O 121.363 0.601 . . . . 0.82 110.673 -177.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.549 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 5.0 p-10 -134.98 -129.85 0.16 Allowed 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 114.411 -1.268 . . . . 1.42 109.078 -172.029 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.25 -14.54 4.82 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.299 0.571 . . . . 0.8 110.266 178.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -90.62 -32.03 9.71 Favored Glycine 0 N--CA 1.441 -1.021 0 N-CA-C 109.921 -1.271 . . . . 0.32 109.921 -178.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.471 ' OG1' ' HB3' ' A' ' 62' ' ' PRO . 98.0 m -67.79 -37.32 81.88 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.004 -0.598 . . . . 0.95 110.5 173.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 54.9 mt -63.22 -50.87 77.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.984 -0.553 . . . . 0.97 109.976 176.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.542 ' O ' ' HG2' ' A' ' 91' ' ' GLU . 0.0 OUTLIER -65.47 -29.9 70.62 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.691 -0.686 . . . . 1.15 110.9 -179.737 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 30.6 tttt -66.79 -37.82 85.31 Favored 'General case' 0 C--N 1.337 0.053 0 CA-C-O 120.986 0.422 . . . . 2.46 110.687 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.403 HH12 ' CG ' ' A' ' 104' ' ' ASP . 29.5 mtp180 -74.56 -29.97 61.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.072 -0.513 . . . . 1.16 110.594 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.566 ' HG ' ' OH ' ' A' ' 95' ' ' TYR . 2.8 mt -70.09 -57.54 4.85 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.791 -0.64 . . . . 0.49 111.084 179.031 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.542 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 9.0 pt-20 -72.25 -7.23 48.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.888 -0.596 . . . . 1.39 112.081 -173.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -106.58 -4.22 19.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.412 0.148 . . . . 1.3 111.168 178.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 57.69 63.8 1.72 Allowed 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.337 0.589 . . . . 1.75 110.854 -177.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -78.23 -26.4 47.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.603 -0.726 . . . . 0.96 111.404 -179.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.627 ' HE2' ' HG ' ' A' ' 101' ' ' CYS . 0.1 OUTLIER -135.62 179.19 6.49 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.056 -0.52 . . . . 1.28 111.202 -172.21 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . 0.457 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 1.8 t-105 -66.55 -47.5 72.65 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.451 -0.795 . . . . 1.05 110.742 178.272 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 26.9 t -150.35 167.06 28.15 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.996 -0.547 . . . . 1.0 110.888 -174.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -76.1 -4.69 42.89 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.762 -0.653 . . . . 0.66 111.682 -175.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.36 -32.08 70.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.05 0.452 . . . . 0.85 110.476 178.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -66.42 -43.25 86.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.755 -0.657 . . . . 2.44 110.011 177.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.627 ' HG ' ' HE2' ' A' ' 95' ' ' TYR . 0.0 OUTLIER -75.73 -20.28 58.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.925 -0.579 . . . . 0.95 111.381 -177.226 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -55.55 -29.17 58.5 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.199 0.523 . . . . 1.13 109.989 174.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -73.55 -41.18 63.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.679 -0.691 . . . . 2.96 110.281 175.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . 0.452 ' OD1' ' HA ' ' A' ' 101' ' ' CYS . 8.9 m-20 -68.04 -38.9 83.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.029 -0.532 . . . . 1.87 110.453 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.66 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -59.21 -46.88 87.28 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.871 -0.604 . . . . 0.38 110.466 177.938 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -62.55 -42.69 99.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.884 -0.598 . . . . 0.97 109.977 177.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 94.7 m -63.27 -40.21 96.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.487 -0.779 . . . . 0.43 111.687 -179.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.75 -42.68 62.51 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.057 0.456 . . . . 0.88 110.902 177.026 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -71.1 -40.33 71.57 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.93 -0.577 . . . . 0.29 110.988 -178.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -41.56 75.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.604 -0.271 . . . . 0.66 111.115 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -48.16 -53.26 17.42 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.619 -0.718 . . . . 1.84 111.062 178.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.62 -34.41 77.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.695 -0.684 . . . . 0.63 111.011 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . 0.561 ' HD1' HG22 ' A' ' 123' ' ' VAL . 18.5 m-30 -77.22 -17.77 58.21 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.457 -0.338 . . . . 0.81 111.663 -177.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 67.5 mt -92.72 -53.63 8.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 120.668 0.27 . . . . 0.55 111.305 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -68.59 -37.75 80.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.322 -0.399 . . . . 1.22 110.53 -176.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -108.7 140.94 41.4 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.082 -0.508 . . . . 1.04 109.654 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.33 146.18 97.77 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 116.434 -0.348 . . . . 3.47 110.507 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . 0.822 ' HA ' HG11 ' A' ' 123' ' ' VAL . 37.0 Cg_exo -58.93 -12.12 14.25 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.215 2.61 . . . . 0.96 113.511 -177.532 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.93 -7.59 59.39 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.432 -0.349 . . . . 1.23 111.655 178.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -81.88 171.03 14.96 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.506 0.669 . . . . 1.34 112.043 -174.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 12.0 t0 -76.5 -41.58 46.44 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.497 -1.229 . . . . 1.44 110.791 -174.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . 0.634 ' HA ' ' SD ' ' A' ' 125' ' ' MET . 2.6 tp -62.15 -35.55 69.47 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.11 0 CA-C-O 120.974 0.416 . . . . 0.42 110.043 179.313 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.822 HG11 ' HA ' ' A' ' 118' ' ' PRO . 12.5 t -69.74 -49.32 58.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.118 -0.492 . . . . 0.35 110.04 177.201 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.9 -40.09 72.52 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.305 -0.862 . . . . 0.52 110.892 -177.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . 0.634 ' SD ' ' HA ' ' A' ' 122' ' ' ILE . 0.1 OUTLIER -75.58 -38.7 58.93 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.163 -0.472 . . . . 0.62 111.21 179.742 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . 0.42 ' N ' ' HG2' ' A' ' 125' ' ' MET . . . -60.15 -28.82 68.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.394 -0.366 . . . . 0.31 111.099 177.305 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.88 -38.52 91.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.26 -0.427 . . . . 1.94 110.815 177.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -73.59 -37.63 65.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.094 -0.503 . . . . 0.32 110.151 177.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.616 HD21 ' HA ' ' A' ' 56' ' ' ALA . 7.1 mp -58.25 -44.75 88.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.532 -0.758 . . . . 0.33 110.213 177.011 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -59.54 -30.56 68.7 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.081 -0.963 . . . . 1.47 111.842 -176.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.477 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -65.38 -46.58 79.54 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.576 -0.284 . . . . 2.24 110.467 -175.023 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.49 HD12 HD23 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -74.0 -21.73 18.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.537 -0.301 . . . . 1.23 110.746 179.828 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.514 ' O ' HG23 ' A' ' 137' ' ' VAL . 30.0 t80 -65.12 -62.23 1.67 Allowed 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.334 -0.394 . . . . 0.46 110.299 177.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.5 pp -66.59 -26.96 67.35 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.035 0.445 . . . . 0.64 110.341 -177.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.477 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -57.93 -48.22 80.55 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.446 -0.797 . . . . 1.61 111.046 178.708 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . 0.653 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -82.81 -24.41 33.38 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.14 -0.482 . . . . 1.52 110.948 -177.873 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 133' ' ' PHE . 59.2 t -70.97 -32.04 47.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.086 0.47 . . . . 0.35 110.362 178.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -69.53 -10.49 58.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.064 0.459 . . . . 0.5 110.471 177.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -103.34 -3.55 25.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.946 -0.57 . . . . 1.76 110.926 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . 0.492 ' HG3' ' HA ' ' A' ' 137' ' ' VAL . 0.7 OUTLIER -67.91 143.9 96.76 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.094 -0.503 . . . . 0.86 111.337 -177.883 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -70.77 110.79 2.85 Favored 'Trans proline' 0 N--CA 1.462 -0.356 0 C-N-CA 122.52 2.147 . . . . 0.67 111.675 177.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.05 5.79 7.51 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.913 -0.585 . . . . 2.91 111.917 -175.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . 0.413 ' O ' ' HB3' ' A' ' 144' ' ' GLU . 18.3 mt-10 -103.17 -41.18 6.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.436 -0.347 . . . . 2.7 111.244 -177.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.413 ' HB3' ' O ' ' A' ' 143' ' ' GLU . 2.7 tt0 70.95 101.57 0.06 Allowed 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.991 0.807 . . . . 2.34 110.866 -177.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 2.6 t -108.52 133.96 51.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.135 -0.691 . . . . 0.99 109.135 176.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.524 ' HG3' HG22 ' A' ' 36' ' ' THR . 1.2 tt0 -80.63 148.18 30.37 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.004 0.43 . . . . 1.53 111.13 -176.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 22.0 mt . . . . . 0 C--O 1.247 0.955 0 CA-C-O 118.896 -0.573 . . . . 1.57 110.142 178.134 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.448 -0.535 0 CA-C-O 121.348 0.594 . . . . 0.93 109.847 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -158.95 137.08 10.55 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.123 -0.944 . . . . 1.61 110.001 176.26 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.469 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 23.8 t-20 -136.8 122.92 13.47 Favored Pre-proline 0 C--N 1.32 -0.69 0 N-CA-C 109.357 -0.608 . . . . 1.6 109.357 173.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -60.4 -46.31 18.5 Favored 'Trans proline' 0 N--CA 1.474 0.338 0 C-N-CA 123.249 2.633 . . . . 1.87 113.008 -175.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.3 m -78.97 -30.04 44.25 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 116.037 -0.529 . . . . 2.18 110.957 -175.201 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.469 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 24.4 tttp -67.41 134.03 93.04 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.564 -0.744 . . . . 2.75 111.419 -177.378 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_exo -49.18 141.11 24.2 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 123.182 2.588 . . . . 1.38 112.993 173.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -158.91 117.07 0.75 Allowed Glycine 0 N--CA 1.443 -0.84 0 N-CA-C 110.218 -1.153 . . . . 0.97 110.218 177.282 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.434 ' HE ' ' CD ' ' A' ' 146' ' ' GLU . 7.2 mmm180 -131.55 158.82 39.94 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.013 0.435 . . . . 1.93 110.935 -175.377 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.518 ' HA ' HD22 ' A' ' 39' ' ' LEU . 1.5 mtpp -103.6 84.52 2.3 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.981 -0.554 . . . . 2.64 109.598 176.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.643 HG22 ' HG3' ' A' ' 146' ' ' GLU . 1.6 p -87.17 168.56 13.13 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.244 -0.434 . . . . 0.68 110.515 -179.285 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -59.12 -50.98 71.97 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-N 116.489 -0.323 . . . . 1.47 110.749 -178.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.512 ' HB2' ' OE2' ' A' ' 144' ' ' GLU . 1.7 mt-30 -59.21 -39.83 83.92 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.711 0.291 . . . . 1.04 111.222 -179.006 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.653 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.8 OUTLIER -61.66 -55.17 33.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.109 -0.496 . . . . 0.8 110.72 -179.638 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 18.2 mm100 -68.53 -30.47 69.29 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.872 -0.603 . . . . 1.75 110.862 -179.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -61.6 -63.36 1.3 Allowed 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.825 -0.625 . . . . 0.64 110.488 176.556 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.581 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -58.44 -33.62 69.9 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 110.175 -0.306 . . . . 1.13 110.175 -175.418 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -56.98 -56.62 19.34 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.569 -0.741 . . . . 1.3 111.121 178.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 61.3 m-80 -86.66 -28.16 23.34 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.285 -0.416 . . . . 0.5 112.039 -176.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 94.5 t -89.61 -56.89 4.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 N-CA-C 112.243 0.46 . . . . 0.3 112.243 -176.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.702 HG22 ' HB3' ' A' ' 136' ' ' LYS . 59.9 t -79.41 -65.82 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 121.012 -0.275 . . . . 0.26 111.521 -172.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.5 HG13 ' O ' ' A' ' 42' ' ' MET . 1.9 m -63.49 -33.58 62.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 N-CA-C 111.75 0.278 . . . . 0.83 111.75 -174.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.05 -39.35 86.92 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 121.102 -0.239 . . . . 2.4 111.53 -178.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 5.9 m -75.1 -33.26 61.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.728 0.299 . . . . 0.55 110.642 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.578 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -67.03 -41.06 87.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.324 0.583 . . . . 0.33 109.595 174.128 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 6.9 t-105 -63.03 -35.79 81.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.607 -0.724 . . . . 0.39 111.253 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.3 mmpt? -87.62 22.75 2.15 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.25 0.463 . . . . 2.24 112.25 -175.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.55 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 12.9 t-80 -96.24 139.99 31.59 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.42 -0.354 . . . . 0.39 110.07 175.232 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 40.6 mm-40 -81.44 7.03 12.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.777 0.323 . . . . 1.91 111.852 -176.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.55 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.7 OUTLIER -115.2 -7.29 12.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.022 0.439 . . . . 0.93 110.165 175.673 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.519 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -99.0 11.05 40.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.059 0.457 . . . . 0.28 110.939 -177.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.586 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 32.4 p-90 -63.24 -33.84 11.75 Favored Pre-proline 0 CA--C 1.547 0.855 0 N-CA-C 113.88 1.067 . . . . 0.58 113.88 -175.114 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.586 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 5.9 Cg_exo -78.97 -0.61 10.9 Favored 'Trans proline' 0 C--N 1.359 1.124 0 CA-C-N 121.2 1.464 . . . . 0.47 112.289 176.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -97.99 -2.01 41.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.121 -0.491 . . . . 1.11 110.614 -175.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.555 ' CZ ' ' HA ' ' A' ' 57' ' ' TRP . 13.1 m-30 -74.55 -11.7 60.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.02 -0.536 . . . . 0.63 110.603 179.24 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -106.96 119.71 50.42 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 115.902 -0.59 . . . . 1.63 111.23 -170.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.619 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 21.5 Cg_exo -63.44 145.45 92.36 Favored 'Trans proline' 0 C--O 1.237 0.438 0 C-N-CA 122.933 2.422 . . . . 0.87 113.103 -178.621 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 22.3 t -91.01 90.1 3.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 122.119 0.961 . . . . 0.88 108.847 177.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.4 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.6 OUTLIER -108.14 5.12 25.61 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.783 -1.099 . . . . 1.85 110.677 -176.774 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.508 ' HB2' ' NE2' ' A' ' 74' ' ' HIS . . . 79.28 -29.73 0.14 Allowed 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.003 -0.999 . . . . 1.29 112.58 177.385 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -98.76 -49.54 11.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 120.855 0.359 . . . . 1.89 111.901 -174.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.01 -22.45 49.28 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.136 -0.484 . . . . 2.99 111.632 -173.109 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.2 tp -112.87 3.59 16.44 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.864 0.364 . . . . 1.66 110.767 177.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . 0.534 ' O ' HD13 ' A' ' 70' ' ' LEU . 15.4 t-20 53.68 69.41 0.71 Allowed 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.461 -0.791 . . . . 1.74 110.88 -178.378 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.534 HD13 ' O ' ' A' ' 69' ' ' ASN . 0.0 OUTLIER -133.31 64.18 68.46 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.584 -0.735 . . . . 1.61 110.596 178.218 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -78.54 -38.8 0.47 Allowed 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.417 2.078 . . . . 1.3 112.548 -178.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -77.97 -15.95 58.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.512 0.672 . . . . 1.97 109.896 -178.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.499 ' HA ' ' CE1' ' A' ' 115' ' ' TYR . 13.2 t80 -53.43 -41.6 66.23 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.845 -1.07 . . . . 1.13 111.007 177.102 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . 0.508 ' NE2' ' HB2' ' A' ' 65' ' ' ALA . 1.8 m-70 -80.35 3.84 19.85 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.585 -0.734 . . . . 0.91 111.724 -173.053 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.9 mttp -88.14 -21.98 24.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.396 0.617 . . . . 2.86 109.589 178.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.8 mp -117.63 -46.42 3.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.143 -0.935 . . . . 1.0 110.339 -179.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.5 mm -86.84 111.56 21.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.009 -0.541 . . . . 0.75 110.476 -179.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.91 -29.5 58.43 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.072 -0.513 . . . . 1.99 110.87 -179.5 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 57.1 m-20 -119.84 81.95 27.06 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 116.031 -0.531 . . . . 2.05 109.962 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -76.06 98.85 1.23 Allowed 'Trans proline' 0 N--CA 1.464 -0.235 0 C-N-CA 123.265 2.644 . . . . 0.89 112.091 -177.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -132.81 174.97 9.75 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.51 0.671 . . . . 0.82 111.087 -176.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.619 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 3.1 p-10 -152.38 -126.99 0.04 OUTLIER 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.555 -1.202 . . . . 1.42 109.135 -173.255 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -126.24 -14.28 5.98 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.185 0.517 . . . . 0.8 110.188 -179.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.475 ' O ' ' HG3' ' A' ' 88' ' ' LYS . . . -92.7 -33.19 7.59 Favored Glycine 0 N--CA 1.438 -1.191 0 N-CA-C 110.157 -1.177 . . . . 0.32 110.157 -179.066 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.612 HG23 ' HB3' ' A' ' 62' ' ' PRO . 0.8 OUTLIER -65.56 -41.0 93.43 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.107 0.48 . . . . 0.95 110.435 176.875 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.439 HG12 ' HB3' ' A' ' 104' ' ' ASP . 79.0 mt -61.79 -47.95 90.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.365 -0.834 . . . . 0.97 109.935 175.074 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -32.28 73.39 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.692 -0.686 . . . . 1.15 111.136 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.475 ' HG3' ' O ' ' A' ' 84' ' ' GLY . 33.4 mttm -59.9 -52.9 63.43 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 120.951 0.405 . . . . 2.46 110.515 178.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -70.47 -30.42 67.23 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.633 -0.712 . . . . 1.16 111.233 -177.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.2 mt -66.14 -56.69 10.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.022 0.439 . . . . 0.49 111.119 178.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -68.42 -28.78 67.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.853 -0.612 . . . . 1.39 111.167 -177.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -80.69 -10.92 59.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.524 -0.307 . . . . 1.3 110.873 179.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 60.34 61.87 1.69 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.674 -0.694 . . . . 1.75 110.189 -178.013 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 31.9 t80 -79.75 -52.73 7.56 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.79 -0.641 . . . . 0.96 111.434 -178.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -97.03 -178.71 4.29 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.071 0.462 . . . . 1.28 110.955 -175.32 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 -72.59 -54.08 10.12 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.589 -0.732 . . . . 1.05 111.216 -179.255 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 26.4 t -145.32 -178.82 6.26 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.054 0.454 . . . . 1.0 111.495 -172.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.653 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -76.81 -7.07 54.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.997 -0.547 . . . . 0.66 111.132 -177.028 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -34.86 73.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.323 0.583 . . . . 0.85 109.82 175.183 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.09 -30.79 62.52 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.418 -0.81 . . . . 2.44 110.14 177.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.48 ' HB3' ' SD ' ' A' ' 42' ' ' MET . 0.1 OUTLIER -74.36 -28.56 61.18 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.485 -0.779 . . . . 0.95 111.242 -179.258 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.77 -36.07 73.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.148 0.499 . . . . 1.13 110.326 177.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -70.05 -40.24 75.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.572 -0.74 . . . . 2.96 110.417 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . 0.439 ' HB3' HG12 ' A' ' 86' ' ' ILE . 0.3 OUTLIER -70.06 -49.65 49.01 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.015 -0.539 . . . . 1.87 111.05 -176.55 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.578 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -55.66 -45.26 77.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.073 -0.512 . . . . 0.38 110.948 -179.496 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -60.56 -45.33 94.29 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.142 -0.481 . . . . 0.97 110.294 177.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 66.4 m -64.4 -37.15 86.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.79 -0.641 . . . . 0.43 111.462 -178.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -34.73 71.08 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.214 -0.448 . . . . 0.88 110.69 177.176 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -79.21 -36.93 39.36 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.37 -0.377 . . . . 0.29 110.515 -178.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.0 -37.23 86.96 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.764 0.316 . . . . 0.66 110.611 175.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -43.63 -55.06 4.56 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.271 -0.877 . . . . 1.84 110.925 177.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . 0.49 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 2.1 t -58.76 -47.73 83.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.196 -0.911 . . . . 0.63 111.906 -179.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 47.7 m-85 -74.85 -15.92 60.7 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.719 0.637 . . . . 0.81 112.719 -170.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 85.5 mt -91.77 -54.33 7.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.759 0.314 . . . . 0.55 111.271 -179.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . 0.499 ' CE1' ' HA ' ' A' ' 73' ' ' TYR . 41.7 t80 -78.24 -40.35 37.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.78 0.324 . . . . 1.22 111.194 -175.31 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . 0.49 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 72.6 m-20 -86.12 -168.57 2.28 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.376 -0.375 . . . . 1.04 110.481 -177.252 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.26 154.07 43.78 Favored Pre-proline 0 C--N 1.32 -0.693 0 N-CA-C 110.526 -0.176 . . . . 3.47 110.526 -177.466 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -58.61 -25.97 77.08 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.409 2.072 . . . . 0.96 112.276 177.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.79 16.37 25.28 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.124 -0.489 . . . . 1.23 111.325 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . 0.433 ' OD1' HG22 ' A' ' 122' ' ' ILE . 3.8 t70 -76.52 159.72 30.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.47 . . . . 1.34 110.976 -177.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -69.56 -47.88 62.17 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.362 -0.836 . . . . 1.44 110.02 -178.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . 0.433 HG22 ' OD1' ' A' ' 120' ' ' ASP . 2.2 tp -68.28 -30.4 47.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.384 -0.825 . . . . 0.42 110.666 -177.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 1.4 t -71.75 -41.36 70.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.225 -0.443 . . . . 0.35 110.163 177.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.07 -32.24 71.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.955 -0.566 . . . . 0.52 110.045 179.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 25.8 mtt -75.39 -39.16 59.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.539 -0.755 . . . . 0.62 110.546 177.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.35 -28.0 66.44 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.201 -0.454 . . . . 0.31 111.837 -178.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.68 -44.79 89.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.849 0.357 . . . . 1.94 111.213 179.286 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -76.72 -36.87 56.88 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.127 0.489 . . . . 0.32 110.433 179.166 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.519 HD21 ' HA ' ' A' ' 56' ' ' ALA . 1.0 OUTLIER -59.39 -43.51 92.92 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.357 -0.838 . . . . 0.33 111.047 179.909 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -65.93 -24.42 66.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.903 -0.589 . . . . 1.47 111.687 -175.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.508 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 19.1 ttmt -64.89 -41.62 95.46 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.768 -0.456 . . . . 2.24 109.768 -178.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.531 HD12 HD23 ' A' ' 50' ' ' LEU . 3.3 mt -69.39 -34.78 64.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.918 -0.583 . . . . 1.23 110.316 178.01 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.443 ' O ' HG23 ' A' ' 137' ' ' VAL . 29.9 t80 -58.35 -61.75 2.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.652 -0.703 . . . . 0.46 110.662 179.273 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 2.0 pp -63.94 -30.02 71.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.923 0.392 . . . . 0.64 110.406 -177.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.508 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.56 -50.73 72.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.549 -0.75 . . . . 1.61 111.13 178.894 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . 0.702 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -77.53 -23.29 50.18 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.77 -0.65 . . . . 1.52 111.055 -176.611 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.45 ' HA ' ' HG3' ' A' ' 140' ' ' MET . 46.4 t -78.15 -33.74 18.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.011 -0.54 . . . . 0.35 110.56 -179.476 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.03 -13.35 61.83 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.116 0.484 . . . . 0.5 110.616 179.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -106.71 4.2 27.51 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.681 -0.691 . . . . 1.76 110.869 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . 0.45 ' HG3' ' HA ' ' A' ' 137' ' ' VAL . 0.7 OUTLIER -66.36 143.03 98.09 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.296 -0.411 . . . . 0.86 110.505 176.908 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -63.82 114.13 2.45 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.27 1.98 . . . . 0.67 111.272 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 13.6 mm-40 -79.37 26.29 0.29 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.184 -0.462 . . . . 2.91 111.622 -173.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.06 -40.16 3.0 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 115.936 -0.574 . . . . 2.7 110.763 -178.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . 0.512 ' OE2' ' HB2' ' A' ' 38' ' ' GLN . 0.0 OUTLIER 63.28 93.8 0.05 Allowed 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.063 -0.972 . . . . 2.34 110.313 -174.696 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 1.5 t -112.89 116.83 53.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 115.522 -0.763 . . . . 0.99 109.961 -178.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.643 ' HG3' HG22 ' A' ' 36' ' ' THR . 7.5 tt0 -64.8 133.14 51.37 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.693 0.283 . . . . 1.53 110.392 178.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 14.9 mt . . . . . 0 C--O 1.246 0.897 0 CA-C-O 118.697 -0.668 . . . . 1.57 110.372 -177.808 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.2 p . . . . . 0 N--CA 1.451 -0.418 0 CA-C-O 122.058 0.932 . . . . 0.93 108.57 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.2 m -149.17 141.35 23.99 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 114.159 -1.382 . . . . 1.61 108.192 176.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -145.11 136.67 12.77 Favored Pre-proline 0 C--N 1.315 -0.929 0 C-N-CA 121.112 -0.235 . . . . 1.6 110.579 -177.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -65.76 -48.13 3.27 Favored 'Trans proline' 0 N--CA 1.473 0.278 0 C-N-CA 123.061 2.507 . . . . 1.87 112.955 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.467 ' O ' ' HD3' ' A' ' 32' ' ' PRO . 5.4 m -75.74 -19.31 59.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.082 -0.508 . . . . 2.18 110.872 -176.175 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.468 ' HE3' ' CZ ' ' A' ' 94' ' ' TYR . 0.0 OUTLIER -102.33 100.63 16.14 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.55 -0.75 . . . . 2.75 110.598 178.409 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.467 ' HD3' ' O ' ' A' ' 30' ' ' SER . 15.2 Cg_exo -66.63 152.57 80.41 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.096 1.864 . . . . 1.38 111.564 178.675 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -136.02 88.78 0.23 Allowed Glycine 0 N--CA 1.444 -0.778 0 N-CA-C 111.662 -0.575 . . . . 0.97 111.662 -177.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.463 ' HG3' ' CZ2' ' A' ' 96' ' ' TRP . 7.3 mtm180 -91.87 148.81 21.94 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.723 -0.473 . . . . 1.93 109.723 178.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.0 120.62 32.14 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.395 -0.366 . . . . 2.64 110.103 -178.157 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.626 HG22 ' HG3' ' A' ' 146' ' ' GLU . 1.0 OUTLIER -111.36 160.58 16.92 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.827 -0.349 . . . . 0.68 110.722 177.89 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.489 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 8.1 t30 -60.69 -37.84 82.99 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-N 115.879 -0.6 . . . . 1.47 110.113 178.292 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.417 ' O ' ' HB3' ' A' ' 41' ' ' TYR . 23.4 tt0 -64.18 -42.37 96.71 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.303 -0.408 . . . . 1.04 110.433 178.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.785 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.4 OUTLIER -63.32 -52.01 63.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.216 -0.447 . . . . 0.8 110.549 179.027 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.422 ' O ' ' HG3' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -67.5 -22.98 65.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.288 0.566 . . . . 1.75 110.789 -179.541 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.489 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 62.3 t80 -64.45 -59.73 3.99 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 115.523 -0.762 . . . . 0.64 110.769 176.624 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.556 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -58.99 -34.39 71.79 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.573 -0.285 . . . . 1.13 111.749 -172.587 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.562 ' HA ' ' CG1' ' A' ' 47' ' ' VAL . 0.0 OUTLIER -65.68 -45.21 83.72 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.426 -0.509 . . . . 1.3 110.851 -177.521 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 -85.68 -34.24 21.34 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.085 -0.507 . . . . 0.5 111.795 -177.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 85.6 t -88.73 -57.81 3.96 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 112.332 0.493 . . . . 0.3 112.332 -175.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.664 HG22 ' HB3' ' A' ' 136' ' ' LYS . 42.4 t -79.63 -66.63 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 111.855 0.317 . . . . 0.26 111.855 -170.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.562 ' CG1' ' HA ' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -68.94 -35.97 71.75 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.314 0 C-N-CA 120.677 -0.409 . . . . 0.83 111.624 -173.728 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.46 -38.64 87.95 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.678 -0.409 . . . . 2.4 111.376 179.066 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.2 m -73.64 -36.37 65.39 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 121.083 -0.247 . . . . 0.55 110.824 178.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.626 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -66.24 -39.63 89.65 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 109.588 -0.523 . . . . 0.33 109.588 174.991 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 11.6 t-105 -58.04 -36.38 72.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.641 -0.709 . . . . 0.39 110.98 177.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -84.78 10.59 11.04 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.198 0.444 . . . . 2.24 112.198 -175.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 19.1 t-80 -83.12 139.06 33.42 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.842 0.353 . . . . 0.39 110.465 177.15 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.9 mm-40 -72.26 1.79 7.11 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.005 -0.543 . . . . 1.91 112.308 -175.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -118.83 -7.84 10.4 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.771 0.32 . . . . 0.93 110.918 178.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.662 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -92.6 6.43 47.34 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.955 0.407 . . . . 0.28 111.217 -176.089 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.55 ' HA ' ' CZ ' ' A' ' 60' ' ' TYR . 40.4 p-90 -62.97 -35.14 16.38 Favored Pre-proline 0 CA--C 1.548 0.867 0 N-CA-C 114.099 1.148 . . . . 0.58 114.099 -174.397 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.51 ' HD3' ' CG ' ' A' ' 57' ' ' TRP . 15.3 Cg_exo -71.19 -17.9 30.93 Favored 'Trans proline' 0 C--N 1.357 0.987 0 CA-C-N 121.095 1.427 . . . . 0.47 112.435 177.478 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -85.36 -4.53 59.19 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.196 -0.456 . . . . 1.11 111.257 -175.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.55 ' CZ ' ' HA ' ' A' ' 57' ' ' TRP . 17.6 m-30 -60.54 -38.08 83.29 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.304 0.573 . . . . 0.63 110.883 -178.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -97.45 132.8 24.63 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-N 115.41 -0.814 . . . . 1.63 110.615 -177.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.73 145.09 25.42 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.334 2.023 . . . . 0.87 112.083 178.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.454 HG11 ' CD1' ' A' ' 73' ' ' TYR . 4.4 t -69.59 110.11 2.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-O 121.727 0.775 . . . . 0.88 110.794 177.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.406 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.5 OUTLIER -110.23 -0.74 17.67 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.897 -1.047 . . . . 1.85 109.559 179.474 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 74.69 -64.19 0.39 Allowed 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 114.627 -1.169 . . . . 1.29 111.055 -175.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 12.9 mt -68.56 -48.84 70.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.788 0.328 . . . . 1.89 111.115 -176.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 38.2 tttp -50.46 -51.92 42.67 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.73 -0.668 . . . . 2.99 112.331 -177.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.629 ' HB3' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -105.1 7.24 33.76 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.496 -0.32 . . . . 1.66 111.573 -171.958 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . 0.433 ' O ' HD13 ' A' ' 70' ' ' LEU . 17.7 t-20 59.11 67.28 0.93 Allowed 'General case' 0 N--CA 1.467 0.418 0 O-C-N 123.731 0.644 . . . . 1.74 111.207 -178.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.629 HD22 ' HB3' ' A' ' 68' ' ' LEU . 0.1 OUTLIER -128.06 66.94 73.44 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.349 -0.841 . . . . 1.61 110.798 -179.699 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.96 -34.93 21.97 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 121.909 1.739 . . . . 1.3 111.972 -179.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -72.0 -30.8 65.6 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.98 -0.554 . . . . 1.97 110.678 -178.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.454 ' CD1' HG11 ' A' ' 63' ' ' VAL . 2.8 t80 -59.67 -45.9 90.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.65 -0.705 . . . . 1.13 110.577 -178.478 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -75.73 -7.8 55.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.128 -0.487 . . . . 0.91 110.977 -177.144 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt -95.72 -44.6 7.37 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 116.082 -0.508 . . . . 2.86 110.004 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.6 mt -82.78 -50.31 15.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.859 -0.609 . . . . 1.0 111.026 -178.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 43.7 mm -83.1 138.08 19.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.438 -0.346 . . . . 0.75 110.339 -177.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.62 -47.43 12.09 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.205 -0.452 . . . . 1.99 110.936 -179.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -115.22 96.43 45.44 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 116.476 -0.329 . . . . 2.05 110.822 -179.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -73.38 99.01 1.07 Allowed 'Trans proline' 0 CA--C 1.529 0.271 0 C-N-CA 122.381 2.054 . . . . 0.89 112.516 178.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.24 145.76 47.94 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 116.056 -0.52 . . . . 0.82 110.085 -178.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.454 ' O ' HD13 ' A' ' 86' ' ' ILE . 5.4 m-20 -145.35 -153.93 0.51 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 114.862 -1.063 . . . . 1.42 108.297 -172.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.53 -18.72 21.94 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.065 -0.717 . . . . 0.8 109.065 -172.55 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -80.37 -25.07 57.86 Favored Glycine 0 N--CA 1.44 -1.084 0 N-CA-C 109.539 -1.424 . . . . 0.32 109.539 175.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -84.47 -41.28 16.75 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 114.705 -0.747 . . . . 0.95 111.486 178.385 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.486 ' CD1' ' HB3' ' A' ' 104' ' ' ASP . 0.2 OUTLIER -56.41 -47.42 81.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 121.163 0.506 . . . . 0.97 109.727 178.398 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.6 ptmt -66.15 -27.54 68.1 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.765 -0.652 . . . . 1.15 111.506 -179.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.9 tttt -67.92 -43.02 80.15 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.935 0.398 . . . . 2.46 110.795 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.543 ' HD3' ' OD2' ' A' ' 104' ' ' ASP . 1.6 mtt180 -69.84 -32.0 70.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.309 -0.405 . . . . 1.16 110.558 178.578 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.418 ' HG ' ' SG ' ' A' ' 101' ' ' CYS . 7.7 mt -67.71 -54.41 19.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.656 -0.702 . . . . 0.49 111.22 178.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 25.0 pt-20 -64.92 -26.74 68.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.119 -0.491 . . . . 1.39 111.313 -175.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -95.29 10.67 35.31 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.081 -0.509 . . . . 1.3 111.276 -178.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.3 p30 37.25 54.9 1.33 Allowed 'General case' 0 N--CA 1.475 0.825 0 O-C-N 124.169 0.918 . . . . 1.75 111.711 -177.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . 0.468 ' CZ ' ' HE3' ' A' ' 31' ' ' LYS . 29.8 t80 -66.06 -73.5 0.13 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.057 -0.974 . . . . 0.96 112.06 -175.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -94.87 39.44 1.1 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.518 -0.765 . . . . 1.28 112.582 -172.651 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . 0.463 ' CZ3' ' HB2' ' A' ' 32' ' ' PRO . 1.2 t-105 71.25 -66.07 0.31 Allowed 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.24 0.83 . . . . 1.05 113.24 169.012 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -125.15 161.26 27.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.114 0.483 . . . . 1.0 111.912 -168.143 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.785 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -73.4 -12.71 60.91 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.973 -0.558 . . . . 0.66 111.071 -179.665 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 20.0 m -64.05 -26.32 68.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.293 0.568 . . . . 0.85 109.791 175.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -82.47 -26.68 32.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.522 -0.763 . . . . 2.44 110.35 176.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.418 ' SG ' ' HG ' ' A' ' 90' ' ' LEU . 0.5 OUTLIER -74.64 -23.08 58.63 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.539 -0.755 . . . . 0.95 110.62 179.475 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 6.5 ttm -60.94 -31.65 71.19 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.053 -0.521 . . . . 1.13 110.134 176.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.4 -38.16 68.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.696 -0.683 . . . . 2.96 110.252 178.18 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . 0.543 ' OD2' ' HD3' ' A' ' 89' ' ' ARG . 1.5 m-20 -67.3 -50.41 60.37 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.994 -0.548 . . . . 1.87 110.502 -178.405 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.626 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -55.75 -43.92 77.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.692 -0.685 . . . . 0.38 110.272 177.479 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -60.41 -49.87 75.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.615 -0.72 . . . . 0.97 110.361 178.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 71.3 m -55.37 -51.14 67.76 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 123.584 0.552 . . . . 0.43 111.259 179.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 2.3 ttp -53.42 -40.88 65.5 Favored 'General case' 0 C--O 1.233 0.216 0 O-C-N 123.326 0.391 . . . . 0.88 111.151 178.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -67.8 -43.58 79.33 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.485 -0.325 . . . . 0.29 110.971 -178.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.37 -43.71 98.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.738 0.304 . . . . 0.66 110.888 177.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . 0.416 ' HB3' ' OH ' ' A' ' 73' ' ' TYR . 7.1 m-20 -47.24 -48.86 24.28 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.455 -0.793 . . . . 1.84 111.335 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 14.0 t -57.24 -42.46 81.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.724 -0.671 . . . . 0.63 111.518 179.124 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -80.44 -21.06 42.52 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.857 0.36 . . . . 0.81 111.833 -173.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 55.5 mt -87.01 -50.86 13.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.935 0.398 . . . . 0.55 110.75 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -73.43 -42.83 61.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.054 -0.521 . . . . 1.22 110.739 -177.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . 0.414 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 67.0 m-80 -100.01 161.5 13.57 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.233 -0.439 . . . . 1.04 110.728 -174.541 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.1 mmtt -82.83 147.95 56.22 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.95 -0.568 . . . . 3.47 109.844 178.007 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . 0.919 ' HA ' HG11 ' A' ' 123' ' ' VAL . 24.2 Cg_endo -62.26 -12.98 29.63 Favored 'Trans proline' 0 N--CA 1.473 0.271 0 C-N-CA 122.786 2.324 . . . . 0.96 112.386 178.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.41 9.35 39.77 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.82 -0.627 . . . . 1.23 111.338 179.686 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -85.92 164.0 17.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.081 0.467 . . . . 1.34 111.062 -177.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.76 -45.41 94.01 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.234 -0.894 . . . . 1.44 110.943 -177.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -69.33 -34.85 64.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.176 -0.92 . . . . 0.42 111.487 -174.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.919 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.3 t -71.32 -35.04 56.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.881 0.372 . . . . 0.35 110.088 179.507 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.87 -32.06 65.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.5 0.667 . . . . 0.52 109.646 177.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . 0.487 ' O ' HD13 ' A' ' 129' ' ' LEU . 8.7 mtt -80.13 -43.95 20.78 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 114.992 -1.004 . . . . 0.62 110.787 179.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.86 -35.16 63.72 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.246 -0.434 . . . . 0.31 111.885 -177.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.63 -41.98 98.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.403 -0.362 . . . . 1.94 111.386 -179.542 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -78.06 -36.56 48.2 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.174 0.512 . . . . 0.32 110.466 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.662 HD21 ' HA ' ' A' ' 56' ' ' ALA . 4.0 mp -60.8 -42.06 96.86 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.445 -0.798 . . . . 0.33 111.042 -179.333 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -61.13 -28.63 69.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.883 -0.599 . . . . 1.47 111.967 -175.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.491 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 7.0 mttm -64.53 -34.35 78.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.839 0.352 . . . . 2.24 110.441 -177.119 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 13.9 mt -75.54 -31.0 22.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.036 -0.529 . . . . 1.23 110.67 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.505 ' O ' HG23 ' A' ' 137' ' ' VAL . 29.4 t80 -58.66 -62.33 1.95 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.009 -0.541 . . . . 0.46 110.691 -179.426 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.28 -28.24 69.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.104 0.478 . . . . 0.64 110.488 -179.364 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.491 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.36 -39.8 88.48 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.469 -0.787 . . . . 1.61 111.481 179.231 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . 0.664 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -90.76 -26.56 19.43 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.895 0.378 . . . . 1.52 110.745 -178.677 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 133' ' ' PHE . 55.8 t -67.8 -32.03 54.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.1 -0.5 . . . . 0.35 110.23 177.403 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -64.96 -18.69 65.48 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.029 -0.532 . . . . 0.5 110.849 179.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.3 mm100 -103.58 -0.28 29.91 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.599 -0.728 . . . . 1.76 110.958 -178.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . 0.472 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 0.4 OUTLIER -66.43 142.32 97.65 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.155 -0.475 . . . . 0.86 111.371 -179.432 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -74.77 101.7 1.49 Allowed 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.472 2.114 . . . . 0.67 111.895 179.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 76.5 mm-40 -70.05 -2.24 12.21 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 112.192 0.441 . . . . 2.91 112.192 -175.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -81.83 -38.42 25.52 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.881 0.372 . . . . 2.7 110.384 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 67.09 86.33 0.13 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.842 -1.072 . . . . 2.34 110.347 -178.685 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 1.2 t -96.25 120.19 45.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.564 -0.744 . . . . 0.99 109.618 178.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.626 ' HG3' HG22 ' A' ' 36' ' ' THR . 0.4 OUTLIER -73.15 146.02 45.95 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.752 0.311 . . . . 1.53 110.625 179.972 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 69.1 mt . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.555 -0.736 . . . . 1.57 110.371 -177.432 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.536 HG21 ' HG2' ' A' ' 88' ' ' LYS . 2.3 p . . . . . 0 N--CA 1.455 -0.202 0 CA-C-O 121.449 0.642 . . . . 0.93 110.059 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -148.92 132.68 16.95 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.645 -0.707 . . . . 1.61 110.027 177.21 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -140.77 131.01 13.39 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 116.366 -0.379 . . . . 1.6 110.319 178.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -67.35 -47.33 2.26 Favored 'Trans proline' 0 CA--C 1.53 0.316 0 C-N-CA 123.093 2.529 . . . . 1.87 113.093 -179.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 3.1 m -80.54 -22.48 40.79 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.083 -0.508 . . . . 2.18 111.331 -174.062 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.461 ' HA ' ' HD3' ' A' ' 32' ' ' PRO . 17.5 tttm -77.85 127.27 82.48 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 115.932 -0.577 . . . . 2.75 110.941 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 31' ' ' LYS . 3.8 Cg_exo -72.36 151.42 53.98 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.386 2.058 . . . . 1.38 111.952 177.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -151.84 113.36 0.58 Allowed Glycine 0 N--CA 1.443 -0.856 0 N-CA-C 110.681 -0.967 . . . . 0.97 110.681 179.674 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.6 mtm180 -124.7 159.74 30.16 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 110.099 -0.334 . . . . 1.93 110.099 -175.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.506 ' HA ' HD22 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -99.2 84.2 2.99 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.118 0.485 . . . . 2.64 110.99 179.284 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.489 ' HA ' ' HA ' ' A' ' 146' ' ' GLU . 5.4 p -94.46 176.6 6.23 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 120.927 0.394 . . . . 0.68 111.401 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.575 ' HA ' HD11 ' A' ' 147' ' ' LEU . 37.9 t30 -63.31 -54.92 29.55 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.613 -0.721 . . . . 1.47 110.679 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -56.74 -39.85 74.7 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.771 0.319 . . . . 1.04 111.105 -178.035 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.506 HD22 ' HA ' ' A' ' 35' ' ' LYS . 0.9 OUTLIER -60.53 -58.99 6.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.057 -0.52 . . . . 0.8 111.282 -179.767 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.4 mt-30 -69.54 -26.02 64.3 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.962 -0.563 . . . . 1.75 110.721 -177.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.406 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 47.8 t80 -60.85 -62.95 1.48 Allowed 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.739 -0.664 . . . . 0.64 110.669 177.164 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.554 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -61.06 -30.41 70.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.726 0.298 . . . . 1.13 110.529 -173.912 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.472 ' HB2' HD22 ' A' ' 90' ' ' LEU . 7.7 tt0 -59.14 -56.24 24.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.866 -0.606 . . . . 1.3 110.836 178.351 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 -86.4 -30.42 22.14 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.99 0.424 . . . . 0.5 111.927 -176.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 91.7 t -88.48 -57.6 4.12 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 N-CA-C 112.423 0.527 . . . . 0.3 112.423 -174.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.569 HG22 ' HB3' ' A' ' 136' ' ' LYS . 50.1 t -80.46 -66.51 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 C-N-CA 120.716 -0.394 . . . . 0.26 111.712 -170.015 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.472 HG12 ' O ' ' A' ' 42' ' ' MET . 1.5 p -70.67 -34.11 55.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 C-N-CA 120.581 -0.448 . . . . 0.83 111.437 -173.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.4 ' O ' ' HE3' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -65.02 -34.79 79.27 Favored 'General case' 0 C--N 1.329 -0.29 0 O-C-N 122.195 -0.316 . . . . 2.4 111.578 179.345 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.0 m -77.5 -39.1 47.46 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.909 -0.316 . . . . 0.55 110.54 177.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.591 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -60.53 -38.05 83.19 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.246 0.546 . . . . 0.33 109.875 175.663 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 17.6 t-105 -60.76 -28.73 68.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.461 -0.79 . . . . 0.39 111.499 178.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.4 ' HE3' ' O ' ' A' ' 48' ' ' LYS . 4.7 mtmt -92.72 18.79 8.28 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.014 0.375 . . . . 2.24 112.014 -174.177 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.425 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 23.3 t-80 -89.48 139.12 30.85 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.963 -0.384 . . . . 0.39 109.963 175.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -70.76 -8.88 55.52 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.323 -0.399 . . . . 1.91 112.023 -175.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.425 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 1.8 m-30 -107.53 -1.49 21.27 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.96 0.409 . . . . 0.93 110.47 177.762 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.586 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -92.25 2.29 56.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.271 0.558 . . . . 0.28 110.972 -177.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.461 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 54.0 p-90 -63.87 -33.22 9.23 Favored Pre-proline 0 CA--C 1.547 0.855 0 N-CA-C 114.489 1.292 . . . . 0.58 114.489 -173.683 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.461 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 6.6 Cg_exo -74.59 -5.1 16.42 Favored 'Trans proline' 0 C--N 1.36 1.179 0 CA-C-N 121.296 1.499 . . . . 0.47 112.49 178.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -100.9 3.13 41.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.875 0.369 . . . . 1.11 110.269 -177.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.416 ' CZ ' ' HA ' ' A' ' 57' ' ' TRP . 16.0 m-30 -71.83 -26.15 62.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.048 -0.524 . . . . 0.63 111.159 -178.484 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.408 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -110.52 123.91 34.52 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.098 -0.501 . . . . 1.63 110.896 -174.617 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.535 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 39.1 Cg_exo -60.41 159.62 26.66 Favored 'Trans proline' 0 C--O 1.237 0.45 0 C-N-CA 122.968 2.445 . . . . 0.87 113.166 179.395 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.514 HG11 ' CD2' ' A' ' 73' ' ' TYR . 2.7 t -100.77 105.14 17.23 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 CA-C-O 121.705 0.764 . . . . 0.88 109.103 -178.575 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -114.12 2.9 15.05 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.919 -1.037 . . . . 1.85 110.885 -176.211 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 73.02 -9.03 1.18 Allowed 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 115.195 -0.911 . . . . 1.29 112.812 175.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 21.5 mm -113.96 -55.39 4.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.019 0.438 . . . . 1.89 110.666 -175.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.68 -40.3 88.51 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.756 -0.656 . . . . 2.99 110.611 -177.548 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.61 -5.08 57.49 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.91 -0.586 . . . . 1.66 110.564 178.221 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 58.9 t30 53.21 68.11 0.89 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.774 -0.648 . . . . 1.74 110.507 -174.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -130.04 65.59 75.75 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 115.603 -0.726 . . . . 1.61 110.667 -177.067 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -70.5 -30.36 18.95 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.166 1.91 . . . . 1.3 112.414 -177.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.23 -9.14 59.6 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.043 -0.526 . . . . 1.97 110.951 -177.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.514 ' CD2' HG11 ' A' ' 63' ' ' VAL . 11.9 t80 -63.55 -42.27 98.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.144 -0.48 . . . . 1.13 110.468 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -71.39 -7.82 49.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.0 -0.545 . . . . 0.91 111.637 -176.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 52.9 mmtt -92.5 -28.88 16.52 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.107 0.48 . . . . 2.86 110.095 -177.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.6 mt -101.72 -42.37 9.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.416 0.627 . . . . 1.0 110.184 178.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 47.8 mm -105.17 117.49 50.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 115.76 -0.655 . . . . 0.75 110.014 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.66 -15.68 34.31 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.289 -0.414 . . . . 1.99 110.697 -176.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -120.36 84.45 35.14 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.921 -0.582 . . . . 2.05 109.896 177.333 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -70.7 91.24 0.61 Allowed 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.604 2.203 . . . . 0.89 112.318 -176.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 1.6 mmt -129.39 162.51 27.87 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.03 -0.532 . . . . 0.82 110.436 -178.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.535 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 8.4 p-10 -146.92 -126.01 0.06 Allowed 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 114.79 -1.096 . . . . 1.42 109.082 -173.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -120.0 -22.01 6.87 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.139 0.495 . . . . 0.8 110.15 -178.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -84.64 -24.89 44.37 Favored Glycine 0 N--CA 1.442 -0.931 0 N-CA-C 110.759 -0.937 . . . . 0.32 110.759 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.68 -38.56 64.86 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 121.104 0.478 . . . . 0.95 110.252 177.371 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.581 HG23 ' SG ' ' A' ' 101' ' ' CYS . 75.9 mt -60.17 -49.27 84.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.404 -0.816 . . . . 0.97 110.046 175.255 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.89 -27.45 66.67 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.562 -0.745 . . . . 1.15 111.303 -178.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.536 ' HG2' HG21 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -62.48 -44.63 95.93 Favored 'General case' 0 N--CA 1.456 -0.128 0 CA-C-O 120.521 0.2 . . . . 2.46 111.301 -178.837 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 24.0 mtp180 -75.97 -29.03 58.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.638 0.256 . . . . 1.16 110.698 -179.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.584 ' HG ' ' OH ' ' A' ' 95' ' ' TYR . 3.9 mt -63.67 -55.52 22.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.945 -0.57 . . . . 0.49 110.91 178.429 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -72.05 -22.53 61.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.229 -0.441 . . . . 1.39 111.249 -176.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.408 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 4.9 m-80 -83.72 -9.04 59.11 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.491 -0.322 . . . . 1.3 110.558 178.183 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 56.71 53.8 7.96 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.604 0.716 . . . . 1.75 110.142 -178.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -81.35 -16.27 52.83 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.329 -0.85 . . . . 0.96 111.411 -175.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.584 ' OH ' ' HG ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -129.18 174.22 9.77 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.042 0.449 . . . . 1.28 110.936 -179.455 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 -73.64 -50.47 20.87 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.178 -0.919 . . . . 1.05 110.671 -178.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 29.1 t -143.55 176.74 8.97 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.033 -0.531 . . . . 1.0 110.228 -175.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.466 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -75.82 -7.35 54.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.475 -0.33 . . . . 0.66 111.741 -173.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.74 -32.23 71.52 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.937 0.398 . . . . 0.85 110.795 -179.515 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -73.26 -32.03 64.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.844 -0.617 . . . . 2.44 110.522 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.625 ' HA ' ' OD2' ' A' ' 104' ' ' ASP . 0.5 OUTLIER -75.44 -20.65 58.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.737 -0.665 . . . . 0.95 111.539 -175.94 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.38 -27.39 62.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.006 0.432 . . . . 1.13 110.182 176.555 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -71.9 -40.52 68.8 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.851 -0.613 . . . . 2.96 110.511 177.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . 0.625 ' OD2' ' HA ' ' A' ' 101' ' ' CYS . 5.3 m-20 -66.47 -48.21 70.62 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.977 -0.556 . . . . 1.87 110.404 -179.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.591 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.4 OUTLIER -56.82 -42.88 80.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.873 -0.603 . . . . 0.38 110.558 179.617 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -58.69 -50.47 73.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.169 -0.468 . . . . 0.97 110.054 175.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 30.9 m -57.88 -49.09 77.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.128 -0.487 . . . . 0.43 111.315 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.31 -38.05 57.43 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.878 0.471 . . . . 0.88 111.927 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -77.87 -49.12 14.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.972 0.415 . . . . 0.29 110.167 -175.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.81 -36.39 80.98 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.937 -0.574 . . . . 0.66 111.61 178.044 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -49.31 -52.83 25.28 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.013 0.435 . . . . 1.84 111.201 178.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . 0.43 ' SG ' ' HA ' ' A' ' 123' ' ' VAL . 1.0 OUTLIER -63.95 -41.71 97.52 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.536 -0.756 . . . . 0.63 110.998 -178.753 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -63.28 -37.92 89.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.399 -0.364 . . . . 0.81 111.411 -177.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 55.8 mt -80.04 -48.96 19.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.451 -0.341 . . . . 0.55 111.887 -176.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 92.2 t80 -69.8 -26.63 64.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.75 0.31 . . . . 1.22 111.55 -174.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -111.46 175.8 5.28 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.15 0.5 . . . . 1.04 111.375 -173.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -97.06 152.04 38.08 Favored Pre-proline 0 C--N 1.322 -0.625 0 CA-C-N 115.543 -0.753 . . . . 3.47 110.298 -177.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . 0.464 ' HA ' HG11 ' A' ' 123' ' ' VAL . 18.5 Cg_endo -60.18 -21.69 67.17 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.798 2.332 . . . . 0.96 112.697 179.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.52 18.39 16.76 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.131 -0.486 . . . . 1.23 111.347 -179.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -96.7 155.71 16.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.236 -0.438 . . . . 1.34 110.361 178.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -71.7 -41.05 69.07 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.792 -0.64 . . . . 1.44 110.703 -175.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.2 tp -62.65 -34.02 62.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.99 -0.55 . . . . 0.42 110.853 -178.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.464 HG11 ' HA ' ' A' ' 118' ' ' PRO . 0.9 OUTLIER -68.99 -41.71 81.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.113 0.483 . . . . 0.35 109.861 177.102 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.37 -34.83 79.07 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.646 -0.707 . . . . 0.52 109.819 -179.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . 0.562 ' O ' HD13 ' A' ' 129' ' ' LEU . 14.5 mtt -69.0 -47.09 66.37 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.257 -0.883 . . . . 0.62 110.677 179.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.59 -39.43 67.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.239 -0.437 . . . . 0.31 111.394 -179.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.76 -36.74 83.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.14 -0.482 . . . . 1.94 111.386 -178.42 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -74.95 -37.15 62.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.198 0.523 . . . . 0.32 110.319 178.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.586 HD21 ' HA ' ' A' ' 56' ' ' ALA . 7.6 mp -61.05 -39.85 91.4 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.264 -0.88 . . . . 0.33 110.323 178.085 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -55.0 -32.75 62.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.574 -0.739 . . . . 1.47 112.071 -176.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.616 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -62.59 -38.8 91.55 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 120.692 0.282 . . . . 2.24 110.676 -175.389 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 25.0 mt -72.2 -34.19 48.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.17 -0.468 . . . . 1.23 110.5 179.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.556 ' O ' HG23 ' A' ' 137' ' ' VAL . 30.7 t80 -60.52 -62.72 1.66 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.947 -0.57 . . . . 0.46 110.845 -178.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.428 ' HG ' ' H ' ' A' ' 134' ' ' LEU . 0.3 OUTLIER -64.8 -28.41 69.55 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 120.917 0.389 . . . . 0.64 110.612 -177.022 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.616 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -58.9 -57.53 12.64 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.611 -0.722 . . . . 1.61 110.777 176.626 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . 0.569 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -71.15 -26.48 63.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.786 -0.643 . . . . 1.52 111.081 -176.552 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' ' 133' ' ' PHE . 75.8 t -68.93 -31.87 52.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.936 0.398 . . . . 0.35 110.245 177.003 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -70.52 -12.5 61.61 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.111 0.482 . . . . 0.5 110.718 177.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -104.26 -1.36 27.17 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.877 -0.601 . . . . 1.76 110.333 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . 0.475 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 0.5 OUTLIER -68.29 144.94 97.15 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 115.907 -0.588 . . . . 0.86 111.193 -178.193 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . 0.419 ' C ' ' H ' ' A' ' 143' ' ' GLU . 58.5 Cg_endo -73.95 91.14 0.93 Allowed 'Trans proline' 0 N--CA 1.459 -0.508 0 C-N-CA 122.4 2.067 . . . . 0.67 111.436 177.002 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -78.98 26.4 0.25 Allowed 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.633 0.73 . . . . 2.91 111.875 -176.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . 0.419 ' H ' ' C ' ' A' ' 141' ' ' PRO . 4.5 mp0 -114.13 -43.13 3.26 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-N 115.14 -0.937 . . . . 2.7 108.49 174.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 72.35 137.99 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 114.667 -1.151 . . . . 2.34 112.37 171.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -155.58 150.63 10.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 114.845 -1.07 . . . . 0.99 108.5 177.683 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.489 ' HA ' ' HA ' ' A' ' 36' ' ' THR . 0.9 OUTLIER -81.74 148.31 29.0 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 119.793 -0.763 . . . . 1.53 109.602 174.387 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.575 HD11 ' HA ' ' A' ' 37' ' ' ASN . 14.1 mt . . . . . 0 C--O 1.247 0.923 0 CA-C-O 118.581 -0.723 . . . . 1.57 110.906 -178.188 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.523 HG21 ' HG3' ' A' ' 88' ' ' LYS . 8.1 p . . . . . 0 N--CA 1.455 -0.222 0 CA-C-O 121.719 0.771 . . . . 0.93 109.596 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.491 ' HB3' ' ND2' ' A' ' 92' ' ' ASN . 66.9 p -163.7 141.8 7.57 Favored 'General case' 0 N--CA 1.439 -0.993 0 CA-C-N 114.893 -1.049 . . . . 1.61 109.21 179.179 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.459 ' HB3' ' CB ' ' A' ' 31' ' ' LYS . 39.1 t-20 -148.05 124.77 5.49 Favored Pre-proline 0 C--N 1.316 -0.86 0 CA-C-N 116.261 -0.427 . . . . 1.6 110.099 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.19 -40.13 9.19 Favored 'Trans proline' 0 N--CA 1.472 0.244 0 C-N-CA 123.093 2.529 . . . . 1.87 112.685 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.6 m -77.46 -22.68 51.0 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 116.054 -0.521 . . . . 2.18 110.363 -177.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.459 ' CB ' ' HB3' ' A' ' 28' ' ' ASN . 5.3 tttp -83.52 131.4 52.68 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.512 -0.767 . . . . 2.75 110.232 177.115 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.436 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 40.9 Cg_endo -68.3 140.5 48.87 Favored 'Trans proline' 0 N--CA 1.463 -0.3 0 C-N-CA 122.758 2.306 . . . . 1.38 112.702 177.77 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -142.45 121.58 1.8 Allowed Glycine 0 N--CA 1.446 -0.635 0 N-CA-C 110.491 -1.043 . . . . 0.97 110.491 177.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.444 ' HE ' ' CD ' ' A' ' 146' ' ' GLU . 0.3 OUTLIER -129.38 173.03 10.91 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 117.052 0.426 . . . . 1.93 110.877 -174.452 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -110.33 100.97 9.74 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.778 -0.646 . . . . 2.64 110.778 177.472 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.404 ' HA ' ' HA ' ' A' ' 146' ' ' GLU . 4.7 p -108.66 164.25 12.54 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.781 -0.368 . . . . 0.68 110.58 175.682 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.465 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 0.1 OUTLIER -65.72 -35.87 81.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.931 -0.577 . . . . 1.47 110.647 -179.666 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -67.43 -36.27 80.88 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 120.748 0.308 . . . . 1.04 110.505 178.162 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.43 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.6 OUTLIER -63.1 -53.7 49.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.991 -0.55 . . . . 0.8 110.648 178.971 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -68.51 -30.36 69.16 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.985 -0.552 . . . . 1.75 110.617 -179.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.465 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 43.3 t80 -57.9 -63.2 1.33 Allowed 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 115.846 -0.616 . . . . 0.64 110.781 176.417 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.468 ' HG2' HG21 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -60.23 -31.87 70.59 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.749 0.309 . . . . 1.13 110.915 -172.945 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.428 ' HA ' ' CG1' ' A' ' 47' ' ' VAL . 11.1 tt0 -67.41 -48.2 68.01 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.88 -0.6 . . . . 1.3 110.978 -178.449 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 66.9 m-80 -85.81 -32.41 21.79 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 112.369 0.507 . . . . 0.5 112.369 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 72.6 t -88.23 -57.4 4.28 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 N-CA-C 112.214 0.45 . . . . 0.3 112.214 -174.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.468 HG21 ' HG2' ' A' ' 42' ' ' MET . 78.6 t -82.6 -66.22 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 C-N-CA 120.695 -0.402 . . . . 0.26 111.864 -170.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.459 HG12 ' O ' ' A' ' 42' ' ' MET . 1.4 p -64.54 -36.79 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 C-N-CA 120.431 -0.508 . . . . 0.83 111.669 -174.026 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.38 -36.97 79.3 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.848 0.356 . . . . 2.4 111.037 177.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 56.3 m -77.88 -34.31 51.66 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.59 -0.277 . . . . 0.55 110.948 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.718 HD23 HD11 ' A' ' 132' ' ' ILE . 0.0 OUTLIER -65.47 -42.63 92.05 Favored 'General case' 0 C--N 1.332 -0.196 0 N-CA-C 109.654 -0.499 . . . . 0.33 109.654 175.275 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 21.2 t-105 -61.9 -38.54 88.74 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.743 -0.662 . . . . 0.39 111.006 178.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -84.42 15.37 3.71 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.018 0.377 . . . . 2.24 112.018 -175.31 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -87.3 134.47 33.55 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.557 -0.535 . . . . 0.39 109.557 175.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -74.9 -4.54 38.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.896 0.379 . . . . 1.91 111.782 -175.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.466 ' CD2' ' HG2' ' A' ' 125' ' ' MET . 3.0 m-30 -105.38 1.64 28.03 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.118 0.485 . . . . 0.93 110.202 177.065 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.727 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -101.24 12.78 36.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.173 -0.467 . . . . 0.28 111.05 -178.612 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.489 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 55.6 p-90 -65.62 -34.62 9.61 Favored Pre-proline 0 CA--C 1.546 0.822 0 N-CA-C 113.507 0.929 . . . . 0.58 113.507 -175.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.489 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 4.7 Cg_exo -75.01 -1.84 11.76 Favored 'Trans proline' 0 C--N 1.364 1.357 0 CA-C-N 120.924 1.366 . . . . 0.47 112.136 178.617 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -106.9 10.59 30.53 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.019 -0.537 . . . . 1.11 110.405 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 11.7 m-30 -79.57 -13.25 59.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.894 -0.593 . . . . 0.63 111.317 -178.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -113.55 136.55 21.97 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 116.267 -0.424 . . . . 1.63 110.712 -174.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.586 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 37.1 Cg_endo -67.1 140.81 55.31 Favored 'Trans proline' 0 C--O 1.239 0.532 0 C-N-CA 122.765 2.31 . . . . 0.87 112.592 -179.474 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.414 HG11 ' CD2' ' A' ' 73' ' ' TYR . 47.4 t -83.97 86.03 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 CA-C-O 122.373 1.082 . . . . 0.88 109.408 178.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.534 ' OD1' ' HB2' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -103.18 17.1 24.87 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 114.259 -1.337 . . . . 1.85 108.612 177.26 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 78.21 -66.08 0.22 Allowed 'General case' 0 C--O 1.215 -0.719 0 CA-C-N 113.379 -1.737 . . . . 1.29 111.254 -176.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 55.7 mt -75.53 -37.5 37.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 112.173 0.435 . . . . 1.89 112.173 -171.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.534 ' HB2' ' OD1' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -57.67 -50.03 74.53 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.044 0.387 . . . . 2.99 112.044 -177.311 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 68' ' ' LEU . 9.9 tp -95.37 -2.63 48.71 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.289 0.566 . . . . 1.66 110.151 178.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . 0.458 ' O ' HD13 ' A' ' 70' ' ' LEU . 1.2 t-20 63.57 56.98 1.51 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 114.95 -1.023 . . . . 1.74 112.168 178.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.458 HD13 ' O ' ' A' ' 69' ' ' ASN . 1.1 mm? -122.23 78.79 43.96 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.17 -0.923 . . . . 1.61 108.89 172.281 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.18 -32.85 26.23 Favored 'Trans proline' 0 C--O 1.233 0.269 0 C-N-CA 122.336 2.024 . . . . 1.3 113.198 -172.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.12 7.21 46.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.438 -0.346 . . . . 1.97 111.202 -174.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.484 ' OH ' ' HB3' ' A' ' 111' ' ' ASN . 1.0 OUTLIER -59.16 -42.81 91.65 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.321 -0.4 . . . . 1.13 110.25 179.437 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -77.29 0.9 20.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.857 -0.61 . . . . 0.91 111.315 -175.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.9 mttp -97.99 -39.05 9.14 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.212 0.529 . . . . 2.86 110.327 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.6 mt -99.09 -39.73 8.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.941 -0.572 . . . . 1.0 110.766 -178.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 50.0 mm -97.3 124.89 50.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.893 -0.594 . . . . 0.75 110.171 -178.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.38 -17.24 30.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.342 -0.39 . . . . 1.99 111.262 -176.494 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -128.32 87.28 55.67 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-O 120.841 0.353 . . . . 2.05 110.343 177.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -71.36 90.51 0.68 Allowed 'Trans proline' 0 CA--C 1.528 0.203 0 C-N-CA 122.976 2.451 . . . . 0.89 111.938 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 4.0 mmt -122.33 150.49 42.31 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 121.471 0.653 . . . . 0.82 110.527 -178.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.586 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 1.0 OUTLIER -128.45 -119.69 0.24 Allowed 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.589 -1.187 . . . . 1.42 109.03 -177.255 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -134.03 -17.68 2.12 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.941 0.4 . . . . 0.8 110.628 174.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -86.99 -30.77 19.47 Favored Glycine 0 CA--C 1.502 -0.749 0 N-CA-C 109.72 -1.352 . . . . 0.32 109.72 -178.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.3 m -74.17 -26.87 60.54 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.662 -0.769 . . . . 0.95 110.159 172.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.6 mm -66.19 -57.41 10.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.856 -0.611 . . . . 0.97 109.766 175.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.16 -24.46 66.31 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.554 -0.748 . . . . 1.15 110.886 179.049 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.523 ' HG3' HG21 ' A' ' 26' ' ' VAL . 4.3 tppt? -63.17 -48.09 79.87 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 120.703 0.287 . . . . 2.46 110.565 178.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 11.7 mtp180 -67.77 -29.54 68.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.973 0.416 . . . . 1.16 110.818 -179.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 9.4 mt -72.07 -51.38 21.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.855 -0.611 . . . . 0.49 111.182 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -73.72 -19.86 60.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.819 0.342 . . . . 1.39 111.252 -176.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.491 ' ND2' ' HB3' ' A' ' 27' ' ' SER . 17.6 t30 -95.06 0.83 54.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.369 -0.378 . . . . 1.3 111.371 -179.087 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 56.25 65.7 1.37 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.394 0.616 . . . . 1.75 110.874 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -80.41 -47.51 14.28 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 116.122 -0.49 . . . . 0.96 111.382 178.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.421 ' HB3' ' OE1' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -106.32 -173.95 2.42 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.664 0.745 . . . . 1.28 111.835 -174.311 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . 0.436 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 2.1 t90 -83.11 -45.29 14.14 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.298 -1.319 . . . . 1.05 110.159 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 46.1 t -149.49 173.67 13.34 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.47 -0.786 . . . . 1.0 110.002 -173.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.43 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -70.84 -8.55 53.43 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.398 -0.365 . . . . 0.66 111.264 -176.639 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -37.36 76.58 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.762 -0.654 . . . . 0.85 111.005 179.433 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.44 ' O ' ' HB3' ' A' ' 103' ' ' GLN . 3.1 tt0 -81.6 -30.7 32.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.05 -0.523 . . . . 2.44 110.718 -178.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 13.7 t -65.19 -22.74 66.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.205 0.526 . . . . 0.95 110.834 -178.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.26 -24.1 66.15 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.121 -0.49 . . . . 1.13 110.224 176.589 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.588 ' HG2' ' N ' ' A' ' 104' ' ' ASP . 0.0 OUTLIER -72.06 -51.38 21.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 2.96 110.445 179.158 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . 0.588 ' N ' ' HG2' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -70.63 -36.45 73.44 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.269 -0.423 . . . . 1.87 110.475 -177.491 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.698 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -60.58 -51.47 69.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.946 -0.57 . . . . 0.38 110.485 174.859 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -58.97 -41.27 87.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.891 -0.595 . . . . 0.97 110.766 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 71.1 m -56.41 -48.5 76.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.88 -0.6 . . . . 0.43 110.943 179.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.46 -42.9 61.92 Favored 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.439 0.462 . . . . 0.88 111.5 178.324 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -72.34 -45.04 61.62 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.43 -0.35 . . . . 0.29 111.159 -176.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.71 -36.16 82.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.132 0.492 . . . . 0.66 110.55 178.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . 0.484 ' HB3' ' OH ' ' A' ' 73' ' ' TYR . 25.1 m-20 -53.08 -51.91 60.31 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.314 -0.857 . . . . 1.84 111.05 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 43.8 t -60.26 -40.65 91.07 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.829 -0.623 . . . . 0.63 111.379 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -71.18 -26.84 63.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.475 -0.329 . . . . 0.81 111.528 -176.077 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 56.0 mt -92.65 -53.67 8.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.875 0.369 . . . . 0.55 111.708 -177.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -71.03 -35.49 72.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.294 -0.412 . . . . 1.22 111.355 -174.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 50.3 m-20 -101.42 166.0 10.97 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.925 0.393 . . . . 1.04 110.705 -174.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 1.7 mmpt? -78.68 140.86 59.44 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 115.947 -0.569 . . . . 3.47 110.188 178.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . 0.638 ' HA ' HG11 ' A' ' 123' ' ' VAL . 28.2 Cg_endo -65.49 -8.63 19.64 Favored 'Trans proline' 0 CA--C 1.531 0.361 0 C-N-CA 122.357 2.038 . . . . 0.96 112.541 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -103.01 4.18 37.03 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.375 -0.375 . . . . 1.23 111.251 177.516 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -76.5 154.45 34.63 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.628 -0.508 . . . . 1.34 109.628 178.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -67.97 -33.29 74.36 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.972 -0.558 . . . . 1.44 110.205 -178.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.9 tp -63.27 -36.52 76.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 116.339 -0.391 . . . . 0.42 110.519 177.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.638 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.6 t -73.18 -43.31 57.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 N-CA-C 109.778 -0.453 . . . . 0.35 109.778 178.139 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.521 ' HA ' ' OE1' ' A' ' 127' ' ' GLN . 0.2 OUTLIER -61.63 -29.77 70.27 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.001 -0.545 . . . . 0.52 110.008 -179.466 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . 0.466 ' HG2' ' CD2' ' A' ' 55' ' ' PHE . 46.7 mtt -80.63 -35.43 33.99 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.565 -0.743 . . . . 0.62 110.565 176.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.33 -36.81 76.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.021 -0.536 . . . . 0.31 111.592 -179.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . 0.521 ' OE1' ' HA ' ' A' ' 124' ' ' LEU . 18.9 mt-30 -61.22 -45.96 92.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.687 0.28 . . . . 1.94 110.638 179.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.85 -41.34 83.06 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.102 -0.499 . . . . 0.32 110.598 178.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.727 HD21 ' HA ' ' A' ' 56' ' ' ALA . 2.5 mp -58.78 -46.19 88.09 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.687 -0.688 . . . . 0.33 110.211 177.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -66.48 -30.05 70.29 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.672 -0.695 . . . . 1.47 111.061 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.1 OUTLIER -64.28 -43.33 95.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.221 -0.445 . . . . 2.24 110.285 -177.068 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.718 HD11 HD23 ' A' ' 50' ' ' LEU . 5.5 pt -79.93 -26.89 12.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.305 -0.407 . . . . 1.23 110.45 177.364 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.483 ' O ' HG23 ' A' ' 137' ' ' VAL . 37.7 t80 -59.57 -61.59 2.51 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.595 -0.275 . . . . 0.46 110.598 175.415 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 2.8 pp -65.03 -22.16 66.95 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.112 0.482 . . . . 0.64 110.442 -178.096 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.526 ' O ' ' HG3' ' A' ' 139' ' ' GLN . 0.8 OUTLIER -66.07 -54.09 30.17 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.596 -0.729 . . . . 1.61 109.979 177.572 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 4.7 mmtm -65.03 -33.71 76.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.61 -0.723 . . . . 1.52 110.692 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.485 ' O ' ' HB2' ' A' ' 140' ' ' MET . 78.7 t -67.16 -31.66 54.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.037 -0.529 . . . . 0.35 110.566 178.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.29 -19.52 64.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.058 0.456 . . . . 0.5 110.565 178.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . 0.526 ' HG3' ' O ' ' A' ' 135' ' ' GLN . 6.9 mt-30 -100.52 0.08 38.84 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.675 -0.693 . . . . 1.76 110.703 -178.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . 0.485 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 0.2 OUTLIER -66.14 147.62 98.77 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.965 -0.561 . . . . 0.86 111.115 -179.411 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . 0.416 ' C ' ' H ' ' A' ' 143' ' ' GLU . 59.9 Cg_endo -71.35 107.01 2.05 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 C-N-CA 122.557 2.171 . . . . 0.67 112.01 -176.192 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.04 14.93 0.46 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.172 0.511 . . . . 2.91 111.372 -178.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . 0.416 ' H ' ' C ' ' A' ' 141' ' ' PRO . 0.5 OUTLIER -95.2 -40.22 9.69 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 115.74 -0.664 . . . . 2.7 109.774 178.082 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 52.8 tt0 55.24 70.06 0.67 Allowed 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.025 -0.989 . . . . 2.34 110.776 -179.045 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 1.7 t -94.6 132.34 38.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.111 -0.495 . . . . 0.99 110.241 -177.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.444 ' CD ' ' HE ' ' A' ' 34' ' ' ARG . 26.8 tt0 -78.21 146.0 35.22 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.739 0.304 . . . . 1.53 110.191 178.236 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 82.5 mt . . . . . 0 C--O 1.247 0.934 0 CA-C-O 118.626 -0.702 . . . . 1.57 110.118 -179.315 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 9.8 p . . . . . 0 N--CA 1.451 -0.421 0 CA-C-O 121.32 0.581 . . . . 0.93 109.879 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 33.7 m -161.55 138.26 8.4 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.369 -0.832 . . . . 1.61 109.263 -178.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -134.43 121.07 15.06 Favored Pre-proline 0 C--N 1.322 -0.615 0 N-CA-C 110.113 -0.328 . . . . 1.6 110.113 178.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -74.86 -37.28 2.2 Favored 'Trans proline' 0 N--CA 1.473 0.305 0 C-N-CA 123.414 2.743 . . . . 1.87 112.843 -178.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 16.3 m -69.46 -25.14 63.95 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 121.795 0.807 . . . . 2.18 109.64 179.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.4 ttmm -82.85 134.16 47.46 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 114.685 -1.143 . . . . 2.75 109.496 174.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.487 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 11.4 Cg_endo -56.06 133.76 60.01 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.02 1.813 . . . . 1.38 111.115 175.484 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -124.57 69.35 0.48 Allowed Glycine 0 N--CA 1.444 -0.818 0 CA-C-N 115.644 -0.707 . . . . 0.97 111.887 -171.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.424 ' HE ' ' CD ' ' A' ' 146' ' ' GLU . 0.9 OUTLIER -101.35 -179.13 3.94 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.307 -0.627 . . . . 1.93 109.307 178.37 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.51 ' O ' ' HG2' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -143.32 137.53 28.86 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.89 -0.411 . . . . 2.64 109.89 178.271 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.54 HG22 ' HG3' ' A' ' 146' ' ' GLU . 2.1 p -120.64 174.59 6.48 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.311 -0.404 . . . . 0.68 110.251 179.296 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 56.7 t-20 -50.34 -44.65 54.54 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.705 0.628 . . . . 1.47 110.158 175.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.434 ' HG2' ' SD ' ' A' ' 140' ' ' MET . 3.3 mt-30 -60.63 -43.1 97.9 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.227 -0.442 . . . . 1.04 110.836 179.204 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.41 ' HB2' ' H ' ' A' ' 36' ' ' THR . 1.9 tm? -55.02 -56.88 14.85 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.528 -0.76 . . . . 0.8 110.856 -178.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -70.88 -31.03 67.56 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.84 -0.618 . . . . 1.75 111.105 -178.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.528 ' CZ ' HG11 ' A' ' 45' ' ' VAL . 58.9 t80 -58.34 -63.72 1.17 Allowed 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.814 -0.63 . . . . 0.64 111.42 -179.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.607 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.3 OUTLIER -60.1 -30.69 69.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.618 0.247 . . . . 1.13 111.039 -172.427 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -62.29 -53.17 58.99 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.038 -0.528 . . . . 1.3 111.317 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.469 ' O ' ' HB2' ' A' ' 48' ' ' LYS . 50.3 m-80 -87.94 -29.49 20.77 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.932 0.396 . . . . 0.5 112.048 -177.579 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.528 HG11 ' CZ ' ' A' ' 41' ' ' TYR . 92.7 t -89.26 -58.66 3.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 N-CA-C 112.559 0.578 . . . . 0.3 112.559 -175.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.673 HG22 ' HB3' ' A' ' 136' ' ' LYS . 61.3 t -77.54 -65.12 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 C-N-CA 120.977 -0.289 . . . . 0.26 111.579 -169.246 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.474 HG12 ' O ' ' A' ' 42' ' ' MET . 1.6 p -66.51 -34.19 68.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 C-N-CA 120.512 -0.475 . . . . 0.83 111.546 -174.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -62.86 -35.46 80.05 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 120.559 -0.457 . . . . 2.4 111.457 177.826 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 22.8 m -77.35 -39.28 48.11 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.858 -0.337 . . . . 0.55 110.79 177.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.648 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -60.72 -37.97 83.49 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.221 0.534 . . . . 0.33 109.699 176.24 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 16.6 t-105 -63.78 -30.18 71.31 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.231 -0.895 . . . . 0.39 111.626 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.9 mttm -83.16 -5.94 59.3 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.197 0.443 . . . . 2.24 112.197 -173.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.405 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 3.7 t-80 -74.73 131.72 41.06 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.546 -0.539 . . . . 0.39 109.546 176.19 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -76.79 -11.87 59.9 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.591 -0.277 . . . . 1.91 111.397 -175.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.405 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 1.5 m-30 -92.87 -2.54 55.78 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.11 0.481 . . . . 0.93 110.14 176.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.781 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -96.78 14.26 25.76 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.111 -0.495 . . . . 0.28 110.596 179.245 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.52 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 47.6 p-90 -66.37 -33.2 6.29 Favored Pre-proline 0 CA--C 1.546 0.811 0 N-CA-C 114.016 1.117 . . . . 0.58 114.016 -174.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.52 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 11.7 Cg_exo -71.94 -2.05 10.92 Favored 'Trans proline' 0 C--N 1.361 1.228 0 C-N-CA 121.443 1.429 . . . . 0.47 112.328 178.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -111.19 15.73 21.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.272 -0.422 . . . . 1.11 110.632 -178.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.45 ' CE2' ' HA ' ' A' ' 57' ' ' TRP . 18.3 m-30 -83.21 -12.07 57.22 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.051 -0.522 . . . . 0.63 110.699 179.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.71 135.28 27.11 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.205 -0.452 . . . . 1.63 110.306 -177.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -71.47 147.3 51.9 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 122.718 2.279 . . . . 0.87 112.599 -177.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.419 HG21 ' CZ ' ' A' ' 73' ' ' TYR . 2.6 t -70.38 105.92 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.525 0 CA-C-O 121.931 0.872 . . . . 0.88 110.326 176.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.458 ' HB3' ' HB3' ' A' ' 67' ' ' LYS . 12.0 t70 -116.07 131.1 57.04 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 107.601 -1.259 . . . . 1.85 107.601 166.348 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.14 -16.11 61.18 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.317 -0.401 . . . . 1.29 111.462 -173.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.9 mt -97.42 -44.08 12.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.031 0.443 . . . . 1.89 110.663 177.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.458 ' HB3' ' HB3' ' A' ' 64' ' ' ASP . 14.8 tptm -66.0 -48.41 71.29 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.729 -0.669 . . . . 2.99 111.587 -177.019 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -101.8 1.74 37.53 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.502 -0.317 . . . . 1.66 110.701 -177.137 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 47.7 t30 58.23 55.06 5.32 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.868 -0.605 . . . . 1.74 111.332 178.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.0 mt -123.37 70.67 44.7 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 115.892 -0.595 . . . . 1.61 111.269 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.98 -19.78 22.77 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.158 1.905 . . . . 1.3 111.441 178.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -77.46 -16.44 58.76 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.322 -0.854 . . . . 1.97 110.557 -179.756 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.419 ' CZ ' HG21 ' A' ' 63' ' ' VAL . 0.8 OUTLIER -61.27 -38.17 85.77 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.371 -0.831 . . . . 1.13 111.732 -176.412 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 8.1 m-70 -83.43 -0.79 51.58 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.083 -0.508 . . . . 0.91 111.303 -169.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.5 mtpt -93.02 -21.51 19.7 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.141 0.496 . . . . 2.86 109.815 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mt -114.53 -49.28 5.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.51 -0.768 . . . . 1.0 111.001 -178.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.452 HG22 ' H ' ' A' ' 79' ' ' ASN . 33.9 mm -99.87 123.12 52.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.058 0.456 . . . . 0.75 110.44 -178.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.37 -9.25 51.05 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.985 -0.552 . . . . 1.99 110.891 -177.463 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.452 ' H ' HG22 ' A' ' 77' ' ' ILE . 0.2 OUTLIER -134.6 80.31 51.04 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.9 -0.591 . . . . 2.05 110.743 -179.414 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -70.7 94.7 0.61 Allowed 'Trans proline' 0 CA--C 1.529 0.26 0 C-N-CA 122.478 2.119 . . . . 0.89 112.219 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -128.13 159.78 34.07 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.167 0.508 . . . . 0.82 110.981 -176.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.2 p-10 -135.93 -126.45 0.15 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.929 -1.032 . . . . 1.42 109.742 -175.021 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.4 ttm -122.76 -18.1 6.64 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.43 -0.581 . . . . 0.8 109.43 177.116 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.432 ' HA2' ' HG2' ' A' ' 87' ' ' LYS . . . -82.13 -35.74 20.15 Favored Glycine 0 N--CA 1.44 -1.036 0 N-CA-C 109.808 -1.317 . . . . 0.32 109.808 179.484 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.8 m -72.36 -31.64 65.78 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.236 -0.482 . . . . 0.95 110.621 174.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.5 HD12 ' HB2' ' A' ' 104' ' ' ASP . 0.2 OUTLIER -64.67 -53.29 44.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 109.145 -0.687 . . . . 0.97 109.145 177.454 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.432 ' HG2' ' HA2' ' A' ' 84' ' ' GLY . 0.2 OUTLIER -65.39 -26.18 67.88 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.896 -0.593 . . . . 1.15 110.737 179.384 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.01 -47.21 81.19 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-O 120.81 0.338 . . . . 2.46 110.54 179.124 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 9.5 mtp180 -67.81 -31.59 71.55 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.23 -0.441 . . . . 1.16 110.619 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.3 mt -68.43 -52.27 34.57 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.061 -0.518 . . . . 0.49 111.254 178.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -75.66 -18.82 59.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.36 -0.382 . . . . 1.39 111.822 -175.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -95.27 0.05 53.44 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.749 0.309 . . . . 1.3 110.411 178.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 56.58 66.48 1.18 Allowed 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.614 -0.721 . . . . 1.75 110.921 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 11.3 t80 -70.76 -57.76 4.32 Favored 'General case' 0 CA--C 1.512 -0.483 0 CA-C-O 121.765 0.793 . . . . 0.96 110.725 175.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -103.7 -177.88 3.5 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 114.268 -1.333 . . . . 1.28 112.074 -173.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . 0.487 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 2.3 t-105 -79.89 -44.61 20.12 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.444 -1.253 . . . . 1.05 110.647 -177.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 14.5 t -146.68 175.37 10.65 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.994 -0.548 . . . . 1.0 110.971 -173.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.15 -14.54 60.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.253 -0.43 . . . . 0.66 111.083 -176.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.12 -31.22 68.74 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.479 0.657 . . . . 0.85 109.869 174.469 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.64 -39.31 45.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.365 -0.834 . . . . 2.44 110.228 177.012 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 31.7 t -62.85 -22.62 66.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.595 -0.729 . . . . 0.95 110.586 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 5.4 mtt -58.97 -21.1 57.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.89 -0.595 . . . . 1.13 110.646 175.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -76.27 -55.94 5.1 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 116.38 -0.373 . . . . 2.96 110.328 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . 0.5 ' HB2' HD12 ' A' ' 86' ' ' ILE . 0.1 OUTLIER -67.07 -40.62 87.07 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.361 -0.381 . . . . 1.87 111.224 -176.21 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.648 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -59.24 -45.32 91.45 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.129 0.49 . . . . 0.38 110.548 176.623 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -64.72 -43.96 91.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.847 -0.615 . . . . 0.97 110.336 178.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . 0.467 ' O ' ' HB3' ' A' ' 111' ' ' ASN . 57.3 m -53.98 -46.58 71.73 Favored 'General case' 0 C--N 1.332 -0.157 0 O-C-N 123.76 0.663 . . . . 0.43 111.31 -178.403 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -52.83 -40.29 63.21 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.12 -0.491 . . . . 0.88 111.07 178.195 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -74.85 -50.53 16.72 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.303 -0.408 . . . . 0.29 111.512 -177.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.28 -43.47 97.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.926 0.393 . . . . 0.66 111.058 -177.041 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . 0.467 ' HB3' ' O ' ' A' ' 107' ' ' THR . 0.1 OUTLIER -51.76 -44.31 63.31 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.386 -0.825 . . . . 1.84 111.252 179.229 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.83 -36.01 82.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.402 -0.363 . . . . 0.63 110.842 -178.535 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -71.85 -24.32 61.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.252 -0.431 . . . . 0.81 111.395 -178.006 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 25.2 mt -89.84 -49.11 14.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.361 -0.381 . . . . 0.55 111.226 -177.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 88.0 t80 -69.22 -32.11 71.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.442 . . . . 1.22 111.461 -175.005 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 54.1 m-80 -108.15 169.62 8.51 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.126 0.489 . . . . 1.04 111.531 -173.016 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 11.2 mmtt -82.53 149.45 61.02 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.672 -0.694 . . . . 3.47 109.969 177.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . 0.568 ' HA ' HG11 ' A' ' 123' ' ' VAL . 34.2 Cg_endo -66.23 -9.6 24.26 Favored 'Trans proline' 0 CA--C 1.53 0.319 0 C-N-CA 122.576 2.184 . . . . 0.96 112.848 -177.557 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -111.53 27.67 9.46 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.822 0.344 . . . . 1.23 111.269 179.605 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . 0.471 ' OD2' HG22 ' A' ' 122' ' ' ILE . 8.6 t70 -99.85 164.58 11.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 1.34 110.705 178.255 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -64.26 -49.16 72.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.834 -0.621 . . . . 1.44 110.417 -178.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . 0.471 HG22 ' OD2' ' A' ' 120' ' ' ASP . 3.4 tp -61.45 -35.95 70.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.12 -0.491 . . . . 0.42 111.054 -175.517 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.568 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.4 t -70.4 -47.1 67.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 121.001 0.429 . . . . 0.35 110.157 177.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.2 mt -60.91 -35.25 76.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.726 -0.67 . . . . 0.52 110.238 -179.052 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 29.6 mtt -73.2 -43.36 61.46 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.757 -0.656 . . . . 0.62 110.619 179.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.97 -35.22 68.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.239 -0.437 . . . . 0.31 111.491 -179.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -62.89 -42.65 99.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.275 -0.42 . . . . 1.94 111.007 179.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -77.06 -39.73 48.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 0.32 110.518 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.781 HD21 ' HA ' ' A' ' 56' ' ' ALA . 2.3 mp -57.49 -39.74 77.09 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.483 -0.78 . . . . 0.33 110.757 178.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.6 -26.63 68.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.706 -0.679 . . . . 1.47 111.527 -177.68 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.498 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 27.6 mttt -64.9 -35.97 82.87 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.887 -0.412 . . . . 2.24 109.887 -179.64 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.464 ' H ' HG13 ' A' ' 132' ' ' ILE . 2.5 mt -74.77 -30.51 24.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.735 -0.666 . . . . 1.23 110.393 178.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.476 ' O ' HG23 ' A' ' 137' ' ' VAL . 49.5 t80 -59.29 -61.84 2.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.88 -0.6 . . . . 0.46 110.153 177.434 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.02 -30.07 71.32 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.102 0.477 . . . . 0.64 110.534 -178.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.498 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -59.49 -31.6 69.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.469 -0.787 . . . . 1.61 112.173 -180.0 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . 0.673 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -99.72 -22.32 15.43 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.072 0.463 . . . . 1.52 110.444 -179.504 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.648 ' O ' ' HB2' ' A' ' 140' ' ' MET . 56.1 t -77.92 -31.9 17.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.63 -0.714 . . . . 0.35 110.436 -179.329 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.24 -18.27 64.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.167 0.508 . . . . 0.5 110.419 178.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . 0.471 ' HB2' ' OH ' ' A' ' 41' ' ' TYR . 1.9 mt-30 -98.18 2.8 48.82 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.633 -0.712 . . . . 1.76 110.324 179.487 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . 0.648 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 1.6 mtt -67.39 147.68 98.81 Favored Pre-proline 0 C--O 1.233 0.219 0 CA-C-N 115.874 -0.603 . . . . 0.86 110.667 177.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.31 105.7 2.09 Favored 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.222 1.948 . . . . 0.67 111.508 175.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.04 8.37 2.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.083 0.468 . . . . 2.91 111.487 -174.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -91.06 -38.82 12.55 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.846 -0.616 . . . . 2.7 109.864 178.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 61.8 91.31 0.06 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 114.647 -1.161 . . . . 2.34 110.641 -177.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 10.3 t -111.08 126.27 68.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 115.897 -0.592 . . . . 0.99 109.532 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.54 ' HG3' HG22 ' A' ' 36' ' ' THR . 4.1 tt0 -71.64 149.23 45.77 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.993 0.425 . . . . 1.53 111.135 -177.443 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 16.0 mt . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.881 -0.58 . . . . 1.57 110.555 -178.245 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.3 p . . . . . 0 N--CA 1.452 -0.341 0 CA-C-O 121.583 0.706 . . . . 0.93 109.522 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 70.8 m -160.83 145.85 14.22 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 114.963 -1.017 . . . . 1.61 109.73 178.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.479 ' HB3' ' HB2' ' A' ' 31' ' ' LYS . 24.8 t-20 -146.57 126.85 6.93 Favored Pre-proline 0 C--N 1.316 -0.852 0 N-CA-C 108.765 -0.828 . . . . 1.6 108.765 175.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -61.81 -46.13 14.72 Favored 'Trans proline' 0 N--CA 1.474 0.374 0 C-N-CA 123.241 2.628 . . . . 1.87 113.305 -175.024 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 6.1 m -77.55 -22.74 50.56 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.212 0.529 . . . . 2.18 110.927 -177.045 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.479 ' HB2' ' HB3' ' A' ' 28' ' ' ASN . 9.3 tttm -77.22 124.77 87.12 Favored Pre-proline 0 C--N 1.321 -0.665 0 CA-C-N 115.393 -0.821 . . . . 2.75 111.231 -177.624 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.403 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 6.0 Cg_exo -76.09 151.57 34.87 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.538 2.159 . . . . 1.38 111.975 175.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -136.85 136.06 8.09 Favored Glycine 0 N--CA 1.443 -0.86 0 N-CA-C 110.366 -1.094 . . . . 0.97 110.366 177.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.98 166.19 22.96 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.187 0.517 . . . . 1.93 111.361 -176.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -115.23 70.13 0.74 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.32 -0.854 . . . . 2.64 109.483 -179.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.68 HG22 ' HG3' ' A' ' 146' ' ' GLU . 2.6 p -89.0 170.02 11.02 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.84 -0.344 . . . . 0.68 110.726 -177.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.506 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 67.2 t30 -59.55 -47.34 85.95 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 115.939 -0.573 . . . . 1.47 110.406 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -56.0 -46.58 78.68 Favored 'General case' 0 C--O 1.233 0.231 0 O-C-N 123.296 0.373 . . . . 1.04 110.821 179.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.91 -59.61 5.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.103 -0.498 . . . . 0.8 111.355 -178.248 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -65.55 -28.26 69.03 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.088 -0.505 . . . . 1.75 110.613 -177.289 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.561 ' CE1' ' HG2' ' A' ' 140' ' ' MET . 36.3 t80 -60.89 -63.34 1.33 Allowed 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.172 -0.467 . . . . 0.64 110.974 176.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.526 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.2 OUTLIER -63.82 -28.45 69.87 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.736 -0.385 . . . . 1.13 110.648 -172.436 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.651 ' HB2' HD22 ' A' ' 90' ' ' LEU . 4.1 tt0 -66.08 -50.58 63.62 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.86 -0.609 . . . . 1.3 110.743 178.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.9 m-80 -86.53 -31.1 21.45 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 111.99 0.367 . . . . 0.5 111.99 -177.52 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 99.4 t -89.34 -58.47 3.47 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.924 0 N-CA-C 112.446 0.536 . . . . 0.3 112.446 -176.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.69 HG22 ' HB3' ' A' ' 136' ' ' LYS . 71.3 t -77.23 -66.14 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.337 -0.392 . . . . 0.26 111.685 -169.15 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.452 HG11 HD13 ' A' ' 90' ' ' LEU . 1.8 p -65.83 -36.05 76.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 C-N-CA 120.531 -0.468 . . . . 0.83 111.588 -175.185 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 7.8 mttt -63.05 -39.61 95.25 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.343 -0.543 . . . . 2.4 111.496 178.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.605 HG21 ' HE2' ' A' ' 136' ' ' LYS . 90.2 m -69.75 -39.33 76.8 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.729 0.299 . . . . 0.55 110.801 177.554 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.639 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -64.28 -40.29 95.65 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 109.724 -0.473 . . . . 0.33 109.724 176.391 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . 0.427 ' CE3' ' HE3' ' A' ' 83' ' ' MET . 15.5 t-105 -62.87 -35.91 81.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.541 -0.754 . . . . 0.39 111.025 177.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -81.68 9.59 7.51 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.412 -0.358 . . . . 2.24 111.873 -177.21 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.401 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 10.8 t-80 -90.05 126.46 35.78 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.299 -0.63 . . . . 0.39 109.299 173.276 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -81.97 15.46 2.28 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 112.114 0.412 . . . . 1.91 112.114 -173.279 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.401 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.3 OUTLIER -111.43 -5.3 14.62 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.205 -0.665 . . . . 0.93 109.205 171.524 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.634 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -95.57 16.93 15.83 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.579 -0.737 . . . . 0.28 110.613 179.681 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.517 ' CG ' ' HD3' ' A' ' 58' ' ' PRO . 57.9 p-90 -67.28 -35.16 8.07 Favored Pre-proline 0 CA--C 1.54 0.593 0 N-CA-C 113.527 0.936 . . . . 0.58 113.527 -175.366 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.517 ' HD3' ' CG ' ' A' ' 57' ' ' TRP . 2.9 Cg_exo -76.17 2.82 6.77 Favored 'Trans proline' 0 C--N 1.361 1.223 0 C-N-CA 121.445 1.43 . . . . 0.47 111.425 175.314 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -107.2 -4.85 18.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.396 -0.82 . . . . 1.11 110.687 -178.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.0 m-30 -71.15 -29.1 64.8 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.315 -0.402 . . . . 0.63 111.748 -176.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.75 123.39 45.88 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-N 116.269 -0.423 . . . . 1.63 111.203 -172.512 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.683 ' HB3' HG23 ' A' ' 85' ' ' THR . 25.0 Cg_exo -61.56 144.65 97.88 Favored 'Trans proline' 0 C--O 1.238 0.481 0 C-N-CA 122.686 2.258 . . . . 0.87 112.314 178.164 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 4.0 t -80.69 111.49 17.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-O 121.661 0.743 . . . . 0.88 110.633 -179.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.451 ' HB3' ' HG2' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -111.51 -0.09 16.31 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.043 -0.98 . . . . 1.85 109.478 177.488 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.498 ' HB2' ' NE2' ' A' ' 74' ' ' HIS . . . 78.38 -55.66 0.48 Allowed 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 114.762 -1.108 . . . . 1.29 111.5 -177.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.7 mp -80.41 -44.32 21.99 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 O-C-N 122.177 -0.327 . . . . 1.89 111.749 -173.142 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.451 ' HG2' ' HB3' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -64.03 -31.04 72.09 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.594 0.22 . . . . 2.99 111.594 -177.424 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.451 ' HB3' HD22 ' A' ' 70' ' ' LEU . 5.0 tp -109.81 3.61 20.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.643 0.258 . . . . 1.66 111.601 -176.482 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 58.85 59.52 2.81 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.361 0.6 . . . . 1.74 111.236 179.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.451 HD22 ' HB3' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -124.7 72.96 62.12 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 115.222 -0.899 . . . . 1.61 109.625 178.051 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -74.49 -58.83 0.05 OUTLIER 'Trans proline' 0 CA--C 1.531 0.34 0 C-N-CA 121.952 1.768 . . . . 1.3 112.928 -174.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -79.83 6.77 10.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.387 0.613 . . . . 1.97 111.019 -176.445 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -61.04 -38.42 86.08 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.233 -0.894 . . . . 1.13 110.613 177.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . 0.498 ' NE2' ' HB2' ' A' ' 65' ' ' ALA . 5.1 m-70 -80.25 -0.4 36.24 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.461 -0.79 . . . . 0.91 111.404 -175.764 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.2 mmtp -94.47 -44.24 7.98 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.658 -0.497 . . . . 2.86 109.658 -179.032 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 14.0 mt -82.99 -47.18 18.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.807 -0.633 . . . . 1.0 110.807 179.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.6 mm -93.53 133.64 33.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.167 -0.47 . . . . 0.75 110.056 -178.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.55 -36.28 24.12 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.136 -0.484 . . . . 1.99 110.54 -177.161 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -119.56 88.88 39.82 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 115.771 -0.65 . . . . 2.05 110.279 -179.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -74.46 80.57 2.24 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 122.857 2.371 . . . . 0.89 112.297 -178.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.63 176.52 5.14 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.358 0.599 . . . . 0.82 111.158 -178.442 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.571 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 4.4 p-10 -154.32 -129.08 0.03 OUTLIER 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 114.763 -1.108 . . . . 1.42 108.96 -172.254 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . 0.469 ' SD ' HD13 ' A' ' 50' ' ' LEU . 6.7 ttp -124.69 -16.8 6.12 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.245 0.545 . . . . 0.8 110.242 -177.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -90.05 -29.47 15.09 Favored Glycine 0 N--CA 1.44 -1.044 0 N-CA-C 110.455 -1.058 . . . . 0.32 110.455 -178.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.683 HG23 ' HB3' ' A' ' 62' ' ' PRO . 0.7 OUTLIER -70.06 -42.65 72.55 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 121.258 0.552 . . . . 0.95 110.373 177.185 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 48.8 mt -61.95 -44.1 98.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.249 -0.887 . . . . 0.97 109.944 175.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.73 -34.56 76.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.838 -0.619 . . . . 1.15 111.44 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.0 mtpt -62.1 -49.09 77.31 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.393 0.616 . . . . 2.46 110.518 179.345 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 32.5 mtp180 -66.69 -29.38 69.36 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.382 -0.827 . . . . 1.16 111.314 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.651 HD22 ' HB2' ' A' ' 43' ' ' GLN . 6.3 mt -70.18 -51.67 29.35 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.297 -0.41 . . . . 0.49 110.883 177.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -73.68 -17.45 61.14 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.142 -0.481 . . . . 1.39 111.695 -175.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 14.4 t30 -100.94 1.32 39.69 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 121.028 -0.269 . . . . 1.3 110.825 178.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 54.77 58.92 4.41 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.937 -0.574 . . . . 1.75 111.184 178.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 43.5 t80 -76.51 -28.56 56.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.167 -0.47 . . . . 0.96 111.283 -178.603 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -117.36 179.76 3.95 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.119 0.485 . . . . 1.28 111.217 -177.537 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . 0.403 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 2.1 t-105 -81.34 -44.47 17.57 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.282 -0.872 . . . . 1.05 110.771 -177.071 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 36.5 t -148.12 -179.6 7.04 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.034 -0.53 . . . . 1.0 111.166 -172.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.45 -18.05 60.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.067 -0.515 . . . . 0.66 111.196 -176.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.38 -29.43 67.7 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.319 0.581 . . . . 0.85 110.195 177.322 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -82.34 -24.64 34.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.508 -0.769 . . . . 2.44 110.265 -179.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 9.6 t -83.42 -30.57 27.2 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.528 -0.76 . . . . 0.95 110.876 -178.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 8.8 ttm -59.01 -33.8 71.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.802 -0.635 . . . . 1.13 111.532 -177.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.48 -45.51 87.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.165 -0.471 . . . . 2.96 110.611 -179.54 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.26 -38.05 71.9 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.328 -0.396 . . . . 1.87 110.316 -179.422 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.639 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -57.97 -43.97 86.81 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.856 -0.611 . . . . 0.38 110.802 178.466 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 31.0 t30 -66.53 -46.29 76.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.973 -0.558 . . . . 0.97 110.08 176.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 94.2 m -57.14 -41.38 79.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.787 -0.642 . . . . 0.43 111.859 -179.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -54.25 -35.09 62.13 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 120.792 0.33 . . . . 0.88 111.141 177.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -78.97 -49.58 12.53 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.233 -0.439 . . . . 0.29 110.753 -177.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.77 -42.85 89.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.352 -0.385 . . . . 0.66 110.876 179.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -51.6 -47.1 63.73 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.589 -0.732 . . . . 1.84 111.002 178.017 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 4.4 t -62.32 -44.82 95.6 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 120.765 0.316 . . . . 0.63 110.938 177.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -65.41 -34.2 77.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.295 -0.411 . . . . 0.81 111.613 -177.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 54.4 mt -80.48 -52.77 13.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.468 -0.333 . . . . 0.55 111.701 -176.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 93.0 t80 -64.77 -35.49 81.25 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.865 0.364 . . . . 1.22 111.156 -175.179 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 -99.8 -175.98 3.13 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.084 -0.507 . . . . 1.04 110.552 -175.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . 0.578 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 0.2 OUTLIER -93.33 150.73 39.5 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 109.469 -0.567 . . . . 3.47 109.469 176.161 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . 0.403 ' HA ' HG11 ' A' ' 123' ' ' VAL . 38.2 Cg_exo -62.9 -15.35 46.81 Favored 'Trans proline' 0 N--CA 1.471 0.174 0 C-N-CA 122.29 1.993 . . . . 0.96 112.141 177.463 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.88 16.63 24.89 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.6 -0.727 . . . . 1.23 110.927 177.474 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . 0.578 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 0.2 OUTLIER -80.04 159.01 26.34 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 120.884 0.373 . . . . 1.34 110.569 -178.752 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -68.01 -46.72 70.47 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.726 -0.67 . . . . 1.44 110.666 -177.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -62.69 -37.83 80.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.123 -0.489 . . . . 0.42 110.634 179.232 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.403 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.3 t -66.12 -42.19 90.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.009 0.433 . . . . 0.35 110.252 178.703 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -33.38 72.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.843 -0.617 . . . . 0.52 109.878 179.909 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . 0.458 ' O ' HD13 ' A' ' 129' ' ' LEU . 11.9 mtt -75.06 -47.47 28.73 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.403 -0.817 . . . . 0.62 110.515 177.001 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -55.9 -37.91 69.51 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.11 -0.495 . . . . 0.31 111.358 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.03 -41.4 87.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.979 -0.555 . . . . 1.94 111.043 178.268 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -76.17 -38.89 56.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.027 0.442 . . . . 0.32 110.602 178.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.634 HD21 ' HA ' ' A' ' 56' ' ' ALA . 2.3 mp -57.31 -41.76 80.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.566 -0.743 . . . . 0.33 110.399 177.787 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -61.27 -26.28 67.66 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.281 -0.872 . . . . 1.47 112.106 -176.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.534 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 49.4 mttm -62.64 -45.78 91.27 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 120.751 0.31 . . . . 2.24 110.38 -175.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.443 HD12 HD23 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -77.48 -21.89 14.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.185 -0.462 . . . . 1.23 110.903 -179.601 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.544 ' O ' HG23 ' A' ' 137' ' ' VAL . 22.0 t80 -63.43 -61.98 1.98 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.652 -0.249 . . . . 0.46 110.516 177.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.0 -27.2 67.95 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.115 0.484 . . . . 0.64 110.219 -178.386 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.534 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -58.87 -56.74 18.34 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.173 -0.922 . . . . 1.61 110.865 174.384 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . 0.69 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -66.67 -30.29 70.51 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.92 -0.582 . . . . 1.52 110.867 -177.761 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 133' ' ' PHE . 83.2 t -66.53 -34.8 72.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.146 -0.479 . . . . 0.35 110.229 176.311 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -70.84 -15.32 62.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.163 -0.472 . . . . 0.5 111.019 179.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . 0.479 ' HG3' ' O ' ' A' ' 135' ' ' GLN . 11.1 mt-30 -98.25 -6.38 31.24 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.398 -0.364 . . . . 1.76 110.596 177.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . 0.561 ' HG2' ' CE1' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -66.12 159.21 72.7 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.086 -0.507 . . . . 0.86 110.453 -179.927 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -74.65 116.95 4.77 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 121.479 1.452 . . . . 0.67 110.366 174.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 -71.34 -2.78 17.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.514 0.673 . . . . 2.91 110.391 -178.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.6 -130.92 0.21 Allowed 'General case' 0 N--CA 1.432 -1.371 0 CA-C-N 114.768 -1.105 . . . . 2.7 108.861 179.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 178.8 132.5 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.08 -0.711 . . . . 2.34 109.08 169.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 2.4 t -131.66 114.45 25.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.305 -0.407 . . . . 0.99 110.118 -179.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.68 ' HG3' HG22 ' A' ' 36' ' ' THR . 15.8 tt0 -76.09 134.21 40.09 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 110.221 -0.288 . . . . 1.53 110.221 179.397 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 4.3 mt . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.647 -0.692 . . . . 1.57 110.346 -179.195 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.1 p . . . . . 0 N--CA 1.452 -0.355 0 CA-C-O 121.632 0.729 . . . . 0.93 109.329 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.2 m -169.87 143.37 2.58 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.706 -1.134 . . . . 1.61 108.514 178.441 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -151.91 140.21 13.33 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-O 120.555 0.216 . . . . 1.6 110.527 -178.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -70.76 -45.15 1.12 Allowed 'Trans proline' 0 N--CA 1.475 0.439 0 C-N-CA 123.193 2.595 . . . . 1.87 113.323 177.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.7 m -74.8 -28.34 60.68 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 121.206 0.527 . . . . 2.18 110.389 -176.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -86.31 114.84 59.61 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 115.488 -0.778 . . . . 2.75 109.015 174.347 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.498 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 5.9 Cg_exo -66.66 148.11 82.64 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 121.651 1.567 . . . . 1.38 111.812 -176.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -144.81 119.51 1.26 Allowed Glycine 0 N--CA 1.44 -1.045 0 N-CA-C 110.638 -0.985 . . . . 0.97 110.638 -179.194 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.3 mmm-85 -134.52 171.51 14.21 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.861 -0.422 . . . . 1.93 109.861 -176.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.472 ' HA ' HD22 ' A' ' 39' ' ' LEU . 26.7 ttpt -111.1 98.56 7.62 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.649 -0.5 . . . . 2.64 109.649 -179.124 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.695 HG22 ' HG3' ' A' ' 146' ' ' GLU . 2.8 p -106.15 167.25 9.94 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.748 0.309 . . . . 0.68 111.366 -178.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.572 ' HB3' ' O ' ' A' ' 145' ' ' VAL . 0.1 OUTLIER -66.78 -35.52 80.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.096 -0.502 . . . . 1.47 110.781 -179.582 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -70.32 -38.87 75.02 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.894 0.378 . . . . 1.04 110.34 176.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.827 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.5 OUTLIER -62.88 -52.63 62.37 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.003 -0.544 . . . . 0.8 110.339 178.253 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.95 -20.88 65.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.008 -0.542 . . . . 1.75 111.134 -179.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.57 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 43.4 t80 -68.31 -63.47 1.05 Allowed 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.741 -0.663 . . . . 0.64 111.33 179.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.551 ' HA ' HG23 ' A' ' 46' ' ' VAL . 1.5 ttm -60.37 -33.85 73.04 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 111.978 0.362 . . . . 1.13 111.978 -170.101 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.557 ' HG2' ' O ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -63.01 -48.91 76.75 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.154 0.502 . . . . 1.3 110.585 -175.423 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.544 ' O ' ' HB2' ' A' ' 48' ' ' LYS . 69.7 m-80 -85.79 -31.29 22.41 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.835 -0.621 . . . . 0.5 111.537 -178.312 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 88.3 t -89.01 -59.72 2.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 112.878 0.695 . . . . 0.3 112.878 -175.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.691 HG22 ' HB3' ' A' ' 136' ' ' LYS . 21.9 t -79.14 -51.82 16.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 C-N-CA 120.992 -0.283 . . . . 0.26 110.669 -171.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.55 HG23 ' O ' ' A' ' 42' ' ' MET . 14.7 t -58.34 -47.61 87.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.912 -0.586 . . . . 0.83 111.083 -178.03 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.544 ' HB2' ' O ' ' A' ' 44' ' ' ASN . 3.6 mttt -63.34 -29.9 71.13 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.214 0.449 . . . . 2.4 112.214 -177.474 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.489 HG21 ' HD3' ' A' ' 136' ' ' LYS . 25.5 m -73.99 -42.05 60.99 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.77 -0.372 . . . . 0.55 110.129 177.376 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.608 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -61.82 -42.18 98.71 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.609 0.719 . . . . 0.33 109.43 174.824 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 8.1 t-105 -58.48 -35.02 71.56 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.664 -1.153 . . . . 0.39 111.99 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 10.9 mtpp -91.36 12.99 18.68 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.301 0.482 . . . . 2.24 112.301 -173.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.419 ' ND1' ' HB2' ' A' ' 55' ' ' PHE . 15.3 t-80 -85.94 138.81 31.73 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.104 -0.332 . . . . 0.39 110.104 176.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.3 mm-40 -75.45 0.99 15.17 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.049 0.388 . . . . 1.91 112.049 -174.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.419 ' HB2' ' ND1' ' A' ' 53' ' ' HIS . 0.5 OUTLIER -111.56 -1.87 15.66 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.951 0.405 . . . . 0.93 110.638 178.238 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.449 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -100.95 16.31 25.7 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.014 0.435 . . . . 0.28 110.764 -178.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.539 ' CG ' ' HD3' ' A' ' 58' ' ' PRO . 63.7 p-90 -64.91 -36.34 16.12 Favored Pre-proline 0 CA--C 1.545 0.775 0 N-CA-C 113.742 1.016 . . . . 0.58 113.742 -174.204 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.539 ' HD3' ' CG ' ' A' ' 57' ' ' TRP . 60.5 Cg_endo -84.25 9.34 4.17 Favored 'Trans proline' 0 C--N 1.359 1.103 0 CA-C-N 120.873 1.347 . . . . 0.47 111.881 178.256 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -112.75 21.17 15.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.636 -0.711 . . . . 1.11 110.777 -177.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 18.2 m-30 -91.64 -16.68 26.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.481 -0.327 . . . . 0.63 111.482 -176.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.483 ' HB2' HD13 ' A' ' 68' ' ' LEU . 37.3 mt-30 -114.96 133.25 22.67 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 116.559 -0.291 . . . . 1.63 110.897 -173.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.618 ' HA ' ' OD1' ' A' ' 82' ' ' ASP . 27.3 Cg_endo -63.28 142.73 87.27 Favored 'Trans proline' 0 C--O 1.237 0.474 0 C-N-CA 122.539 2.16 . . . . 0.87 112.191 179.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 40.0 t -71.64 93.09 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 122.137 0.97 . . . . 0.88 110.466 178.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.42 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.0 OUTLIER -98.65 -3.08 36.87 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.653 -1.158 . . . . 1.85 108.978 175.272 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.42 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 81.38 -35.52 0.11 Allowed 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 114.155 -1.384 . . . . 1.29 111.703 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 42.9 mt -95.04 -48.52 12.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 120.676 0.274 . . . . 1.89 110.355 179.346 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.41 -38.04 58.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.736 -0.666 . . . . 2.99 112.074 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.483 HD13 ' HB2' ' A' ' 61' ' ' GLN . 6.8 tp -109.96 6.69 23.37 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.555 -0.293 . . . . 1.66 111.394 -175.459 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 59.24 51.45 6.87 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.265 0.555 . . . . 1.74 111.374 178.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 17.6 mt -126.97 71.7 75.59 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.83 -0.623 . . . . 1.61 110.402 179.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -72.47 -40.99 1.89 Allowed 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.338 2.025 . . . . 1.3 113.051 -174.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -92.41 26.29 2.66 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.31 0.576 . . . . 1.97 111.085 -176.016 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -70.04 -53.87 15.67 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.584 -0.734 . . . . 1.13 111.814 -178.855 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -73.96 4.99 4.6 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.796 -0.638 . . . . 0.91 112.252 -171.089 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.0 mttp -88.26 -21.82 24.27 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.591 -0.522 . . . . 2.86 109.591 179.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.502 HD13 ' CE1' ' A' ' 115' ' ' TYR . 2.7 mp -122.82 -48.33 2.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.692 -0.685 . . . . 1.0 110.443 -179.424 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.483 HD11 ' HB2' ' A' ' 115' ' ' TYR . 41.5 mm -83.26 124.42 39.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 120.898 0.38 . . . . 0.75 110.209 -179.698 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 10.9 mmtt -77.49 -44.88 27.36 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.88 -0.6 . . . . 1.99 110.903 -176.519 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 41.4 m-20 -113.39 97.76 44.34 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 116.197 -0.456 . . . . 2.05 110.284 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -75.12 79.4 2.7 Favored 'Trans proline' 0 CA--C 1.528 0.213 0 C-N-CA 122.9 2.4 . . . . 0.89 112.197 -178.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 4.0 mmt -119.25 151.57 38.17 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.281 0.562 . . . . 0.82 110.755 -177.326 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.618 ' OD1' ' HA ' ' A' ' 62' ' ' PRO . 3.2 p-10 -132.64 -112.84 0.23 Allowed 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 114.885 -1.052 . . . . 1.42 109.485 -174.094 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.6 ttm -131.66 -21.89 2.45 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 122.141 -0.349 . . . . 0.8 110.639 175.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -81.95 -33.08 27.74 Favored Glycine 0 N--CA 1.442 -0.902 0 N-CA-C 110.322 -1.111 . . . . 0.32 110.322 179.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -70.02 -35.08 74.07 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-O 121.134 0.492 . . . . 0.95 110.113 175.358 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.4 mm -56.28 -61.37 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.257 -0.883 . . . . 0.97 110.044 175.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.554 ' O ' ' HG3' ' A' ' 91' ' ' GLU . 0.3 OUTLIER -62.09 -28.68 69.79 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.428 -0.806 . . . . 1.15 111.609 -179.292 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 65.1 tttt -63.76 -42.65 97.78 Favored 'General case' 0 C--O 1.226 -0.154 0 C-N-CA 120.675 -0.41 . . . . 2.46 110.411 -179.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 6.5 mtm-85 -74.45 -24.27 59.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.93 0.395 . . . . 1.16 110.755 -177.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.481 HD11 ' SD ' ' A' ' 42' ' ' MET . 3.2 mt -75.32 -53.46 8.72 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.787 -0.642 . . . . 0.49 110.645 177.286 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.554 ' HG3' ' O ' ' A' ' 87' ' ' LYS . 13.2 mt-10 -69.56 -37.1 76.87 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.957 -0.565 . . . . 1.39 110.948 -176.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -78.55 -11.03 59.94 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.393 -0.367 . . . . 1.3 110.824 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 63.01 69.06 0.6 Allowed 'General case' 0 N--CA 1.462 0.172 0 O-C-N 123.844 0.715 . . . . 1.75 111.427 176.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 11.4 t80 -80.1 -47.32 14.99 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.818 -0.628 . . . . 0.96 111.145 179.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -117.42 -174.23 2.57 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.958 0.408 . . . . 1.28 110.999 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . 0.498 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 1.9 t-105 -67.07 -68.4 0.38 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.368 -0.833 . . . . 1.05 112.005 -175.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 75.3 m -121.2 168.18 11.88 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.002 -0.545 . . . . 1.0 111.582 -171.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.827 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -68.32 -16.87 64.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.763 -0.653 . . . . 0.66 111.352 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . 0.462 ' O ' ' HB2' ' A' ' 102' ' ' MET . 0.3 OUTLIER -61.15 -26.37 67.64 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.265 -0.425 . . . . 0.85 110.993 179.409 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -38.65 64.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.208 0.528 . . . . 2.44 110.147 176.595 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.422 ' HB3' ' HE1' ' A' ' 42' ' ' MET . 0.0 OUTLIER -69.47 -21.52 63.7 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.488 -0.778 . . . . 0.95 110.367 179.679 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.805 ' HE1' HG22 ' A' ' 137' ' ' VAL . 8.5 mmt -57.23 -33.26 67.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.021 -0.536 . . . . 1.13 110.131 175.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.414 HE21 ' HB3' ' A' ' 103' ' ' GLN . 0.3 OUTLIER -72.52 -39.66 67.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.494 -0.776 . . . . 2.96 110.039 178.945 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -70.68 -38.06 73.71 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.856 -0.611 . . . . 1.87 110.323 -178.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.608 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -57.47 -48.53 78.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.661 -0.699 . . . . 0.38 109.919 174.26 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -59.69 -41.15 90.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.716 -0.674 . . . . 0.97 110.106 176.126 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 86.5 m -58.33 -45.97 87.11 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.672 -0.695 . . . . 0.43 111.455 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -54.47 -47.18 73.26 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.001 0.429 . . . . 0.88 110.738 176.092 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -66.19 -40.95 90.79 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.813 -0.631 . . . . 0.29 111.23 -177.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.82 -43.07 80.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.742 0.306 . . . . 0.66 110.247 178.457 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -49.85 -48.56 51.04 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.651 -0.704 . . . . 1.84 110.669 176.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . 0.428 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 1.5 t -62.48 -41.05 98.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.186 -0.461 . . . . 0.63 110.859 178.351 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . 0.452 ' HD1' HG22 ' A' ' 123' ' ' VAL . 12.1 m-85 -70.79 -27.11 63.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.413 -0.358 . . . . 0.81 111.625 -177.61 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 59.4 mt -85.22 -50.15 14.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 120.779 0.323 . . . . 0.55 111.395 -177.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . 0.502 ' CE1' HD13 ' A' ' 76' ' ' ILE . 1.1 t80 -86.25 36.25 0.68 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.416 0.627 . . . . 1.22 111.738 -174.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . 0.428 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 51.6 m-80 -157.59 -172.85 4.13 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.142 -0.936 . . . . 1.04 109.703 -179.078 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 2.5 mttp -96.39 150.06 36.64 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 109.539 -0.541 . . . . 3.47 109.539 174.276 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -59.68 -19.97 55.96 Favored 'Trans proline' 0 N--CA 1.475 0.389 0 C-N-CA 122.564 2.176 . . . . 0.96 112.798 -179.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -118.67 30.7 7.05 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.913 -0.585 . . . . 1.23 110.618 177.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . 0.429 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 1.5 t0 -84.24 173.36 11.06 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.055 0.455 . . . . 1.34 111.886 -175.425 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -67.23 -56.66 8.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.267 -0.879 . . . . 1.44 111.736 -173.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . 0.437 ' O ' HG13 ' A' ' 122' ' ' ILE . 1.0 OUTLIER -69.17 -29.37 42.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.978 0.418 . . . . 0.42 110.542 -179.546 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.452 HG22 ' HD1' ' A' ' 113' ' ' TYR . 2.1 t -64.44 -43.62 96.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.268 -0.424 . . . . 0.35 110.178 177.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.0 mt -56.28 -35.69 67.76 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 115.628 -0.715 . . . . 0.52 109.817 176.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . 0.467 ' O ' HD13 ' A' ' 129' ' ' LEU . 30.7 mtt -73.38 -43.81 59.85 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.015 -0.993 . . . . 0.62 110.654 -178.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -55.1 -36.57 65.83 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.831 0.348 . . . . 0.31 111.048 178.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.53 -44.36 97.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.865 -0.607 . . . . 1.94 111.211 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.44 -35.29 60.96 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.082 0.468 . . . . 0.32 110.474 178.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.467 HD13 ' O ' ' A' ' 125' ' ' MET . 1.8 mp -62.27 -44.98 95.3 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.532 -0.758 . . . . 0.33 110.914 179.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -70.8 -22.28 62.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.48 -0.327 . . . . 1.47 111.727 -176.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 37.2 mttm -70.34 -41.73 72.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.812 0.339 . . . . 2.24 110.126 -177.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 129' ' ' LEU . 1.6 pt -79.88 -21.24 12.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.401 -0.363 . . . . 1.23 110.332 176.221 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.559 ' O ' HG23 ' A' ' 137' ' ' VAL . 25.1 t80 -61.58 -61.79 2.27 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.224 -0.444 . . . . 0.46 110.258 173.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.4 pp -64.38 -25.29 67.96 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 121.028 0.442 . . . . 0.64 110.462 -177.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.459 ' HB2' ' HA ' ' A' ' 132' ' ' ILE . 0.0 OUTLIER -55.75 -47.71 76.5 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.395 -0.82 . . . . 1.61 111.117 176.373 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . 0.691 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -82.44 -24.27 34.38 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.939 -0.573 . . . . 1.52 110.786 -178.112 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.805 HG22 ' HE1' ' A' ' 102' ' ' MET . 95.6 t -66.61 -35.87 75.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 121.299 0.571 . . . . 0.35 110.066 176.46 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.97 -17.58 64.48 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.808 -0.633 . . . . 0.5 110.606 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -101.82 3.82 39.73 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.969 -0.559 . . . . 1.76 110.811 178.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . 0.472 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 24.0 mtp -72.84 146.07 87.45 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.343 -0.39 . . . . 0.86 109.973 175.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -68.1 116.29 4.25 Favored 'Trans proline' 0 N--CA 1.464 -0.255 0 C-N-CA 122.409 2.073 . . . . 0.67 112.291 -178.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -78.01 15.05 0.96 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.273 0.559 . . . . 2.91 110.615 177.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -99.74 -47.82 4.93 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-N 115.731 -0.668 . . . . 2.7 110.186 -178.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 61.99 89.13 0.08 Allowed 'General case' 0 C--O 1.237 0.395 0 CA-C-N 115.015 -0.993 . . . . 2.34 110.41 -174.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . 0.572 ' O ' ' HB3' ' A' ' 37' ' ' ASN . 2.8 t -104.4 115.3 46.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.461 -0.791 . . . . 0.99 109.654 178.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.695 ' HG3' HG22 ' A' ' 36' ' ' THR . 3.8 tt0 -68.4 147.15 52.48 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.546 -0.297 . . . . 1.53 110.887 -177.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 12.1 mt . . . . . 0 C--O 1.248 0.989 0 CA-C-O 118.186 -0.912 . . . . 1.57 110.922 -177.705 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.2 p . . . . . 0 N--CA 1.45 -0.431 0 CA-C-O 121.347 0.594 . . . . 0.93 109.956 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.6 m -165.78 147.59 7.21 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.31 -0.859 . . . . 1.61 109.415 179.288 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.524 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 23.0 t-20 -148.83 125.99 5.53 Favored Pre-proline 0 C--N 1.317 -0.824 0 CA-C-N 115.972 -0.558 . . . . 1.6 109.605 177.789 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -66.44 -43.32 8.23 Favored 'Trans proline' 0 N--CA 1.474 0.374 0 C-N-CA 123.375 2.717 . . . . 1.87 113.282 -175.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.0 m -75.4 -26.53 58.5 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-O 121.451 0.643 . . . . 2.18 110.468 -176.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.524 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 11.1 tttm -82.77 121.93 77.99 Favored Pre-proline 0 C--N 1.318 -0.775 0 CA-C-N 115.179 -0.918 . . . . 2.75 109.985 178.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.466 ' HB2' ' CZ3' ' A' ' 96' ' ' TRP . 23.1 Cg_endo -64.96 132.33 31.86 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.027 1.818 . . . . 1.38 112.116 -179.898 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -138.38 77.7 0.33 Allowed Glycine 0 N--CA 1.445 -0.707 0 CA-C-N 115.119 -0.946 . . . . 0.97 110.947 -178.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -85.98 148.96 25.51 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.02 0.438 . . . . 1.93 111.08 -173.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.79 102.56 14.78 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.955 -0.566 . . . . 2.64 110.045 176.274 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.587 HG22 ' HG3' ' A' ' 146' ' ' GLU . 1.3 p -110.51 167.23 10.37 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.911 0.386 . . . . 0.68 111.004 176.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.415 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 62.3 t30 -63.12 -39.92 96.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.806 -0.634 . . . . 1.47 111.264 -179.096 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.404 ' O ' ' HB3' ' A' ' 41' ' ' TYR . 9.2 tt0 -64.6 -42.86 95.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.559 -0.291 . . . . 1.04 110.521 178.262 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.479 ' O ' ' HG2' ' A' ' 43' ' ' GLN . 0.5 OUTLIER -59.01 -52.31 66.3 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.272 -0.422 . . . . 0.8 110.641 -179.754 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.442 ' O ' ' HG3' ' A' ' 43' ' ' GLN . 1.4 mt-30 -70.1 -19.98 63.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.04 -0.527 . . . . 1.75 111.186 -179.586 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.415 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 57.2 t80 -64.83 -63.34 1.14 Allowed 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.966 -0.561 . . . . 0.64 111.307 178.299 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.54 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -58.84 -34.84 72.02 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 111.879 0.326 . . . . 1.13 111.879 -170.922 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' A' ' 39' ' ' LEU . 0.5 OUTLIER -63.81 -49.59 72.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.208 0.528 . . . . 1.3 110.398 -176.192 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -85.46 -29.89 23.95 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.894 -0.594 . . . . 0.5 111.943 -177.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 87.8 t -89.37 -58.54 3.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 112.491 0.552 . . . . 0.3 112.491 -177.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.603 HG22 ' HB3' ' A' ' 136' ' ' LYS . 43.8 t -78.4 -66.06 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 120.645 0.26 . . . . 0.26 111.305 -172.055 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.491 HG13 ' O ' ' A' ' 42' ' ' MET . 2.0 m -64.17 -33.75 64.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.366 -0.379 . . . . 0.83 111.8 -173.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.5 mttp -69.5 -31.98 70.57 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.848 -0.341 . . . . 2.4 111.467 -178.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.1 m -77.22 -38.57 51.0 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.785 -0.366 . . . . 0.55 110.386 177.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.666 HD23 HD12 ' A' ' 132' ' ' ILE . 0.0 OUTLIER -64.43 -35.72 81.84 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 109.409 -0.589 . . . . 0.33 109.409 175.132 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 13.7 t-105 -62.79 -34.2 76.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.635 -0.711 . . . . 0.39 111.209 178.049 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.5 mttt -84.28 5.68 25.79 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.944 -0.302 . . . . 2.24 111.763 -175.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.481 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 14.3 t-80 -84.96 134.17 34.25 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.57 -0.53 . . . . 0.39 109.57 175.379 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -85.19 12.41 7.99 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.827 0.346 . . . . 1.91 111.829 -173.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.481 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.6 OUTLIER -111.97 -1.08 15.54 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.338 0.59 . . . . 0.93 109.42 172.364 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.65 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -100.9 20.21 15.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.647 -0.706 . . . . 0.28 110.534 179.45 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.559 ' CG ' ' HD3' ' A' ' 58' ' ' PRO . 40.5 p-90 -73.13 -35.41 2.76 Favored Pre-proline 0 CA--C 1.541 0.623 0 N-CA-C 113.025 0.75 . . . . 0.58 113.025 -175.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.559 ' HD3' ' CG ' ' A' ' 57' ' ' TRP . 2.9 Cg_exo -75.82 -1.13 11.01 Favored 'Trans proline' 0 C--N 1.361 1.208 0 C-N-CA 121.475 1.45 . . . . 0.47 110.703 174.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -102.98 -7.95 21.03 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 114.778 -1.101 . . . . 1.11 110.537 -178.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 9.0 m-30 -65.35 -50.67 64.71 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.947 -0.57 . . . . 0.63 111.365 -176.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.15 127.33 64.61 Favored Pre-proline 0 C--N 1.32 -0.686 0 CA-C-N 115.425 -0.807 . . . . 1.63 110.549 -174.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.61 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 37.8 Cg_endo -67.94 150.07 77.93 Favored 'Trans proline' 0 C--O 1.237 0.469 0 C-N-CA 122.766 2.311 . . . . 0.87 112.799 -177.355 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 4.0 t -72.02 97.97 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 122.19 0.995 . . . . 0.88 109.958 175.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -109.44 13.47 24.08 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.524 -1.217 . . . . 1.85 109.385 176.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.506 ' HB2' ' NE2' ' A' ' 74' ' ' HIS . . . 65.71 -73.77 0.06 Allowed 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 114.791 -1.095 . . . . 1.29 111.453 -175.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.5 mt -65.5 -39.91 86.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 120.8 0.333 . . . . 1.89 111.282 -174.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.1 -29.1 68.37 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.021 -0.536 . . . . 2.99 112.176 -177.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.446 HD13 ' HA ' ' A' ' 68' ' ' LEU . 0.2 OUTLIER -120.18 7.11 10.75 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.941 -0.304 . . . . 1.66 111.785 -176.47 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 66.1 t30 61.84 48.82 5.14 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.292 0.568 . . . . 1.74 111.04 -179.428 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 5.3 mt -126.04 71.4 69.18 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.047 -0.524 . . . . 1.61 111.673 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -75.7 -27.62 8.76 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 121.928 1.752 . . . . 1.3 111.83 176.183 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.0 -4.97 59.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.257 -0.429 . . . . 1.97 110.882 -179.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -59.53 -49.6 77.16 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.805 -0.634 . . . . 1.13 110.494 179.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . 0.557 ' HD1' ' HG3' ' A' ' 80' ' ' PRO . 72.1 m-70 -77.98 8.28 4.93 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.51 -0.768 . . . . 0.91 111.457 -175.311 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 24.3 mttt -99.3 -19.96 16.79 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.453 0.644 . . . . 2.86 109.595 177.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.0 mt -114.93 -50.31 4.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.731 -0.668 . . . . 1.0 109.99 177.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 24.0 mm -95.48 103.38 14.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.826 -0.625 . . . . 0.75 109.767 179.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.0 mttt -83.08 -11.78 57.7 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.954 -0.567 . . . . 1.99 110.48 -178.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 16.1 m-80 -123.93 73.05 55.0 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.67 -0.696 . . . . 2.05 109.756 174.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.557 ' HG3' ' HD1' ' A' ' 74' ' ' HIS . 73.4 Cg_endo -80.76 102.15 1.36 Allowed 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.534 2.156 . . . . 0.89 112.759 -175.053 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.5 mmt -130.64 152.93 49.47 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.953 -0.567 . . . . 0.82 110.292 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.61 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 1.1 p30 -139.36 -116.23 0.14 Allowed 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.061 -0.972 . . . . 1.42 109.607 -174.603 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -125.22 -27.09 3.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.053 0.454 . . . . 0.8 110.189 177.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.505 ' O ' ' HG3' ' A' ' 88' ' ' LYS . . . -84.28 -31.75 24.55 Favored Glycine 0 N--CA 1.441 -0.999 0 N-CA-C 110.799 -0.92 . . . . 0.32 110.799 -177.712 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -70.51 -40.85 73.29 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.928 0.394 . . . . 0.95 110.503 177.264 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.542 HG23 ' SG ' ' A' ' 101' ' ' CYS . 34.7 mt -63.81 -42.51 96.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.657 -0.701 . . . . 0.97 109.938 176.047 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.87 -33.14 72.62 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.034 -0.53 . . . . 1.15 111.147 178.081 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' A' ' 84' ' ' GLY . 35.8 mttt -62.09 -50.48 71.76 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-O 121.115 0.483 . . . . 2.46 110.628 179.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 16.3 mtp180 -69.69 -32.93 71.81 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.676 -0.693 . . . . 1.16 111.415 -176.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 8.7 mt -66.53 -54.34 24.89 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.175 -0.466 . . . . 0.49 111.316 -179.556 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -69.59 -23.33 63.52 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.258 -0.428 . . . . 1.39 111.642 -175.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.424 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 0.5 OUTLIER -89.37 -2.46 58.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.653 -0.249 . . . . 1.3 110.895 -179.01 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 59.73 54.41 4.43 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.242 0.544 . . . . 1.75 111.164 -179.345 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -80.35 -27.33 38.32 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.056 -0.52 . . . . 0.96 110.54 178.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.655 ' CD1' ' HB3' ' A' ' 100' ' ' GLU . 8.2 m-85 -96.88 178.32 5.33 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-O 121.844 0.831 . . . . 1.28 111.432 -178.496 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . 0.466 ' CZ3' ' HB2' ' A' ' 32' ' ' PRO . 2.2 t-105 -94.19 -56.12 2.95 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 113.703 -1.589 . . . . 1.05 108.872 170.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 67.3 m -129.19 167.98 16.83 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 114.919 -1.037 . . . . 1.0 109.597 -177.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -70.79 -12.29 61.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.774 0.321 . . . . 0.66 111.647 -177.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -21.49 66.31 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.068 -0.515 . . . . 0.85 110.591 177.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.655 ' HB3' ' CD1' ' A' ' 95' ' ' TYR . 2.0 tt0 -77.03 -33.22 57.41 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.054 -0.521 . . . . 2.44 109.922 179.445 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.542 ' SG ' HG23 ' A' ' 86' ' ' ILE . 0.1 OUTLIER -75.81 -22.08 56.7 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.383 -0.826 . . . . 0.95 110.724 -177.446 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 5.0 ttm -59.01 -30.95 68.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.084 -0.507 . . . . 1.13 110.454 178.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.07 -43.26 74.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.674 -0.694 . . . . 2.96 110.115 178.071 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -67.87 -43.39 79.51 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.756 -0.656 . . . . 1.87 110.82 -177.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.549 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.7 OUTLIER -60.42 -44.4 95.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.101 -0.5 . . . . 0.38 110.445 178.055 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 39.4 t30 -60.7 -39.64 89.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.048 -0.524 . . . . 0.97 110.301 177.438 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 85.3 m -68.53 -44.16 75.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.563 -0.744 . . . . 0.43 111.463 179.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.09 -44.09 70.91 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.174 -0.466 . . . . 0.88 111.08 178.29 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -70.3 -43.83 69.57 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.12 -0.491 . . . . 0.29 111.026 -177.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -66.33 -37.26 84.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.813 0.34 . . . . 0.66 110.665 -178.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -50.27 -51.58 43.59 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.481 -0.781 . . . . 1.84 110.901 176.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 2.0 t -60.86 -36.43 79.13 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.548 -0.296 . . . . 0.63 111.194 178.121 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -69.79 -27.65 65.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.434 -0.348 . . . . 0.81 111.536 -177.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 29.0 mt -92.13 -51.05 12.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.923 0.392 . . . . 0.55 111.618 -176.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -67.39 -38.25 84.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.28 0.562 . . . . 1.22 110.726 -177.152 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 38.8 m-20 -101.7 -172.12 2.1 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.88 -0.6 . . . . 1.04 109.669 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.31 147.28 51.82 Favored Pre-proline 0 C--N 1.32 -0.681 0 N-CA-C 110.213 -0.292 . . . . 3.47 110.213 -179.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . 0.821 ' HA ' HG11 ' A' ' 123' ' ' VAL . 52.0 Cg_exo -57.7 -20.13 41.29 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 123.013 2.475 . . . . 0.96 112.86 -179.452 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.0 21.11 2.83 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.802 -0.635 . . . . 1.23 111.687 -179.711 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -118.5 165.73 13.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.166 0.508 . . . . 1.34 111.763 177.658 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -67.49 -36.25 80.74 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.052 -0.976 . . . . 1.44 110.588 -179.683 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.1 tp -61.03 -40.56 86.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 CA-C-N 116.491 -0.322 . . . . 0.42 111.312 -177.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.821 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.2 t -70.18 -39.6 77.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 C-N-CA 120.57 -0.452 . . . . 0.35 110.011 177.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.0 -35.34 74.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.857 -0.61 . . . . 0.52 109.409 178.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . 0.43 ' O ' HD13 ' A' ' 129' ' ' LEU . 38.0 mtt -68.67 -50.46 50.91 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.038 -0.983 . . . . 0.62 110.613 176.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -55.05 -38.57 68.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.361 -0.381 . . . . 0.31 111.106 179.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -60.35 -41.05 92.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.895 -0.593 . . . . 1.94 111.193 178.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -77.93 -39.17 43.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.997 0.427 . . . . 0.32 110.505 179.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.65 HD21 ' HA ' ' A' ' 56' ' ' ALA . 1.9 mp -58.99 -40.56 85.21 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.605 -0.725 . . . . 0.33 110.444 179.02 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -57.64 -29.71 64.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.294 -0.866 . . . . 1.47 111.996 -178.033 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.506 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -63.29 -39.34 94.32 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.829 0.347 . . . . 2.24 110.328 -176.778 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.666 HD12 HD23 ' A' ' 50' ' ' LEU . 11.1 mt -70.07 -28.31 35.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.981 -0.554 . . . . 1.23 110.851 -178.519 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.428 ' O ' HG23 ' A' ' 137' ' ' VAL . 26.9 t80 -62.48 -63.06 1.34 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.118 -0.492 . . . . 0.46 110.779 -179.374 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . 0.445 ' HG ' ' H ' ' A' ' 134' ' ' LEU . 0.0 OUTLIER -65.46 -26.53 67.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.172 0.511 . . . . 0.64 110.422 -179.102 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.506 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.94 -41.96 97.28 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.538 -0.756 . . . . 1.61 111.281 179.353 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . 0.603 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -92.82 -24.91 18.35 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.246 -0.434 . . . . 1.52 110.897 -177.41 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 133' ' ' PHE . 37.1 t -70.73 -33.64 53.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.316 -0.402 . . . . 0.35 110.833 -179.749 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -69.3 -12.55 61.76 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.13 0.491 . . . . 0.5 110.759 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -103.98 0.0 29.43 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.999 -0.546 . . . . 1.76 110.695 178.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . 0.408 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 0.0 OUTLIER -59.89 146.84 80.88 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.109 -0.496 . . . . 0.86 110.812 178.465 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -74.47 94.61 0.92 Allowed 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 121.985 1.79 . . . . 0.67 111.034 178.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 8.9 mm-40 -84.77 31.86 0.53 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.456 0.646 . . . . 2.91 111.26 -175.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -116.41 -35.67 4.22 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 114.901 -1.045 . . . . 2.7 108.508 173.445 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 74.18 138.37 0.06 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 113.882 -1.508 . . . . 2.34 111.468 177.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 45.3 t -144.32 102.27 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.185 -0.916 . . . . 0.99 109.831 -177.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.587 ' HG3' HG22 ' A' ' 36' ' ' THR . 1.0 OUTLIER -67.15 138.29 56.92 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.665 -0.495 . . . . 1.53 109.665 176.576 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 6.5 mt . . . . . 0 C--O 1.251 1.135 0 CA-C-O 118.524 -0.75 . . . . 1.57 110.745 -176.786 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.2 p . . . . . 0 N--CA 1.453 -0.279 0 CA-C-O 121.671 0.748 . . . . 0.93 108.991 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 54.0 m -167.42 146.55 5.02 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.425 -1.261 . . . . 1.61 108.745 178.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.528 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 18.4 t-20 -135.49 129.72 18.69 Favored Pre-proline 0 C--N 1.317 -0.82 0 N-CA-C 108.879 -0.785 . . . . 1.6 108.879 176.709 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -59.79 -48.5 12.55 Favored 'Trans proline' 0 N--CA 1.472 0.264 0 C-N-CA 123.368 2.712 . . . . 1.87 113.361 -174.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.7 m -81.83 -28.31 33.16 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.854 0.359 . . . . 2.18 111.337 -174.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.528 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 0.4 OUTLIER -77.38 116.58 58.95 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.106 -0.497 . . . . 2.75 110.387 178.708 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.473 ' HB2' ' CZ3' ' A' ' 96' ' ' TRP . 6.8 Cg_exo -71.53 151.51 58.97 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.224 1.949 . . . . 1.38 112.18 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -148.66 77.69 0.23 Allowed Glycine 0 N--CA 1.444 -0.793 0 CA-C-N 115.345 -0.843 . . . . 0.97 111.111 178.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.3 mtm-85 -80.32 132.77 35.86 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.699 0.285 . . . . 1.93 110.247 -177.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -72.1 109.97 6.25 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.211 -0.449 . . . . 2.64 110.285 -177.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.963 HG22 ' HG3' ' A' ' 146' ' ' GLU . 5.3 p -107.81 166.86 10.38 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.661 -0.416 . . . . 0.68 110.513 177.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -60.26 -43.92 95.73 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 116.22 -0.446 . . . . 1.47 110.739 -179.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -58.53 -40.19 82.27 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.658 0.266 . . . . 1.04 110.973 -179.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.43 ' HB2' ' HA ' ' A' ' 97' ' ' SER . 0.6 OUTLIER -62.62 -57.57 10.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.081 -0.509 . . . . 0.8 110.956 -179.164 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -65.85 -29.61 70.1 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 115.986 -0.552 . . . . 1.75 110.848 -179.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 53.0 t80 -59.04 -63.89 1.14 Allowed 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.904 -0.589 . . . . 0.64 110.48 177.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.566 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -58.73 -33.77 70.6 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 121.124 -0.23 . . . . 1.13 110.755 -174.896 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -57.57 -55.38 35.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.006 0.431 . . . . 1.3 110.885 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 51.3 m-80 -85.99 -29.93 23.12 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.067 -0.515 . . . . 0.5 111.805 -176.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 99.1 t -88.4 -56.89 4.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 N-CA-C 112.284 0.476 . . . . 0.3 112.284 -174.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.704 HG22 ' HB3' ' A' ' 136' ' ' LYS . 41.5 t -82.22 -66.57 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 111.814 0.301 . . . . 0.26 111.814 -172.096 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.447 HG13 ' O ' ' A' ' 42' ' ' MET . 1.3 m -63.37 -34.62 68.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 N-CA-C 111.604 0.224 . . . . 0.83 111.604 -173.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.35 -36.26 81.04 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.752 -0.379 . . . . 2.4 111.496 -179.301 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.4 m -76.06 -36.77 58.89 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.782 -0.367 . . . . 0.55 110.467 177.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.601 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -62.13 -42.48 99.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.29 0.566 . . . . 0.33 109.547 174.451 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 22.1 t-105 -55.91 -36.14 67.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.984 -1.007 . . . . 0.39 111.292 178.215 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 9.8 mmtp -90.57 22.02 3.68 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 112.445 0.535 . . . . 2.24 112.445 -172.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 34.3 t-80 -88.57 148.25 24.19 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 110.077 -0.342 . . . . 0.39 110.077 174.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -73.25 -16.15 61.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.315 -0.402 . . . . 1.91 111.931 -175.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 19.1 m-30 -106.72 3.24 26.44 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.924 0.392 . . . . 0.93 110.764 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.664 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -92.43 5.45 50.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.136 0.493 . . . . 0.28 111.003 -178.143 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.525 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 56.3 p-90 -63.84 -36.0 18.94 Favored Pre-proline 0 CA--C 1.548 0.897 0 N-CA-C 114.214 1.19 . . . . 0.58 114.214 -173.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.525 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 19.4 Cg_endo -79.99 -9.6 14.18 Favored 'Trans proline' 0 C--N 1.359 1.097 0 CA-C-N 121.407 1.538 . . . . 0.47 112.289 -178.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -98.19 9.09 43.77 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.058 -0.519 . . . . 1.11 110.347 -179.349 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 5.3 m-30 -70.96 -37.37 72.78 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.751 -0.659 . . . . 0.63 111.36 -178.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -101.95 134.36 20.15 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.898 -0.592 . . . . 1.63 110.846 -172.497 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.65 ' HA ' ' OD1' ' A' ' 82' ' ' ASP . 34.8 Cg_exo -57.62 147.73 77.7 Favored 'Trans proline' 0 C--O 1.239 0.54 0 C-N-CA 122.674 2.249 . . . . 0.87 112.099 176.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 3.8 t -68.19 106.67 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 121.785 0.802 . . . . 0.88 111.307 -178.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -114.92 130.19 56.86 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.716 -1.129 . . . . 1.85 108.071 168.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.17 -2.17 14.97 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 112.265 0.468 . . . . 1.29 112.265 -171.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 12.1 mt -113.74 -52.0 5.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.495 0.188 . . . . 1.89 111.012 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.6 tttp -59.37 -51.06 71.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.929 0.395 . . . . 2.99 111.211 -179.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.25 -7.83 50.12 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.25 -0.432 . . . . 1.66 110.298 179.252 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 56.51 63.26 2.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.267 -0.879 . . . . 1.74 110.667 -176.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.425 HD12 ' HA ' ' A' ' 70' ' ' LEU . 0.3 OUTLIER -114.62 72.02 2.56 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 115.542 -0.754 . . . . 1.61 109.804 178.315 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -77.85 -51.09 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.467 2.111 . . . . 1.3 112.979 -173.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -72.87 -13.07 61.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.369 0.604 . . . . 1.97 110.538 -178.244 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -58.98 -39.99 83.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.084 -0.962 . . . . 1.13 110.899 178.529 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -75.27 -2.42 28.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.691 -0.686 . . . . 0.91 111.755 -175.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -104.59 -53.59 2.67 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.072 0.463 . . . . 2.86 110.443 -177.265 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.1 mp -76.55 -38.82 32.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.733 -0.667 . . . . 1.0 110.752 -177.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.474 HD11 ' HB2' ' A' ' 115' ' ' TYR . 47.8 mm -94.51 125.77 47.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 109.941 -0.392 . . . . 0.75 109.941 179.355 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.68 -28.24 33.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.278 -0.419 . . . . 1.99 111.128 -175.39 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 18.9 m-80 -132.83 81.07 59.38 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.433 -0.349 . . . . 2.05 110.431 178.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -68.65 95.34 0.46 Allowed 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 123.028 2.485 . . . . 0.89 111.863 179.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 5.8 mmt -127.46 160.82 30.31 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-O 121.39 0.614 . . . . 0.82 110.313 -178.364 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.65 ' OD1' ' HA ' ' A' ' 62' ' ' PRO . 2.5 p-10 -136.62 -134.27 0.14 Allowed 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 114.65 -1.159 . . . . 1.42 109.61 -170.472 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -123.36 -14.75 7.35 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.172 0.511 . . . . 0.8 109.849 -177.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -89.54 -32.39 10.34 Favored Glycine 0 N--CA 1.442 -0.916 0 N-CA-C 109.65 -1.38 . . . . 0.32 109.65 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 94.5 m -67.19 -42.33 84.36 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 114.916 -0.642 . . . . 0.95 110.823 174.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 43.4 mt -62.22 -45.79 97.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.031 0.443 . . . . 0.97 110.116 177.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.491 ' HG3' ' N ' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -64.81 -31.66 72.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.133 -0.485 . . . . 1.15 110.712 178.316 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.491 ' N ' ' HG3' ' A' ' 87' ' ' LYS . 16.5 tttp -63.62 -43.31 97.21 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 121.278 0.561 . . . . 2.46 110.755 179.232 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 10.2 mtp180 -76.22 -31.03 58.17 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.812 -0.631 . . . . 1.16 111.1 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 4.5 mt -64.8 -51.46 62.05 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.028 -0.533 . . . . 0.49 111.011 177.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -66.83 -31.25 71.74 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.873 -0.603 . . . . 1.39 111.597 -177.109 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -92.68 5.08 52.35 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.923 -0.311 . . . . 1.3 111.455 -177.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 60.41 55.13 3.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.906 -0.588 . . . . 1.75 111.8 175.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -82.08 -22.39 36.32 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.338 0.59 . . . . 0.96 110.133 175.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . 0.6 ' CD1' ' HB3' ' A' ' 100' ' ' GLU . 46.5 m-85 -99.02 169.52 9.36 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.723 0.773 . . . . 1.28 112.151 -174.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . 0.473 ' CZ3' ' HB2' ' A' ' 32' ' ' PRO . 2.0 t90 -96.72 -38.1 10.04 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-N 113.994 -1.457 . . . . 1.05 108.688 169.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.43 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 8.6 t -155.88 168.54 26.88 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 115.544 -0.753 . . . . 1.0 110.166 -175.711 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -72.67 -9.4 58.58 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.481 -0.327 . . . . 0.66 111.634 -175.322 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.15 -21.76 65.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.1 0.476 . . . . 0.85 109.89 175.094 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.6 ' HB3' ' CD1' ' A' ' 95' ' ' TYR . 1.0 OUTLIER -78.16 -42.57 31.27 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.757 -0.831 . . . . 2.44 108.757 175.341 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 29.9 m -61.91 -34.84 76.79 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.054 -0.975 . . . . 0.95 110.627 177.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 3.2 ttm -58.35 -35.27 71.68 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.604 -0.725 . . . . 1.13 110.582 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -70.73 -41.21 72.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.884 -0.598 . . . . 2.96 110.123 179.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -68.83 -43.73 74.91 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.753 -0.658 . . . . 1.87 110.47 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.601 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.6 OUTLIER -58.31 -46.04 86.89 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.026 -0.534 . . . . 0.38 110.058 176.421 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 14.6 t30 -56.71 -45.25 81.98 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.682 -0.69 . . . . 0.97 110.018 176.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 91.4 m -64.77 -45.99 84.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.974 -0.557 . . . . 0.43 111.504 179.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.06 -42.68 77.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.85 0.357 . . . . 0.88 110.66 178.233 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -72.89 -50.31 24.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.021 -0.536 . . . . 0.29 110.526 -178.013 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . 0.41 ' O ' HG13 ' A' ' 114' ' ' ILE . 5.0 p -59.86 -35.98 75.91 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 116.373 -0.376 . . . . 0.66 111.047 -178.175 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -52.65 -42.9 65.1 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.136 -0.484 . . . . 1.84 110.679 178.571 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . 0.611 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 0.0 OUTLIER -73.81 -26.9 60.85 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.869 -0.605 . . . . 0.63 110.875 -179.207 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -85.47 -15.87 41.49 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.862 0.363 . . . . 0.81 111.194 -179.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . 0.41 HG13 ' O ' ' A' ' 110' ' ' THR . 70.0 mt -89.19 -57.66 4.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.211 -0.45 . . . . 0.55 110.744 178.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . 0.474 ' HB2' HD11 ' A' ' 77' ' ' ILE . 45.4 t80 -67.55 -51.59 48.87 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.853 -0.612 . . . . 1.22 110.563 -176.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . 0.611 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 28.6 m120 -79.59 176.3 9.83 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.592 -0.731 . . . . 1.04 110.707 -178.194 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . 0.422 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 0.0 OUTLIER -101.1 153.24 37.87 Favored Pre-proline 0 C--N 1.321 -0.654 0 N-CA-C 109.329 -0.619 . . . . 3.47 109.329 177.786 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . 0.583 ' HA ' HG11 ' A' ' 123' ' ' VAL . 28.7 Cg_endo -64.44 2.74 1.06 Allowed 'Trans proline' 0 CA--C 1.535 0.548 0 C-N-CA 122.584 2.189 . . . . 0.96 112.686 178.168 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.31 5.03 13.51 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.165 -0.47 . . . . 1.23 110.609 177.299 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . 0.422 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 0.9 OUTLIER -75.5 164.08 26.73 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.215 0.531 . . . . 1.34 111.923 -173.407 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.7 -55.52 22.74 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.994 -1.003 . . . . 1.44 110.603 -178.134 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . 0.406 ' H ' HG22 ' A' ' 122' ' ' ILE . 0.9 OUTLIER -62.78 -34.48 65.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.569 -0.741 . . . . 0.42 111.114 -179.627 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.583 HG11 ' HA ' ' A' ' 118' ' ' PRO . 1.5 t -64.75 -40.07 87.8 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-O 121.004 0.431 . . . . 0.35 110.312 178.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.1 -29.39 68.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.292 0.567 . . . . 0.52 110.055 176.736 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . 0.44 ' O ' HD13 ' A' ' 129' ' ' LEU . 10.4 mtt -80.4 -48.04 13.5 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.591 -0.731 . . . . 0.62 110.438 178.563 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -53.91 -39.08 65.5 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.151 -0.477 . . . . 0.31 111.387 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -56.72 -42.87 79.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.31 -0.405 . . . . 1.94 111.301 178.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.99 -41.79 50.17 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.023 -0.535 . . . . 0.32 110.95 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.664 HD21 ' HA ' ' A' ' 56' ' ' ALA . 8.5 mp -57.88 -44.51 86.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.649 -0.705 . . . . 0.33 110.41 177.636 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -57.78 -26.96 62.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.116 -0.947 . . . . 1.47 111.902 -177.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.452 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -68.24 -41.46 81.16 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.648 -0.251 . . . . 2.24 110.479 -176.878 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 15.5 mt -69.24 -31.99 51.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.884 0.373 . . . . 1.23 110.17 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.413 ' O ' HG23 ' A' ' 137' ' ' VAL . 39.4 t80 -60.28 -61.94 2.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.776 -0.647 . . . . 0.46 110.599 178.347 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.8 pp -64.87 -28.12 69.33 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.907 0.384 . . . . 0.64 110.638 -177.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.452 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.7 OUTLIER -59.73 -56.58 20.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.688 -0.687 . . . . 1.61 110.778 178.726 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . 0.704 ' HB3' HG22 ' A' ' 46' ' ' VAL . 1.2 mptp? -76.75 -20.46 56.46 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.768 -0.651 . . . . 1.52 111.138 -176.793 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.513 ' HA ' ' HG3' ' A' ' 140' ' ' MET . 23.1 t -73.97 -32.27 32.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.848 0.356 . . . . 0.35 110.289 178.445 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -65.13 -20.28 66.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.093 0.473 . . . . 0.5 110.14 176.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -97.24 -0.64 46.37 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.767 -0.651 . . . . 1.76 110.954 -178.323 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . 0.513 ' HG3' ' HA ' ' A' ' 137' ' ' VAL . 0.6 OUTLIER -68.54 151.31 97.31 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.258 -0.428 . . . . 0.86 111.397 -178.967 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -72.87 106.56 2.16 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.583 2.189 . . . . 0.67 111.207 177.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.45 27.52 1.08 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.196 0.522 . . . . 2.91 111.726 -173.331 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -115.2 -38.93 3.72 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 115.383 -0.826 . . . . 2.7 109.536 176.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 71.78 95.76 0.07 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 114.986 -1.007 . . . . 2.34 111.106 176.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 1.7 t -112.4 139.09 38.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.847 -0.615 . . . . 0.99 109.959 178.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.963 ' HG3' HG22 ' A' ' 36' ' ' THR . 1.2 mt-10 -80.06 146.45 31.93 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.791 0.329 . . . . 1.53 110.825 179.192 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 51.3 mt . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.575 -0.726 . . . . 1.57 110.689 -178.736 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.448 -0.559 0 CA-C-O 121.093 0.473 . . . . 0.93 110.165 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.3 m -166.3 135.61 3.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.624 -0.717 . . . . 1.61 110.086 -179.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -140.69 123.7 9.98 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 115.782 -0.645 . . . . 1.6 110.019 -179.008 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -79.91 -30.05 2.44 Favored 'Trans proline' 0 N--CA 1.475 0.41 0 C-N-CA 123.354 2.703 . . . . 1.87 112.8 177.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.4 t -76.43 -20.69 56.82 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.465 0.65 . . . . 2.18 109.571 -178.355 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.4 tttm -105.26 136.17 19.23 Favored Pre-proline 0 C--N 1.316 -0.865 0 CA-C-N 115.165 -0.925 . . . . 2.75 109.345 177.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.467 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 19.7 Cg_endo -60.21 137.87 77.78 Favored 'Trans proline' 0 C--O 1.239 0.53 0 C-N-CA 122.417 2.078 . . . . 1.38 112.274 178.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -141.12 78.04 0.29 Allowed Glycine 0 N--CA 1.446 -0.685 0 CA-C-N 115.089 -0.959 . . . . 0.97 110.869 -179.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.502 ' HG3' ' CE2' ' A' ' 96' ' ' TRP . 0.3 OUTLIER -93.86 174.26 7.26 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 110.291 -0.263 . . . . 1.93 110.291 -177.04 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.4 ttpp -120.53 107.02 12.35 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.821 0.344 . . . . 2.64 110.507 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.456 ' HB ' ' O ' ' A' ' 145' ' ' VAL . 7.3 p -107.5 165.39 11.44 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.689 -0.404 . . . . 0.68 110.232 177.188 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.474 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 62.5 t30 -58.15 -38.93 77.54 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.917 -0.583 . . . . 1.47 110.684 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -65.14 -39.53 93.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.03 -0.532 . . . . 1.04 110.996 -178.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.475 ' HB2' ' HA ' ' A' ' 97' ' ' SER . 0.9 OUTLIER -60.19 -58.84 6.78 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.216 -0.447 . . . . 0.8 110.809 -178.89 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 20.8 mt-30 -66.82 -26.51 66.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.961 -0.563 . . . . 1.75 110.981 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.474 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 56.6 t80 -60.25 -63.69 1.21 Allowed 'General case' 0 C--O 1.22 -0.498 0 CA-C-N 116.182 -0.463 . . . . 0.64 110.378 176.216 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.52 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -60.24 -28.56 68.13 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 116.593 -0.276 . . . . 1.13 111.0 -174.47 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.481 ' O ' HG13 ' A' ' 47' ' ' VAL . 6.0 tt0 -62.71 -55.9 22.51 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.034 0.445 . . . . 1.3 111.288 177.687 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -86.56 -26.44 24.5 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.857 0.361 . . . . 0.5 111.963 -176.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 94.7 t -88.8 -57.59 4.12 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 N-CA-C 111.928 0.344 . . . . 0.3 111.928 -177.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.708 HG22 ' HB3' ' A' ' 136' ' ' LYS . 58.5 t -81.97 -64.45 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 112.33 0.493 . . . . 0.26 112.33 -169.243 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' VAL . . . . . 0.481 HG13 ' O ' ' A' ' 43' ' ' GLN . 0.7 OUTLIER -66.81 -30.81 50.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 C-N-CA 120.21 -0.596 . . . . 0.83 110.967 -175.162 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -62.37 -42.25 99.27 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 120.919 -0.312 . . . . 2.4 111.304 177.555 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.441 HG21 ' HE2' ' A' ' 136' ' ' LYS . 2.8 p -69.42 -33.57 73.17 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 120.807 0.337 . . . . 0.55 110.876 179.513 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.611 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.2 OUTLIER -67.8 -41.48 83.11 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.997 -0.547 . . . . 0.33 109.698 176.439 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 15.0 t-105 -59.02 -36.78 75.54 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.153 -0.931 . . . . 0.39 111.538 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.8 mttm -82.98 7.69 14.86 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.025 0.38 . . . . 2.24 112.025 -174.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.444 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 13.1 t-80 -89.12 131.53 35.22 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.927 -0.397 . . . . 0.39 109.927 176.386 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -80.1 21.58 0.57 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.289 -0.414 . . . . 1.91 111.702 -175.257 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.444 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.2 OUTLIER -126.07 -6.43 6.64 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.3 0.571 . . . . 0.93 109.629 174.432 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.669 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -97.61 10.63 39.42 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.456 0.646 . . . . 0.28 110.264 179.514 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.467 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 57.4 p-90 -68.67 -31.68 3.14 Favored Pre-proline 0 CA--C 1.545 0.78 0 N-CA-C 113.954 1.094 . . . . 0.58 113.954 -175.608 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' PRO . . . . . 0.467 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 16.7 Cg_exo -68.52 -13.19 36.8 Favored 'Trans proline' 0 C--N 1.363 1.335 0 CA-C-N 121.193 1.462 . . . . 0.47 112.103 178.246 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.479 ' CE2' HD11 ' A' ' 122' ' ' ILE . 2.4 m-85 -104.19 11.64 34.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.272 -0.422 . . . . 1.11 110.964 -178.546 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.417 ' CD1' ' HA ' ' A' ' 57' ' ' TRP . 2.6 m-30 -66.08 -43.91 85.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.089 -0.505 . . . . 0.63 111.433 -178.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -95.7 133.49 25.51 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.873 -0.603 . . . . 1.63 110.432 -175.611 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.456 ' HA ' ' OD1' ' A' ' 82' ' ' ASP . 18.3 Cg_endo -61.11 133.33 46.38 Favored 'Trans proline' 0 C--O 1.237 0.448 0 C-N-CA 122.783 2.322 . . . . 0.87 112.232 -179.755 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 1.7 t -68.65 113.16 4.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.868 0.842 . . . . 0.88 110.784 179.34 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.434 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.3 OUTLIER -109.97 -0.88 17.97 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.803 -1.09 . . . . 1.85 109.39 177.216 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.434 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 78.03 -72.99 0.08 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 114.631 -1.168 . . . . 1.29 110.054 -171.189 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 31.1 mm -68.22 -44.64 83.93 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 116.577 -0.283 . . . . 1.89 111.585 -173.069 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 3.2 tptp -63.51 -19.9 65.16 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.307 0.484 . . . . 2.99 112.307 -176.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.458 ' HB3' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -114.02 10.16 17.47 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 122.19 -0.318 . . . . 1.66 111.173 -179.684 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 61.23 42.53 11.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.611 0.72 . . . . 1.74 110.637 179.241 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.458 HD22 ' HB3' ' A' ' 68' ' ' LEU . 0.2 OUTLIER -119.51 73.93 16.27 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 114.943 -1.026 . . . . 1.61 110.555 -175.618 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -79.51 -34.48 1.03 Allowed 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 121.731 1.621 . . . . 1.3 112.967 -176.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -89.71 1.86 55.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.345 0.593 . . . . 1.97 110.785 -176.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.451 ' HB2' ' HB3' ' A' ' 70' ' ' LEU . 8.7 t80 -61.85 -50.47 72.12 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.473 -0.785 . . . . 1.13 111.029 -178.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -75.75 2.9 10.91 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.536 -0.757 . . . . 0.91 111.529 -174.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.7 mttt -89.91 -25.23 21.06 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.317 0.58 . . . . 2.86 110.015 178.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.5 mt -111.91 -45.86 5.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.574 -0.739 . . . . 1.0 110.292 -178.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 35.1 mm -94.66 121.84 45.6 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-N 116.005 -0.543 . . . . 0.75 110.257 -178.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.513 ' O ' ' HD3' ' A' ' 80' ' ' PRO . 0.0 OUTLIER -88.87 -26.12 21.79 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.956 -0.565 . . . . 1.99 110.553 -177.654 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -113.18 84.72 7.54 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 115.953 -0.567 . . . . 2.05 109.922 177.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' PRO . . . . . 0.513 ' HD3' ' O ' ' A' ' 78' ' ' LYS . 6.4 Cg_exo -73.32 94.17 0.83 Allowed 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.98 2.453 . . . . 0.89 112.137 -177.188 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -130.62 155.79 45.97 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.274 0.559 . . . . 0.82 110.739 -178.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.456 ' OD1' ' HA ' ' A' ' 62' ' ' PRO . 1.7 p-10 -140.61 -119.78 0.12 Allowed 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.876 -1.057 . . . . 1.42 109.098 -175.793 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 5.2 ttp -130.21 -20.0 3.09 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.912 0.387 . . . . 0.8 110.547 177.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -85.63 -30.25 24.64 Favored Glycine 0 N--CA 1.44 -1.068 0 N-CA-C 110.442 -1.063 . . . . 0.32 110.442 -179.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.77 -47.44 62.93 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.504 -0.348 . . . . 0.95 110.363 175.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.543 HG23 ' SG ' ' A' ' 101' ' ' CYS . 58.4 mt -56.3 -46.97 81.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.61 -0.723 . . . . 0.97 110.126 176.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.466 ' O ' ' HG2' ' A' ' 91' ' ' GLU . 0.0 OUTLIER -67.74 -34.89 77.73 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 115.772 -0.649 . . . . 1.15 110.614 -178.508 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.431 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 21.3 tptt -67.05 -34.77 78.39 Favored 'General case' 0 C--N 1.339 0.124 0 CA-C-O 120.828 0.347 . . . . 2.46 110.544 -178.567 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 7.4 mtp180 -73.25 -33.5 65.31 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.032 0.444 . . . . 1.16 110.468 177.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 9.3 mt -68.0 -51.34 48.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.901 -0.591 . . . . 0.49 111.239 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 0.5 OUTLIER -66.13 -26.03 67.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.934 0.397 . . . . 1.39 111.101 -178.089 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.431 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 1.7 m-80 -90.95 5.98 46.54 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.261 -0.427 . . . . 1.3 111.012 -179.022 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 49.7 51.67 16.05 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 121.381 0.61 . . . . 1.75 111.351 -178.843 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -74.32 -21.96 59.47 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.429 0.633 . . . . 0.96 110.657 177.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -102.7 170.24 8.13 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.862 0.839 . . . . 1.28 112.017 -174.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . 0.502 ' CE2' ' HG3' ' A' ' 34' ' ' ARG . 2.1 t90 -85.73 -42.11 14.52 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 113.538 -1.664 . . . . 1.05 108.805 168.411 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.475 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 23.2 t -155.79 176.3 12.81 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.754 -1.112 . . . . 1.0 109.944 -171.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.26 -15.37 61.42 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.869 0.366 . . . . 0.66 110.793 -177.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.48 -30.91 69.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.131 0.491 . . . . 0.85 110.508 176.12 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -75.88 -30.83 58.98 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.541 -0.754 . . . . 2.44 109.883 -179.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . 0.543 ' SG ' HG23 ' A' ' 86' ' ' ILE . 0.5 OUTLIER -81.81 -22.11 37.28 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.596 -0.729 . . . . 0.95 110.43 -177.994 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 7.5 mmt -53.33 -35.29 60.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.655 -0.702 . . . . 1.13 110.617 177.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.13 -50.32 48.99 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.552 -0.749 . . . . 2.96 110.072 -178.738 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -64.53 -40.44 95.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.946 -0.57 . . . . 1.87 110.809 -176.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.611 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -61.8 -44.93 95.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.464 . . . . 0.38 110.629 177.791 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.13 -41.32 99.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.129 -0.487 . . . . 0.97 110.202 177.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 54.9 m -63.38 -47.68 81.04 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.722 -0.672 . . . . 0.43 111.71 -178.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.416 ' HG3' ' N ' ' A' ' 109' ' ' PHE . 0.0 OUTLIER -58.85 -35.72 73.39 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.601 0.239 . . . . 0.88 111.206 -177.907 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' PHE . . . . . 0.416 ' N ' ' HG3' ' A' ' 108' ' ' MET . 6.1 m-85 -72.3 -49.22 36.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.022 0.439 . . . . 0.29 110.802 -178.094 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -67.93 -33.36 74.53 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.099 -0.501 . . . . 0.66 110.792 -177.748 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -53.01 -42.79 65.97 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.382 -0.826 . . . . 1.84 111.023 177.582 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -67.61 -40.06 84.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.08 0.466 . . . . 0.63 110.419 179.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -69.38 -19.06 63.83 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.239 -0.437 . . . . 0.81 111.269 -178.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 69.5 mt -92.18 -49.64 12.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.26 -0.427 . . . . 0.55 110.847 179.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -68.55 -38.44 80.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.922 -0.581 . . . . 1.22 110.831 -176.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' ASN . . . . . 0.42 ' HB2' HG23 ' A' ' 123' ' ' VAL . 18.3 m120 -99.99 177.9 4.96 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.033 -0.531 . . . . 1.04 110.812 -176.611 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -104.37 158.33 32.18 Favored Pre-proline 0 C--N 1.322 -0.623 0 N-CA-C 109.252 -0.647 . . . . 3.47 109.252 175.527 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' PRO . . . . . 0.77 ' HA ' HG11 ' A' ' 123' ' ' VAL . 22.7 Cg_exo -63.11 -7.54 12.03 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.365 2.043 . . . . 0.96 112.681 178.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.56 5.37 47.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.048 -0.523 . . . . 1.23 111.284 177.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -91.54 146.99 23.34 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.088 0.47 . . . . 1.34 111.367 -174.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -57.34 -46.72 83.0 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.075 -0.966 . . . . 1.44 111.282 -176.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' ILE . . . . . 0.479 HD11 ' CE2' ' A' ' 59' ' ' PHE . 0.9 OUTLIER -65.67 -32.16 56.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.132 -0.485 . . . . 0.42 111.075 -177.473 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.77 HG11 ' HA ' ' A' ' 118' ' ' PRO . 1.0 OUTLIER -66.1 -44.07 92.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.194 0.521 . . . . 0.35 109.686 176.192 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.81 -32.04 71.41 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.519 -0.764 . . . . 0.52 109.91 178.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' MET . . . . . 0.423 ' O ' HD13 ' A' ' 129' ' ' LEU . 23.3 mtt -73.13 -45.32 57.53 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.471 -0.786 . . . . 0.62 110.57 179.171 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.04 -36.1 67.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.894 0.378 . . . . 0.31 111.236 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . 0.418 ' O ' ' HD2' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.21 -49.17 78.69 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.063 -0.517 . . . . 1.94 111.099 178.618 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -70.57 -37.1 73.91 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.08 0.467 . . . . 0.32 110.516 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.669 HD21 ' HA ' ' A' ' 56' ' ' ALA . 1.8 mp -59.55 -45.49 91.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.352 -0.84 . . . . 0.33 111.247 -179.138 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -65.95 -22.05 66.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.287 -0.415 . . . . 1.47 111.917 -174.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' LYS . . . . . 0.508 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.6 OUTLIER -64.67 -39.81 94.32 Favored 'General case' 0 CA--C 1.518 -0.255 0 N-CA-C 109.789 -0.449 . . . . 2.24 109.789 179.858 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' ILE . . . . . 0.449 HD12 HD23 ' A' ' 50' ' ' LEU . 2.7 mt -73.74 -34.0 39.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.701 -0.682 . . . . 1.23 110.023 177.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' PHE . . . . . 0.512 ' O ' HG23 ' A' ' 137' ' ' VAL . 37.0 t80 -57.92 -62.19 1.99 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.627 -0.715 . . . . 0.46 110.556 178.619 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.36 -28.19 69.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.8 0.334 . . . . 0.64 110.755 -177.554 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.508 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.65 -51.24 70.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.793 -0.639 . . . . 1.61 111.337 178.055 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' LYS . . . . . 0.708 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -76.16 -29.01 57.59 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.912 -0.586 . . . . 1.52 110.786 -178.417 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 133' ' ' PHE . 53.9 t -70.8 -29.38 37.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.118 -0.492 . . . . 0.35 110.753 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -69.25 -17.57 63.77 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.095 0.474 . . . . 0.5 110.549 177.614 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -106.18 6.47 30.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.118 -0.492 . . . . 1.76 110.949 179.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' MET . . . . . 0.512 ' HG3' ' HA ' ' A' ' 137' ' ' VAL . 0.4 OUTLIER -70.15 149.33 96.11 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.082 -0.508 . . . . 0.86 110.322 177.214 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' PRO . . . . . 0.459 ' C ' ' H ' ' A' ' 143' ' ' GLU . 71.8 Cg_endo -75.9 102.96 1.66 Allowed 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 121.959 1.772 . . . . 0.67 111.753 -178.375 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -78.12 25.33 0.22 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.389 0.614 . . . . 2.91 110.39 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . 0.459 ' H ' ' C ' ' A' ' 141' ' ' PRO . 3.4 mm-40 -101.4 -34.17 9.7 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 115.085 -0.961 . . . . 2.7 108.822 176.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 60.15 74.81 0.43 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 114.275 -1.329 . . . . 2.34 110.029 -178.682 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' VAL . . . . . 0.456 ' O ' ' HB ' ' A' ' 36' ' ' THR . 21.9 t -97.14 139.48 19.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.364 -0.834 . . . . 0.99 109.055 -176.221 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . 0.443 ' HA ' ' HA ' ' A' ' 36' ' ' THR . 11.8 tt0 -86.1 153.15 22.3 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 120.593 -0.443 . . . . 1.53 110.253 179.038 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' LEU . . . . . 0.453 HD11 ' HA ' ' A' ' 37' ' ' ASN . 89.5 mt . . . . . 0 C--O 1.251 1.168 0 CA-C-O 118.474 -0.774 . . . . 1.57 110.86 -176.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo . . . . . 0 N--CA 1.479 0.66 0 N-CA-C 110.198 -0.732 . . . . 6.18 110.198 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.35 84.94 3.78 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.355 0.598 . . . . 5.71 109.888 175.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 150.9 -79.5 0.2 Allowed Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 110.613 -0.995 . . . . 3.45 110.613 -177.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 11.8 p -78.73 138.33 38.2 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.777 -0.453 . . . . 2.44 109.777 173.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.73 172.73 6.66 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.776 0.798 . . . . 1.64 111.945 -174.38 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 9.2 p -122.77 -14.39 6.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-N 114.349 -1.296 . . . . 0.93 108.853 175.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -147.8 132.7 18.08 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 114.504 -1.225 . . . . 1.61 109.06 177.218 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.415 ' O ' ' HE3' ' A' ' 31' ' ' LYS . 23.8 t-20 -153.05 125.85 4.05 Favored Pre-proline 0 C--N 1.316 -0.876 0 CA-C-N 116.037 -0.529 . . . . 1.6 109.933 -178.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -65.85 -46.44 4.92 Favored 'Trans proline' 0 N--CA 1.474 0.378 0 C-N-CA 123.421 2.747 . . . . 1.87 113.271 -176.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 15.8 m -66.11 -32.53 74.04 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.293 0.568 . . . . 2.18 110.535 -177.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.415 ' HE3' ' O ' ' A' ' 28' ' ' ASN . 0.8 OUTLIER -78.52 123.66 85.55 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 115.379 -0.828 . . . . 2.75 109.73 178.215 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -48.16 136.25 24.38 Favored 'Trans proline' 0 C--N 1.345 0.355 0 C-N-CA 122.811 2.341 . . . . 1.38 112.97 178.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.449 ' HA2' ' O ' ' A' ' 95' ' ' TYR . . . -162.64 62.32 0.27 Allowed Glycine 0 N--CA 1.444 -0.809 0 N-CA-C 110.816 -0.914 . . . . 0.97 110.816 179.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -80.09 167.9 19.81 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.006 0.431 . . . . 1.93 110.488 -177.468 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.514 ' HB3' HD12 ' A' ' 147' ' ' LEU . 4.8 mmtm -102.95 108.44 19.63 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 116.332 -0.395 . . . . 2.64 110.048 178.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.673 HG22 ' HG3' ' A' ' 146' ' ' GLU . 5.7 p -109.0 171.65 7.31 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 120.774 -0.37 . . . . 0.68 110.826 174.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -61.69 -50.51 72.19 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.801 -0.636 . . . . 1.47 110.937 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.584 ' HG2' ' SD ' ' A' ' 140' ' ' MET . 1.3 mt-30 -56.68 -44.37 81.38 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.714 0.292 . . . . 1.04 110.983 179.115 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.445 ' HB2' ' HA ' ' A' ' 97' ' ' SER . 0.8 OUTLIER -59.42 -56.0 27.52 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.088 -0.505 . . . . 0.8 111.13 -178.53 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -65.54 -33.48 76.02 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.013 -0.539 . . . . 1.75 110.48 -179.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.658 ' CE1' ' HG2' ' A' ' 140' ' ' MET . 61.2 t80 -58.17 -63.89 1.1 Allowed 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.758 -0.656 . . . . 0.64 110.858 178.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.473 ' O ' HG12 ' A' ' 47' ' ' VAL . 0.0 OUTLIER -62.65 -29.61 70.75 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 120.721 -0.392 . . . . 1.13 110.932 -171.961 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.484 ' HA ' HD13 ' A' ' 90' ' ' LEU . 4.5 tt0 -62.16 -55.83 24.78 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.778 -0.646 . . . . 1.3 110.874 -179.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -87.2 -29.63 21.6 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.928 0.394 . . . . 0.5 111.91 -177.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.419 HG11 ' CZ ' ' A' ' 41' ' ' TYR . 93.7 t -88.39 -57.66 4.07 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 N-CA-C 112.443 0.534 . . . . 0.3 112.443 -174.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.483 HG22 ' HB3' ' A' ' 136' ' ' LYS . 81.7 t -79.24 -66.27 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 C-N-CA 120.782 -0.367 . . . . 0.26 111.953 -170.212 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.473 HG12 ' O ' ' A' ' 42' ' ' MET . 2.2 p -67.72 -35.43 72.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 C-N-CA 120.518 -0.473 . . . . 0.83 111.498 -174.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.8 mttt -67.31 -31.31 71.52 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 122.013 -0.43 . . . . 2.4 111.619 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 48.1 m -81.34 -36.88 29.16 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.84 -0.344 . . . . 0.55 110.634 176.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.633 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -55.45 -40.46 71.6 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 108.703 -0.851 . . . . 0.33 108.703 171.326 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 10.5 t-105 -60.14 -37.69 80.84 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.441 -1.254 . . . . 0.39 111.912 178.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -77.23 -5.15 48.21 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.212 0.449 . . . . 2.24 112.212 -172.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -72.62 130.41 40.51 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.672 -0.492 . . . . 0.39 109.672 176.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -75.55 -4.76 41.73 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.284 -0.416 . . . . 1.91 111.214 -174.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 2.0 m-30 -100.06 -3.71 31.4 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.203 0.525 . . . . 0.93 109.866 175.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.792 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -93.81 10.06 34.67 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.856 -0.611 . . . . 0.28 110.913 -178.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.551 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 48.9 p-90 -65.46 -33.01 6.89 Favored Pre-proline 0 CA--C 1.548 0.889 0 N-CA-C 113.57 0.952 . . . . 0.58 113.57 -175.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.551 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 12.7 Cg_exo -71.54 -6.93 20.2 Favored 'Trans proline' 0 C--N 1.365 1.44 0 CA-C-N 121.088 1.424 . . . . 0.47 112.104 177.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -105.97 14.2 28.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.125 0.488 . . . . 1.11 110.137 -179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 10.4 m-30 -82.0 -11.21 58.95 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.839 -0.618 . . . . 0.63 110.714 179.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -122.19 125.09 26.7 Favored Pre-proline 0 C--N 1.322 -0.602 0 CA-C-N 116.281 -0.418 . . . . 1.63 111.06 -175.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.609 ' HA ' ' OD1' ' A' ' 82' ' ' ASP . 50.3 Cg_endo -71.07 150.93 61.06 Favored 'Trans proline' 0 C--O 1.236 0.422 0 C-N-CA 122.795 2.33 . . . . 0.87 112.49 -179.116 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 38.3 t -73.34 92.24 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 122.061 0.934 . . . . 0.88 110.395 176.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -87.11 -10.18 53.5 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.683 -1.144 . . . . 1.85 109.229 175.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 76.18 -45.26 0.51 Allowed 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 114.573 -1.194 . . . . 1.29 111.745 -179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 41.5 mm -80.04 -53.01 13.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 120.751 0.31 . . . . 1.89 110.639 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -53.28 -52.86 57.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.742 -0.663 . . . . 2.99 112.328 -177.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.524 HD23 HD11 ' A' ' 70' ' ' LEU . 2.2 tp -90.66 0.24 57.46 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.26 -0.427 . . . . 1.66 111.108 -177.332 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 57.23 56.6 5.05 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.688 -0.687 . . . . 1.74 112.083 178.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.524 HD11 HD23 ' A' ' 68' ' ' LEU . 7.5 mt -121.21 79.05 34.87 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 115.664 -0.698 . . . . 1.61 110.357 178.075 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -78.63 -37.52 0.65 Allowed 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.575 2.183 . . . . 1.3 113.131 -175.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.3 p-10 -86.62 -3.96 59.11 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.284 0.564 . . . . 1.97 110.604 -178.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -58.83 -39.34 80.94 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.328 -0.851 . . . . 1.13 110.496 175.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.413 ' ND1' ' HG2' ' A' ' 80' ' ' PRO . 3.2 m-70 -76.94 0.77 19.82 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.228 -0.896 . . . . 0.91 111.417 -176.584 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 25.9 mttt -109.81 -41.38 4.53 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.448 -0.342 . . . . 2.86 111.099 -178.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.2 mt -86.43 -49.85 14.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 120.901 0.381 . . . . 1.0 111.082 -178.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.482 HD11 ' HB2' ' A' ' 115' ' ' TYR . 20.0 mm -80.57 131.8 33.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.329 -0.396 . . . . 0.75 110.324 -177.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.4 -56.68 8.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.029 -0.532 . . . . 1.99 111.214 -175.152 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.776 ' HB2' HG21 ' A' ' 107' ' ' THR . 0.3 OUTLIER -122.27 89.75 49.05 Favored Pre-proline 0 C--N 1.324 -0.538 0 N-CA-C 110.067 -0.345 . . . . 2.05 110.067 178.432 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.413 ' HG2' ' ND1' ' A' ' 74' ' ' HIS . 32.4 Cg_exo -60.99 91.97 0.1 OUTLIER 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 123.038 2.492 . . . . 0.89 112.345 177.617 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 1.7 mmt -134.05 167.29 20.9 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.736 -0.665 . . . . 0.82 109.763 -179.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.609 ' OD1' ' HA ' ' A' ' 62' ' ' PRO . 5.6 p-10 -143.05 -116.71 0.1 Allowed 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.289 -0.869 . . . . 1.42 109.696 -173.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -128.33 -22.95 3.31 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.954 0.407 . . . . 0.8 110.337 177.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -82.75 -23.12 56.77 Favored Glycine 0 N--CA 1.441 -1.026 0 N-CA-C 110.738 -0.945 . . . . 0.32 110.738 -178.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.85 -41.66 22.82 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.304 -0.448 . . . . 0.95 110.552 177.305 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.425 HD12 ' O ' ' A' ' 82' ' ' ASP . 47.0 mt -58.42 -51.0 76.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.827 -0.624 . . . . 0.97 110.153 175.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.53 -24.68 66.42 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 115.903 -0.59 . . . . 1.15 111.185 -178.69 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.35 -45.42 76.41 Favored 'General case' 0 C--O 1.23 0.045 0 CA-C-O 120.772 0.32 . . . . 2.46 110.752 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.588 ' HD2' ' CD2' ' A' ' 94' ' ' TYR . 6.3 mtm180 -69.31 -30.54 68.62 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.345 -0.388 . . . . 1.16 110.757 177.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.484 HD13 ' HA ' ' A' ' 43' ' ' GLN . 12.6 mt -70.54 -49.62 46.24 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.441 -0.345 . . . . 0.49 111.284 179.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -70.04 -21.53 63.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.812 0.339 . . . . 1.39 111.174 -177.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -96.53 5.66 50.33 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.181 -0.463 . . . . 1.3 110.618 179.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 53.36 54.25 10.46 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.84 -0.618 . . . . 1.75 111.478 178.295 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . 0.588 ' CD2' ' HD2' ' A' ' 89' ' ' ARG . 8.5 t80 -70.67 -44.19 67.56 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.292 -0.413 . . . . 0.96 111.786 -178.448 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.458 ' CD1' ' HB3' ' A' ' 100' ' ' GLU . 0.3 OUTLIER -91.7 -172.35 3.19 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.67 0.748 . . . . 1.28 111.39 -179.272 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -94.59 -42.81 8.61 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 114.132 -1.395 . . . . 1.05 108.898 175.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.445 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 9.4 t -145.95 170.66 16.16 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.014 -0.994 . . . . 1.0 109.619 -176.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -69.16 -12.12 61.4 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.978 0.362 . . . . 0.66 111.978 -174.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -63.27 -26.76 68.93 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.845 0.355 . . . . 0.85 111.094 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.458 ' HB3' ' CD1' ' A' ' 95' ' ' TYR . 4.4 tp10 -82.13 -22.92 35.92 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.014 0.435 . . . . 2.44 110.37 179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.407 ' SG ' HG23 ' A' ' 86' ' ' ILE . 1.6 t -76.65 -21.76 55.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.75 -0.659 . . . . 0.95 110.112 178.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -21.18 59.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.798 -0.637 . . . . 1.13 110.778 178.402 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 4.7 tp-100 -73.64 -57.18 4.17 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 116.022 -0.536 . . . . 2.96 110.602 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.99 -36.98 80.94 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.042 -0.526 . . . . 1.87 111.005 -176.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.633 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -61.19 -39.59 90.74 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.062 0.458 . . . . 0.38 110.847 177.021 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -67.46 -39.37 85.31 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.921 -0.581 . . . . 0.97 110.709 -178.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.776 HG21 ' HB2' ' A' ' 79' ' ' ASN . 47.5 m -70.69 -39.74 73.3 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.236 -0.438 . . . . 0.43 111.675 -177.444 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.511 ' HG3' ' N ' ' A' ' 109' ' ' PHE . 0.0 OUTLIER -54.05 -37.86 64.59 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.745 0.307 . . . . 0.88 111.278 -178.913 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.511 ' N ' ' HG3' ' A' ' 108' ' ' MET . 7.3 m-85 -76.95 -43.73 34.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.362 -0.381 . . . . 0.29 110.98 -178.218 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -67.19 -39.96 86.47 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.042 0.449 . . . . 0.66 110.716 -177.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -49.85 -46.53 51.45 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.246 -0.888 . . . . 1.84 111.139 177.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.76 -39.98 91.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.325 -0.398 . . . . 0.63 110.773 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -67.14 -29.85 69.69 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.339 -0.391 . . . . 0.81 111.25 -177.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 37.0 mt -84.64 -54.95 7.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.174 -0.466 . . . . 0.55 111.739 -176.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.482 ' HB2' HD11 ' A' ' 77' ' ' ILE . 45.0 t80 -67.4 -40.04 85.58 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.763 0.316 . . . . 1.22 110.849 -176.099 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -97.56 152.74 18.72 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.132 -0.486 . . . . 1.04 110.592 -176.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.52 151.71 85.22 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 116.228 -0.442 . . . . 3.47 110.264 179.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . 0.568 ' HA ' HG11 ' A' ' 123' ' ' VAL . 29.7 Cg_endo -64.49 -7.15 13.52 Favored 'Trans proline' 0 CA--C 1.533 0.435 0 C-N-CA 122.978 2.452 . . . . 0.96 113.068 -177.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -102.46 5.51 39.58 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.793 0.33 . . . . 1.23 111.281 178.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -82.93 155.4 24.06 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.098 0.475 . . . . 1.34 110.851 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.82 -40.54 88.05 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.458 -0.792 . . . . 1.44 110.423 -177.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.3 tp -62.04 -36.95 77.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.99 -0.55 . . . . 0.42 110.67 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.568 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.3 t -67.72 -46.38 82.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 109.877 -0.416 . . . . 0.35 109.877 177.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.37 -38.38 74.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.541 -0.754 . . . . 0.52 110.031 178.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . 0.488 ' O ' HD13 ' A' ' 129' ' ' LEU . 25.9 mtt -69.78 -48.81 57.81 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.309 -0.86 . . . . 0.62 110.785 178.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.27 -40.46 67.85 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.274 -0.421 . . . . 0.31 111.372 -179.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -58.23 -42.54 86.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.021 -0.536 . . . . 1.94 111.039 179.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -77.58 -38.26 48.77 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.985 0.422 . . . . 0.32 110.66 -179.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.792 HD21 ' HA ' ' A' ' 56' ' ' ALA . 4.6 mp -56.48 -38.1 71.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.52 -0.764 . . . . 0.33 110.676 177.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -62.23 -23.78 66.86 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.423 -0.808 . . . . 1.47 111.953 -178.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.42 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 1.3 mptt -68.18 -47.57 67.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.69 0.281 . . . . 2.24 110.46 -176.102 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.5 HD12 ' HA ' ' A' ' 50' ' ' LEU . 0.1 OUTLIER -71.98 -23.2 21.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.308 -0.405 . . . . 1.23 110.467 179.601 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.423 ' O ' HG23 ' A' ' 137' ' ' VAL . 24.7 t80 -61.56 -62.02 2.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.091 -0.504 . . . . 0.46 110.213 175.136 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 2.2 pp -65.98 -28.41 68.88 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.928 0.394 . . . . 0.64 110.818 -178.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.445 ' HB2' ' HA ' ' A' ' 132' ' ' ILE . 0.1 OUTLIER -54.62 -50.93 66.9 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.571 -0.741 . . . . 1.61 111.383 178.997 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . 0.483 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.2 OUTLIER -82.28 -24.42 34.71 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.47 -0.786 . . . . 1.52 110.981 -176.236 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.478 ' O ' ' HB2' ' A' ' 140' ' ' MET . 41.1 t -74.01 -36.4 44.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.809 -0.632 . . . . 0.35 110.852 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.19 -19.29 65.54 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.081 0.467 . . . . 0.5 110.238 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -100.42 6.04 44.36 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.55 -0.75 . . . . 1.76 110.447 -178.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . 0.658 ' HG2' ' CE1' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -61.18 150.38 79.43 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 115.865 -0.607 . . . . 0.86 110.898 177.218 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -61.23 103.22 0.24 Allowed 'Trans proline' 0 N--CA 1.461 -0.426 0 C-N-CA 122.161 1.907 . . . . 0.67 110.88 173.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -73.4 3.2 6.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.899 -0.591 . . . . 2.91 112.122 -173.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.408 ' O ' ' HB3' ' A' ' 144' ' ' GLU . 0.9 OUTLIER -112.44 -36.72 5.18 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 116.049 -0.523 . . . . 2.7 110.949 -176.148 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.57 ' OE2' ' HB2' ' A' ' 38' ' ' GLN . 5.9 tp10 74.28 135.37 0.05 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 114.991 -1.004 . . . . 2.34 110.845 -178.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 39.5 t -139.39 108.6 3.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.23 -0.896 . . . . 0.99 109.268 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.673 ' HG3' HG22 ' A' ' 36' ' ' THR . 3.4 tt0 -67.27 130.92 44.64 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.464 -0.569 . . . . 1.53 109.464 177.206 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.514 HD12 ' HB3' ' A' ' 35' ' ' LYS . 11.1 mt . . . . . 0 C--O 1.252 1.216 0 CA-C-O 118.493 -0.765 . . . . 1.57 110.27 -175.145 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.779 0 N-CA-C 111.655 -0.578 . . . . 2.17 111.655 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 141.67 76.3 0.04 OUTLIER Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.924 -0.655 . . . . 1.97 112.19 -179.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt 61.55 84.02 0.14 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.377 0.608 . . . . 3.58 111.622 176.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 1.2 ptpm? . . . . . 0 C--O 1.244 0.805 0 CA-C-O 118.428 -0.796 . . . . 4.6 110.38 -179.515 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo . . . . . 0 N--CA 1.477 0.529 0 N-CA-C 110.548 -0.597 . . . . 6.18 110.548 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 30.1 tp -100.76 151.94 21.08 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.131 -0.322 . . . . 5.71 110.131 178.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 90.73 -47.77 3.01 Favored Glycine 0 N--CA 1.45 -0.387 0 N-CA-C 111.464 -0.654 . . . . 3.45 111.464 -178.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 31.8 p -81.47 156.17 25.45 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 110.145 -0.317 . . . . 2.44 110.145 175.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.562 ' HG3' ' CE1' ' A' ' 94' ' ' TYR . 12.0 pt-20 -132.13 165.93 22.93 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.5 0.667 . . . . 1.64 110.878 -179.158 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 7.9 p -127.54 -7.48 4.26 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 115.225 -0.898 . . . . 0.93 108.994 176.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -151.47 145.31 25.12 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 114.713 -1.131 . . . . 1.61 108.997 178.574 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.439 ' HB3' ' CB ' ' A' ' 31' ' ' LYS . 11.9 t-20 -156.15 125.52 3.13 Favored Pre-proline 0 C--N 1.314 -0.935 0 CA-C-N 116.568 -0.287 . . . . 1.6 110.41 176.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -73.94 -39.96 1.55 Allowed 'Trans proline' 0 N--CA 1.473 0.308 0 C-N-CA 123.23 2.62 . . . . 1.87 113.231 -178.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.5 m -80.25 -21.03 43.23 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.208 0.528 . . . . 2.18 110.529 -175.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.439 ' CB ' ' HB3' ' A' ' 28' ' ' ASN . 9.2 tttp -74.46 135.45 75.56 Favored Pre-proline 0 C--N 1.319 -0.734 0 CA-C-N 114.917 -1.038 . . . . 2.75 111.027 179.34 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -57.97 137.21 79.74 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.142 1.895 . . . . 1.38 111.49 169.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -173.17 90.93 0.09 OUTLIER Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 111.221 -0.752 . . . . 0.97 111.221 -176.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -110.35 177.9 4.55 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 120.923 0.392 . . . . 1.93 110.434 -177.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.439 ' HA ' HD22 ' A' ' 39' ' ' LEU . 7.4 mtpp -108.1 104.38 13.79 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.219 -0.446 . . . . 2.64 110.276 179.117 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.6 p -99.11 168.52 10.02 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.821 0.343 . . . . 0.68 110.466 177.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.496 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 6.7 t30 -62.08 -40.0 94.32 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 115.932 -0.576 . . . . 1.47 110.35 178.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -67.71 -40.6 84.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.764 0.316 . . . . 1.04 110.883 -178.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.551 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.5 OUTLIER -62.34 -49.83 74.01 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.117 0.484 . . . . 0.8 110.541 179.461 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 21.7 mm100 -70.38 -28.84 65.41 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.739 -0.664 . . . . 1.75 110.587 179.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.496 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 52.7 t80 -59.83 -63.9 1.14 Allowed 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.754 -0.657 . . . . 0.64 110.762 176.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.544 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -59.33 -31.9 69.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.579 0.228 . . . . 1.13 110.462 -174.901 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.468 ' O ' HG13 ' A' ' 47' ' ' VAL . 9.9 tt0 -56.12 -58.7 6.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.604 -0.726 . . . . 1.3 111.087 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -87.11 -27.19 23.25 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.105 -0.498 . . . . 0.5 112.323 -177.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 97.0 t -89.12 -57.59 4.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 112.347 0.499 . . . . 0.3 112.347 -175.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.544 HG23 ' HA ' ' A' ' 42' ' ' MET . 60.7 t -80.12 -65.93 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 C-N-CA 120.931 -0.308 . . . . 0.26 111.637 -170.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.468 HG13 ' O ' ' A' ' 43' ' ' GLN . 0.2 OUTLIER -66.1 -37.09 79.0 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.284 0 C-N-CA 120.7 -0.4 . . . . 0.83 111.266 -174.535 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -36.34 82.94 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 111.751 0.278 . . . . 2.4 111.751 -179.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.442 HG21 ' HE2' ' A' ' 136' ' ' LYS . 9.9 m -79.05 -33.44 44.69 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 120.835 -0.346 . . . . 0.55 110.87 178.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.655 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -64.59 -36.17 83.36 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 121.486 0.66 . . . . 0.33 109.371 174.046 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 12.4 t-105 -61.96 -28.12 69.33 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.127 -0.942 . . . . 0.39 111.272 177.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 37.5 mtpt -92.41 28.81 1.85 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.104 0.478 . . . . 2.24 111.439 -176.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.517 ' HD2' HD11 ' A' ' 132' ' ' ILE . 14.5 t-80 -103.11 133.87 47.49 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.212 -0.449 . . . . 0.39 110.054 176.1 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.69 -11.4 60.92 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.306 -0.406 . . . . 1.91 111.789 -176.085 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.492 ' CG ' ' HG2' ' A' ' 125' ' ' MET . 0.2 OUTLIER -101.97 -4.46 26.08 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.912 0.387 . . . . 0.93 110.407 178.799 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.57 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -94.58 16.39 15.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.201 0.524 . . . . 0.28 110.802 -179.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.591 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 42.1 p-90 -70.44 -30.89 1.99 Allowed Pre-proline 0 CA--C 1.545 0.766 0 N-CA-C 113.706 1.002 . . . . 0.58 113.706 -174.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.591 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 6.4 Cg_exo -76.17 -4.92 15.71 Favored 'Trans proline' 0 C--N 1.359 1.108 0 C-N-CA 121.273 1.315 . . . . 0.47 111.252 172.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -109.15 45.81 1.03 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.246 -0.888 . . . . 1.11 109.893 -176.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.47 ' CE2' ' HA ' ' A' ' 57' ' ' TRP . 11.2 m-30 -120.99 -12.48 8.74 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.502 -0.772 . . . . 0.63 110.987 -176.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.424 ' HA ' ' HD2' ' A' ' 62' ' ' PRO . 1.1 mt-30 -123.28 113.37 29.48 Favored Pre-proline 0 C--N 1.32 -0.683 0 CA-C-N 116.252 -0.431 . . . . 1.63 110.816 -169.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.424 ' HD2' ' HA ' ' A' ' 61' ' ' GLN . 12.0 Cg_endo -56.45 129.81 36.72 Favored 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.418 2.079 . . . . 0.87 111.608 -178.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 20.5 t -65.02 103.39 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-O 121.708 0.766 . . . . 0.88 111.188 -176.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -110.21 30.54 6.66 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.029 -0.987 . . . . 1.85 109.283 174.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 55.68 -88.29 0.02 OUTLIER 'General case' 0 C--O 1.226 -0.18 0 CA-C-N 114.687 -1.142 . . . . 1.29 111.716 -178.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 40.7 mm -62.78 -34.47 65.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.475 -0.33 . . . . 1.89 111.397 -173.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -57.81 -29.83 65.23 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.952 -0.567 . . . . 2.99 112.025 -177.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 10.7 tp -128.06 14.91 6.81 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.864 0.364 . . . . 1.66 110.825 -177.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 61.26 56.08 2.78 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.474 -0.785 . . . . 1.74 111.351 179.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.63 HD21 ' HD2' ' B' ' 312' ' ' ALY . 0.2 OUTLIER -120.15 71.4 16.68 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 115.959 -0.564 . . . . 1.61 110.564 174.948 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -84.43 -39.87 0.1 Allowed 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.638 2.225 . . . . 1.3 112.218 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -81.25 -14.69 57.18 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.337 0.589 . . . . 1.97 109.962 -179.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.423 ' HE2' ' HA ' ' A' ' 80' ' ' PRO . 44.7 t80 -58.74 -40.51 84.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.139 -0.937 . . . . 1.13 110.593 177.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -77.72 1.9 18.53 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.49 -0.777 . . . . 0.91 111.557 -175.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 83.8 mttt -91.13 -47.42 7.54 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.397 0.618 . . . . 2.86 109.415 178.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.5 mp -88.92 -43.87 15.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 115.14 -0.936 . . . . 1.0 110.608 -177.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 35.2 mm -87.46 126.78 41.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.027 -0.533 . . . . 0.75 110.449 -178.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.9 mtmt -89.97 -23.34 21.57 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.725 -0.67 . . . . 1.99 110.948 -177.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -123.24 90.47 50.42 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 116.14 -0.482 . . . . 2.05 109.975 179.09 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.423 ' HA ' ' HE2' ' A' ' 73' ' ' TYR . 36.0 Cg_endo -67.19 93.44 0.34 Allowed 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.614 2.21 . . . . 0.89 112.5 -177.475 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 22.4 mmt -125.96 169.59 12.54 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.392 0.615 . . . . 0.82 111.036 -177.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.517 ' CG ' ' H ' ' A' ' 83' ' ' MET . 23.0 t70 -151.06 -142.15 0.12 Allowed 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.18 -1.373 . . . . 1.42 107.349 -177.16 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . 0.517 ' H ' ' CG ' ' A' ' 82' ' ' ASP . 0.1 OUTLIER -115.64 -15.17 11.42 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 108.3 -1.0 . . . . 0.8 108.3 176.177 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -80.04 -24.49 59.58 Favored Glycine 0 N--CA 1.441 -0.967 0 N-CA-C 109.653 -1.379 . . . . 0.32 109.653 178.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.99 -34.82 43.8 Favored 'General case' 0 N--CA 1.44 -0.953 0 CA-C-N 114.81 -0.695 . . . . 0.95 110.421 176.306 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 36.4 mm -58.3 -56.76 14.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.325 -0.852 . . . . 0.97 109.996 175.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.25 -34.49 66.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.247 -0.888 . . . . 1.15 110.891 177.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.608 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 0.1 OUTLIER -63.19 -52.98 60.16 Favored 'General case' 0 N--CA 1.455 -0.186 0 CA-C-O 120.599 0.238 . . . . 2.46 111.121 -176.868 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 8.0 mmm-85 -64.4 -32.98 74.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.516 -0.311 . . . . 1.16 111.135 -178.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 10.1 mt -69.81 -52.27 26.53 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.275 -0.42 . . . . 0.49 111.162 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -71.78 -26.23 62.34 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.911 0.386 . . . . 1.39 110.711 -177.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.608 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 1.2 t30 -76.14 -15.6 60.04 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.375 -0.375 . . . . 1.3 110.509 176.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 59.31 54.79 4.56 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 115.544 -0.753 . . . . 1.75 109.712 -176.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . 0.562 ' CE1' ' HG3' ' A' ' 25' ' ' GLU . 25.1 t80 -74.72 -46.58 36.65 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.194 -0.912 . . . . 0.96 111.486 -176.138 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -107.17 -176.89 3.2 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.212 0.53 . . . . 1.28 111.208 -179.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -77.66 -43.34 31.63 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.228 -0.896 . . . . 1.05 111.307 -176.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -147.05 170.12 17.8 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-O 121.154 0.502 . . . . 1.0 111.825 -168.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.551 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -74.54 -10.55 59.66 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.788 -0.642 . . . . 0.66 111.527 -178.193 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 48.9 m -64.75 -24.09 67.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.273 0.559 . . . . 0.85 110.045 177.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -80.77 -38.56 28.35 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.785 -0.643 . . . . 2.44 110.195 175.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.424 ' HB3' ' HE3' ' A' ' 42' ' ' MET . 0.5 OUTLIER -69.11 -23.4 63.99 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.623 -0.717 . . . . 0.95 111.029 -178.05 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.4 ttm -61.29 -29.9 70.15 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.195 -0.457 . . . . 1.13 110.282 177.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -73.96 -34.69 64.36 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.868 -0.605 . . . . 2.96 109.935 178.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -71.78 -47.05 56.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.806 -0.634 . . . . 1.87 110.317 -179.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.655 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -55.3 -46.73 76.22 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.808 -0.633 . . . . 0.38 110.634 177.573 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -59.21 -44.95 92.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.747 -0.661 . . . . 0.97 110.611 178.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 80.9 m -62.2 -46.76 87.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.941 -0.572 . . . . 0.43 111.112 179.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.63 -41.09 69.63 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.19 -0.459 . . . . 0.88 111.108 178.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -73.06 -45.42 57.52 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.357 -0.383 . . . . 0.29 111.219 -177.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.1 p -67.45 -33.25 74.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.351 -0.386 . . . . 0.66 111.067 -177.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 9.1 m-20 -49.31 -47.41 47.09 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.643 -0.708 . . . . 1.84 111.192 178.122 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -65.69 -38.1 88.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.803 -0.635 . . . . 0.63 110.792 -178.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -72.6 -25.83 61.47 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.112 -0.494 . . . . 0.81 111.202 -177.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 62.0 mt -88.32 -50.82 13.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.059 0.457 . . . . 0.55 111.18 -179.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.404 ' CE1' ' HA ' ' A' ' 73' ' ' TYR . 63.8 t80 -70.9 -34.87 71.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.136 -0.484 . . . . 1.22 111.495 -175.537 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 44.0 m-20 -110.85 157.81 19.42 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.891 0.377 . . . . 1.04 111.542 -172.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.541 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 0.2 OUTLIER -74.3 149.8 87.02 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-N 115.771 -0.65 . . . . 3.47 110.767 -177.468 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . 0.439 ' HA ' HG11 ' A' ' 123' ' ' VAL . 24.6 Cg_endo -62.24 -16.64 52.33 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.933 2.422 . . . . 0.96 112.976 -178.612 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.52 6.42 48.14 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.994 0.426 . . . . 1.23 111.25 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.541 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 0.5 OUTLIER -78.56 157.39 28.8 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 116.162 -0.472 . . . . 1.34 110.618 -178.414 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -67.5 -42.16 83.33 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.598 -0.728 . . . . 1.44 110.345 -177.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 5.5 tp -60.29 -35.84 64.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.972 -0.558 . . . . 0.42 111.009 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.439 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.4 t -68.97 -45.76 79.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.963 -0.384 . . . . 0.35 109.963 178.302 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.82 -29.69 67.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.906 -0.588 . . . . 0.52 110.13 177.617 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . 0.495 ' O ' HD13 ' A' ' 129' ' ' LEU . 32.8 mtt -76.42 -42.21 44.97 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.376 -0.829 . . . . 0.62 110.654 178.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.38 -45.17 72.77 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.073 -0.512 . . . . 0.31 112.095 -177.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . 0.431 ' HG3' ' H ' ' A' ' 127' ' ' GLN . 0.0 OUTLIER -59.44 -44.18 92.97 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.913 0.387 . . . . 1.94 110.86 179.888 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -68.38 -37.69 80.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 0.32 110.627 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.57 HD21 ' HA ' ' A' ' 56' ' ' ALA . 5.0 mp -64.83 -40.93 95.99 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.394 -0.821 . . . . 0.33 110.734 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -59.27 -24.75 63.51 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.662 -0.699 . . . . 1.47 111.849 -176.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.553 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -62.66 -44.0 97.37 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 110.158 -0.312 . . . . 2.24 110.158 -177.895 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.517 HD11 ' HD2' ' A' ' 53' ' ' HIS . 22.1 mt -66.96 -35.61 75.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.128 -0.487 . . . . 1.23 110.343 -179.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.468 ' O ' HG23 ' A' ' 137' ' ' VAL . 36.1 t80 -59.89 -62.71 1.67 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.819 -0.628 . . . . 0.46 110.77 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 2.0 pp -64.74 -28.38 69.55 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.954 0.407 . . . . 0.64 110.782 -177.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.553 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.3 OUTLIER -60.82 -51.72 68.14 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.673 -0.694 . . . . 1.61 111.024 178.992 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . 0.535 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -81.36 -26.51 35.47 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.852 -0.613 . . . . 1.52 110.885 -175.718 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 133' ' ' PHE . 52.4 t -68.86 -29.7 44.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.128 0.489 . . . . 0.35 110.262 176.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.51 -14.77 63.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.162 -0.472 . . . . 0.5 110.531 177.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -106.88 -0.57 23.17 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.895 -0.593 . . . . 1.76 110.325 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . 0.493 ' HG2' ' CE1' ' A' ' 41' ' ' TYR . 0.3 OUTLIER -70.07 147.29 95.63 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 115.874 -0.603 . . . . 0.86 110.752 -178.287 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.434 ' C ' ' H ' ' A' ' 143' ' ' GLU . 50.6 Cg_endo -86.18 79.95 1.85 Allowed 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 122.308 2.005 . . . . 0.67 111.324 178.118 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -76.08 21.39 0.17 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.273 0.558 . . . . 2.91 111.234 -177.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.434 ' H ' ' C ' ' A' ' 141' ' ' PRO . 2.4 mt-10 -90.62 -32.92 16.06 Favored 'General case' 0 N--CA 1.439 -0.982 0 N-CA-C 108.218 -1.031 . . . . 2.7 108.218 170.41 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 75.18 113.03 0.07 Allowed 'General case' 0 C--O 1.228 -0.064 0 CA-C-N 113.569 -1.651 . . . . 2.34 111.227 176.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 15.3 t -125.83 116.73 47.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.825 -0.625 . . . . 0.99 109.613 176.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -73.62 147.11 44.11 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.724 0.297 . . . . 1.53 110.499 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 64.6 mt . . . . . 0 C--O 1.247 0.931 0 CA-C-O 118.834 -0.603 . . . . 1.57 109.991 179.521 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.758 0 N-CA-C 112.173 -0.371 . . . . 2.17 112.173 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 312' ' ' ALY . . . . . 0.63 ' HD2' HD21 ' A' ' 70' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . -175.96 -80.98 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.511 0 N-CA-C 111.064 -0.814 . . . . 1.97 111.064 178.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 8.0 tmtm? -93.02 127.56 38.59 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.783 -0.821 . . . . 3.58 108.783 172.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 315' ' ' ALY . . . . . 0.458 ' HE2' ' CH2' ' A' ' 57' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.152 -0.928 . . . . 4.6 109.639 -177.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo . . . . . 0 N--CA 1.482 0.816 0 N-CA-C 110.506 -0.613 . . . . 6.18 110.506 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -101.98 42.91 1.1 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.796 0.331 . . . . 5.71 110.342 -178.5 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.9 60.89 3.02 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.492 -0.861 . . . . 3.45 111.083 -174.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.3 p 58.55 176.77 0.07 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.378 0.671 . . . . 2.44 111.8 -173.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.732 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 4.1 mt-10 -53.56 123.72 12.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.177 -0.465 . . . . 1.64 111.236 174.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.4 p -99.9 -14.48 7.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-O 121.216 0.531 . . . . 0.93 110.387 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -178.44 154.01 0.77 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.341 -0.845 . . . . 1.61 109.661 177.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.544 ' HB3' ' HB2' ' A' ' 31' ' ' LYS . 42.8 t-20 -160.53 124.38 2.0 Allowed Pre-proline 0 C--N 1.318 -0.779 0 CA-C-N 115.846 -0.616 . . . . 1.6 109.52 -179.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -65.06 -33.87 48.96 Favored 'Trans proline' 0 N--CA 1.48 0.729 0 C-N-CA 123.407 2.738 . . . . 1.87 112.994 -177.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 19.4 t -74.3 -20.7 60.04 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.577 0.703 . . . . 2.18 109.678 -179.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.544 ' HB2' ' HB3' ' A' ' 28' ' ' ASN . 2.1 tttp -87.11 134.75 36.03 Favored Pre-proline 0 C--N 1.319 -0.736 0 CA-C-N 115.0 -1.0 . . . . 2.75 109.755 178.464 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.509 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 35.9 Cg_endo -65.66 137.72 51.14 Favored 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.256 1.971 . . . . 1.38 112.317 177.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -153.88 109.27 0.4 Allowed Glycine 0 N--CA 1.442 -0.939 0 N-CA-C 110.788 -0.925 . . . . 0.97 110.788 179.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -123.81 155.77 37.36 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.789 0.328 . . . . 1.93 110.57 -176.312 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.489 ' HA ' HD22 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -92.62 84.36 5.04 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.191 0.52 . . . . 2.64 110.292 176.486 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.634 HG22 ' HG3' ' A' ' 146' ' ' GLU . 1.2 p -92.02 165.55 13.13 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.228 -0.442 . . . . 0.68 110.826 -179.225 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.446 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 64.0 t30 -63.99 -40.88 97.38 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 116.282 -0.417 . . . . 1.47 110.591 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -64.51 -38.97 92.86 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 110.203 -0.295 . . . . 1.04 110.203 177.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.783 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.7 OUTLIER -63.52 -55.68 22.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.916 -0.584 . . . . 0.8 110.501 178.838 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.48 ' HA ' ' OE1' ' A' ' 43' ' ' GLN . 2.7 mm-40 -63.81 -31.53 72.73 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.966 -0.561 . . . . 1.75 110.891 -179.166 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.446 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 63.8 t80 -53.57 -62.68 1.5 Allowed 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.52 -0.764 . . . . 0.64 110.922 176.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.529 ' HA ' HG23 ' A' ' 46' ' ' VAL . 3.5 ttm -59.07 -29.98 67.73 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.428 -0.351 . . . . 1.13 111.645 -173.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.577 ' HG2' HD22 ' A' ' 90' ' ' LEU . 24.9 mt-30 -60.12 -58.56 7.98 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.097 0.475 . . . . 1.3 110.502 178.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -84.27 -29.7 26.23 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.702 -0.681 . . . . 0.5 111.534 -174.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 97.9 t -87.9 -56.63 5.02 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 N-CA-C 112.336 0.495 . . . . 0.3 112.336 -175.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.529 HG23 ' HA ' ' A' ' 42' ' ' MET . 53.6 t -83.03 -67.26 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 N-CA-C 112.076 0.399 . . . . 0.26 112.076 -171.404 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.452 HG12 ' O ' ' A' ' 42' ' ' MET . 2.5 p -72.76 -34.13 46.13 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 C-N-CA 120.822 -0.351 . . . . 0.83 111.7 -171.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 43' ' ' GLN . 0.0 OUTLIER -61.48 -35.4 77.55 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.778 0.323 . . . . 2.4 110.779 179.196 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.419 HG21 ' HE3' ' A' ' 136' ' ' LYS . 27.3 m -80.75 -37.77 29.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.454 -0.339 . . . . 0.55 110.878 178.203 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.691 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -61.47 -40.78 95.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.903 0.383 . . . . 0.33 110.03 177.417 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 23.2 t-105 -64.73 -31.63 72.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.932 -0.576 . . . . 0.39 111.385 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.6 mttt -79.74 -9.83 59.7 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 111.815 0.302 . . . . 2.24 111.815 -175.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 10.5 t-80 -69.1 129.67 40.56 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.588 -0.523 . . . . 0.39 109.588 176.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.2 mm-40 -81.34 9.4 7.23 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.938 0.399 . . . . 1.91 111.658 -173.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -110.45 -3.52 16.02 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.303 0.573 . . . . 0.93 109.626 173.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.744 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -92.79 9.11 36.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.607 -0.724 . . . . 0.28 110.642 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.471 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 55.9 p-90 -64.31 -31.43 5.93 Favored Pre-proline 0 CA--C 1.546 0.803 0 N-CA-C 113.954 1.094 . . . . 0.58 113.954 -175.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.471 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 10.8 Cg_exo -73.11 -4.4 15.35 Favored 'Trans proline' 0 C--N 1.363 1.324 0 CA-C-N 121.151 1.447 . . . . 0.47 111.946 176.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -110.19 19.38 18.97 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.173 0.511 . . . . 1.11 110.008 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 8.2 m-30 -85.84 -8.86 57.81 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.722 -0.672 . . . . 0.63 110.434 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.09 131.42 19.78 Favored Pre-proline 0 C--N 1.327 -0.403 0 CA-C-N 116.282 -0.417 . . . . 1.63 110.877 -172.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -67.58 154.74 72.68 Favored 'Trans proline' 0 C--O 1.236 0.398 0 C-N-CA 122.689 2.26 . . . . 0.87 113.044 -178.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 9.4 t -97.61 101.94 12.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.672 -0.694 . . . . 0.88 109.491 -178.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.444 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.0 OUTLIER -108.48 7.33 26.83 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.619 -0.719 . . . . 1.85 110.84 -178.26 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 86.05 -21.62 0.21 Allowed 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 114.737 -1.12 . . . . 1.29 112.29 178.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.7 mt -113.11 -42.69 4.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 O-C-N 122.224 -0.297 . . . . 1.89 111.105 -178.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 53.7 tptt -52.91 -54.61 32.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.14 -0.482 . . . . 2.99 110.975 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.405 ' HB3' HD22 ' A' ' 70' ' ' LEU . 9.4 tp -93.48 2.01 56.6 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.263 -0.426 . . . . 1.66 110.605 178.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 56.29 71.78 0.54 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 115.618 -0.719 . . . . 1.74 110.648 -177.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.538 ' HG ' ' CD1' ' A' ' 73' ' ' TYR . 0.0 OUTLIER -132.35 75.01 74.98 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.168 -0.924 . . . . 1.61 109.921 -175.614 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -73.17 -37.06 3.65 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.561 2.174 . . . . 1.3 113.416 -173.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -91.48 -0.91 57.67 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.244 0.545 . . . . 1.97 110.937 -176.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.538 ' CD1' ' HG ' ' A' ' 70' ' ' LEU . 0.9 OUTLIER -65.71 -43.34 89.44 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.491 -0.777 . . . . 1.13 110.768 179.369 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -76.86 10.41 2.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.664 -0.698 . . . . 0.91 112.006 -173.573 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.6 mmtt -97.87 -47.85 5.4 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.125 -0.694 . . . . 2.86 109.125 176.289 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.7 mp -89.09 -52.63 10.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.322 -0.854 . . . . 1.0 110.608 -179.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 22.9 mm -91.01 97.43 7.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-O 121.043 0.449 . . . . 0.75 109.879 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.3 mtmt -75.04 -11.19 60.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.887 -0.597 . . . . 1.99 111.13 -177.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -122.13 82.67 44.64 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 115.985 -0.552 . . . . 2.05 110.212 177.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -76.71 72.7 5.57 Favored 'Trans proline' 0 CA--C 1.53 0.28 0 C-N-CA 122.91 2.406 . . . . 0.89 112.016 -178.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -110.06 154.39 23.29 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.49 0.662 . . . . 0.82 110.924 -175.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.433 ' O ' HG12 ' A' ' 86' ' ' ILE . 13.9 p-10 -133.61 -129.21 0.17 Allowed 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 114.635 -1.166 . . . . 1.42 109.23 -173.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -120.44 -18.21 7.94 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.514 -0.55 . . . . 0.8 109.514 177.322 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -78.41 -35.59 32.79 Favored Glycine 0 N--CA 1.439 -1.13 0 N-CA-C 109.642 -1.383 . . . . 0.32 109.642 177.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 23.4 m -71.68 -35.54 70.31 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-N 115.254 -0.473 . . . . 0.95 110.63 174.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.433 HG12 ' O ' ' A' ' 82' ' ' ASP . 0.2 OUTLIER -62.83 -52.88 53.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 N-CA-C 109.256 -0.646 . . . . 0.97 109.256 176.914 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.68 -25.5 67.36 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.945 -0.57 . . . . 1.15 111.104 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.477 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 14.9 tttp -68.54 -51.43 42.97 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 120.518 0.199 . . . . 2.46 110.65 179.386 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 11.4 mtp180 -66.54 -28.8 68.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.911 0.386 . . . . 1.16 110.683 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.717 ' HG ' ' SG ' ' A' ' 101' ' ' CYS . 5.6 mt -66.44 -58.55 5.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.936 -0.574 . . . . 0.49 110.96 173.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -68.19 -22.94 64.79 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.204 -0.453 . . . . 1.39 111.384 -176.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.477 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 7.6 t30 -89.38 -7.32 55.48 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.294 -0.412 . . . . 1.3 110.715 178.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 56.76 67.0 1.05 Allowed 'General case' 0 N--CA 1.464 0.251 0 O-C-N 123.648 0.593 . . . . 1.75 110.713 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . 0.732 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 14.1 t80 -77.87 -32.25 51.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.556 -0.747 . . . . 0.96 111.664 -178.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.424 ' CE2' ' HD2' ' A' ' 94' ' ' TYR . 0.0 OUTLIER -127.68 -172.72 2.74 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.612 0.72 . . . . 1.28 111.717 -175.897 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . 0.509 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 2.2 t-105 -76.17 -59.8 2.61 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 114.236 -1.347 . . . . 1.05 111.087 -177.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 8.2 m -128.31 166.37 18.75 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.999 0.428 . . . . 1.0 111.567 -172.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.783 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -70.5 -12.56 61.65 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.297 -0.411 . . . . 0.66 111.358 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . 0.4 ' HA ' ' SD ' ' A' ' 102' ' ' MET . 0.1 OUTLIER -62.13 -22.79 66.13 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.387 0.613 . . . . 0.85 109.887 174.499 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -81.14 -44.95 17.15 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.411 -0.813 . . . . 2.44 110.348 176.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.717 ' SG ' ' HG ' ' A' ' 90' ' ' LEU . 1.6 t -69.49 -25.21 63.95 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.106 -0.497 . . . . 0.95 111.53 -176.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.4 ' SD ' ' HA ' ' A' ' 99' ' ' SER . 1.1 ptm -66.74 -16.75 64.46 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.637 -0.425 . . . . 1.13 110.292 177.269 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -78.5 -44.01 25.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 2.96 110.594 177.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . 0.571 ' OD1' ' HA ' ' A' ' 101' ' ' CYS . 0.4 OUTLIER -75.07 -31.27 61.21 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.847 -0.427 . . . . 1.87 109.847 177.95 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.691 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -54.71 -51.54 65.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.807 -0.633 . . . . 0.38 109.945 170.336 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 -60.43 -46.01 91.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.398 -0.819 . . . . 0.97 110.026 176.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 63.3 m -54.69 -45.97 74.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.595 -0.73 . . . . 0.43 111.742 -177.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -54.26 -45.68 72.48 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 120.769 0.318 . . . . 0.88 110.73 176.094 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -64.94 -47.3 78.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.834 -0.621 . . . . 0.29 111.049 -178.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.31 -41.29 96.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.944 0.402 . . . . 0.66 110.686 -178.644 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -52.06 -46.05 64.98 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.374 -0.83 . . . . 1.84 110.547 177.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . 0.475 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 0.0 OUTLIER -70.32 -37.74 74.78 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.92 -0.582 . . . . 0.63 110.855 -178.68 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -71.7 -32.77 68.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.625 -0.261 . . . . 0.81 111.353 -177.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 76.9 mt -73.32 -57.98 5.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.531 -0.304 . . . . 0.55 111.33 -177.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -70.32 -41.55 73.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.381 -0.372 . . . . 1.22 111.318 -174.202 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . 0.475 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 71.7 m-80 -86.28 168.14 14.18 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.926 0.393 . . . . 1.04 111.031 -174.273 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.04 147.27 83.4 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 115.984 -0.553 . . . . 3.47 110.397 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_endo -60.35 -21.24 66.52 Favored 'Trans proline' 0 C--N 1.343 0.241 0 C-N-CA 122.447 2.098 . . . . 0.96 111.959 177.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.15 34.82 4.79 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.059 -0.519 . . . . 1.23 110.638 176.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.512 ' OD1' ' HA2' ' B' ' 313' ' ' GLY . 2.3 t70 -83.84 167.48 17.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.882 -0.599 . . . . 1.34 110.673 179.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -67.28 -49.67 63.4 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.868 -0.605 . . . . 1.44 110.49 -177.285 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -64.3 -40.05 87.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.046 -0.525 . . . . 0.42 110.655 179.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 6.6 t -65.45 -38.68 83.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.057 0.456 . . . . 0.35 110.681 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.31 -28.29 68.0 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.029 -0.532 . . . . 0.52 110.276 177.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . 0.472 ' O ' HD13 ' A' ' 129' ' ' LEU . 3.1 mtt -82.52 -44.98 15.26 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.764 -0.653 . . . . 0.62 110.582 177.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.41 -33.24 58.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.679 -0.691 . . . . 0.31 111.697 -179.21 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -59.21 -45.87 89.95 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.373 -0.376 . . . . 1.94 110.986 178.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -73.86 -35.5 64.77 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.104 -0.498 . . . . 0.32 110.509 179.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.744 HD21 ' HA ' ' A' ' 56' ' ' ALA . 5.6 mp -61.37 -46.14 91.44 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.42 -0.809 . . . . 0.33 110.615 179.132 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -62.7 -23.87 67.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.321 -0.854 . . . . 1.47 111.831 -176.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.536 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -62.97 -49.63 73.97 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 109.914 -0.402 . . . . 2.24 109.914 -176.77 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.528 HD12 HD23 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -68.94 -30.09 45.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.953 -0.567 . . . . 1.23 110.481 179.577 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.484 ' O ' HG23 ' A' ' 137' ' ' VAL . 34.8 t80 -61.72 -62.88 1.49 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.984 -0.553 . . . . 0.46 110.99 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.8 pp -66.62 -29.91 70.05 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 120.821 0.343 . . . . 0.64 110.534 -175.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.536 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.3 OUTLIER -63.39 -48.79 76.41 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.623 -0.717 . . . . 1.61 111.203 -179.549 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . 0.419 ' HE3' HG21 ' A' ' 49' ' ' THR . 2.8 mttm -80.89 -14.03 58.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.403 -0.362 . . . . 1.52 111.285 -177.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 133' ' ' PHE . 30.9 t -82.53 -34.99 12.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.052 0.453 . . . . 0.35 109.882 178.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -66.44 -19.38 65.78 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.197 0.522 . . . . 0.5 110.432 178.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -100.05 10.61 41.01 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.991 -0.55 . . . . 1.76 111.172 -179.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -61.21 152.08 73.46 Favored Pre-proline 0 N--CA 1.466 0.341 0 CA-C-N 116.267 -0.424 . . . . 0.86 111.055 175.167 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -68.61 121.38 8.3 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.384 2.056 . . . . 0.67 112.074 179.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -71.97 1.95 6.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.32 -0.4 . . . . 2.91 112.065 -176.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.441 ' HB2' HG23 ' A' ' 145' ' ' VAL . 1.2 mt-10 -97.69 -41.3 8.17 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 116.387 -0.37 . . . . 2.7 111.678 -171.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 60.55 65.7 1.02 Allowed 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.66 0.6 . . . . 2.34 109.979 -175.553 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . 0.441 HG23 ' HB2' ' A' ' 143' ' ' GLU . 16.6 t -98.21 127.78 50.32 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.699 -0.682 . . . . 0.99 110.294 -177.524 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.634 ' HG3' HG22 ' A' ' 36' ' ' THR . 8.8 tt0 -71.24 138.86 49.79 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.892 -0.41 . . . . 1.53 109.892 175.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 40.7 mt . . . . . 0 C--O 1.247 0.953 0 CA-C-O 118.395 -0.812 . . . . 1.57 110.516 -176.146 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.564 0 N-CA-C 111.453 -0.659 . . . . 2.17 111.453 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 313' ' ' GLY . . . . . 0.512 ' HA2' ' OD1' ' A' ' 120' ' ' ASP . . . 97.39 -5.51 62.77 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.705 -0.759 . . . . 1.97 112.897 178.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -143.12 125.83 15.98 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.654 0.264 . . . . 3.58 110.626 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.178 0 CA-C-N 115.421 -0.808 . . . . 4.6 110.653 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo . . . . . 0 N--CA 1.481 0.747 0 N-CA-C 109.919 -0.839 . . . . 6.18 109.919 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.92 144.17 33.03 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.978 -0.379 . . . . 5.71 109.978 177.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 145.89 -115.7 0.84 Allowed Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.926 -0.654 . . . . 3.45 111.743 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -144.96 173.3 11.99 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.919 -0.4 . . . . 2.44 109.919 178.074 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.601 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 3.5 mt-10 -55.3 122.82 11.96 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 121.066 0.46 . . . . 1.64 111.555 175.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 5.7 p -106.98 -18.57 7.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 115.653 -0.703 . . . . 0.93 110.158 177.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 73.1 m -166.95 142.57 4.26 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.551 -0.749 . . . . 1.61 109.347 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.463 ' HB3' ' CB ' ' A' ' 31' ' ' LYS . 34.8 t-20 -145.97 127.91 7.73 Favored Pre-proline 0 C--N 1.319 -0.754 0 N-CA-C 109.663 -0.495 . . . . 1.6 109.663 178.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -63.42 -36.12 57.06 Favored 'Trans proline' 0 N--CA 1.478 0.587 0 C-N-CA 123.224 2.616 . . . . 1.87 112.783 -177.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.5 m -80.35 -19.68 45.89 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 115.576 -0.738 . . . . 2.18 110.324 -178.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.463 ' CB ' ' HB3' ' A' ' 28' ' ' ASN . 11.1 tttp -90.33 129.27 46.02 Favored Pre-proline 0 C--N 1.321 -0.643 0 CA-C-N 115.114 -0.948 . . . . 2.75 110.254 179.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.455 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 35.6 Cg_endo -69.17 135.72 32.63 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 121.96 1.773 . . . . 1.38 112.284 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -145.46 86.05 0.18 Allowed Glycine 0 N--CA 1.446 -0.665 0 CA-C-N 115.317 -0.856 . . . . 0.97 111.002 -178.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.498 ' HG3' ' CE2' ' A' ' 96' ' ' TRP . 1.7 mmm180 -97.97 163.38 12.8 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 120.879 0.371 . . . . 1.93 110.498 -176.161 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.424 ' HA ' HD22 ' A' ' 39' ' ' LEU . 4.3 mtmt -104.93 108.92 20.69 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.084 -0.507 . . . . 2.64 110.121 178.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.447 HG22 ' HG3' ' A' ' 146' ' ' GLU . 1.3 p -111.94 166.89 10.82 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.889 0.376 . . . . 0.68 110.864 176.227 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.544 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 60.3 t30 -59.75 -37.41 78.92 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.928 -0.578 . . . . 1.47 110.893 178.249 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -71.07 -37.47 72.48 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.854 0.359 . . . . 1.04 110.409 -178.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.424 HD22 ' HA ' ' A' ' 35' ' ' LYS . 0.6 OUTLIER -63.18 -53.27 55.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.117 -0.492 . . . . 0.8 110.557 178.507 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -69.48 -21.43 63.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.093 -0.503 . . . . 1.75 110.81 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.544 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 52.8 t80 -64.36 -63.41 1.15 Allowed 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 116.003 -0.544 . . . . 0.64 110.868 178.307 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.609 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.5 OUTLIER -57.91 -31.45 66.79 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.534 -0.303 . . . . 1.13 110.867 -174.633 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -59.69 -55.24 36.83 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.909 -0.587 . . . . 1.3 111.209 178.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -86.56 -28.89 23.04 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 112.28 0.474 . . . . 0.5 112.28 -176.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 95.1 t -89.23 -57.51 4.19 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 N-CA-C 112.479 0.548 . . . . 0.3 112.479 -175.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.609 HG23 ' HA ' ' A' ' 42' ' ' MET . 39.7 t -81.47 -65.63 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 111.739 0.274 . . . . 0.26 111.739 -169.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.459 HG12 ' O ' ' A' ' 42' ' ' MET . 2.6 p -67.53 -34.26 67.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 C-N-CA 120.851 -0.34 . . . . 0.83 111.548 -174.253 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.4 mmtt -60.03 -39.5 86.08 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 122.243 -0.285 . . . . 2.4 111.574 177.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.3 m -75.97 -36.12 59.38 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.67 0.272 . . . . 0.55 110.713 178.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.597 HD23 HD12 ' A' ' 132' ' ' ILE . 0.1 OUTLIER -59.88 -37.51 79.58 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-O 121.406 0.622 . . . . 0.33 109.541 174.312 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 16.7 t-105 -63.9 -27.36 69.1 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.041 -0.982 . . . . 0.39 112.096 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.1 mtpt -88.97 0.79 56.34 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.038 0.384 . . . . 2.24 112.038 -174.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.449 ' CD2' HD11 ' A' ' 132' ' ' ILE . 8.7 t-80 -76.76 134.51 39.13 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.893 -0.41 . . . . 0.39 109.893 177.028 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 40.1 mm-40 -72.42 -13.39 61.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.417 -0.356 . . . . 1.91 111.743 -175.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.424 ' HB2' ' ND1' ' A' ' 53' ' ' HIS . 3.1 m-85 -96.08 -1.79 47.97 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.152 0.501 . . . . 0.93 110.341 178.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.594 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -97.28 13.9 27.91 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.411 0.624 . . . . 0.28 110.311 -179.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.623 ' HA ' ' CE2' ' A' ' 60' ' ' TYR . 54.3 p-90 -65.91 -33.6 7.45 Favored Pre-proline 0 CA--C 1.545 0.775 0 N-CA-C 113.787 1.032 . . . . 0.58 113.787 -174.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.477 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 1.3 Cg_endo -85.13 12.0 3.2 Favored 'Trans proline' 0 C--N 1.359 1.115 0 C-N-CA 121.695 1.597 . . . . 0.47 111.325 176.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -110.57 -0.39 17.32 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.389 -0.823 . . . . 1.11 110.781 -177.241 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.623 ' CE2' ' HA ' ' A' ' 57' ' ' TRP . 16.3 m-30 -82.21 -23.24 35.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.878 0.37 . . . . 0.63 111.179 -178.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.98 127.53 27.82 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.214 -0.448 . . . . 1.63 110.717 -174.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -69.79 158.22 57.65 Favored 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 122.835 2.357 . . . . 0.87 112.843 -177.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 41.7 t -77.07 94.45 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.618 0.723 . . . . 0.88 110.167 178.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.408 ' CG ' ' H ' ' A' ' 67' ' ' LYS . 0.4 OUTLIER -91.82 -10.24 40.54 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.103 -0.953 . . . . 1.85 110.507 178.499 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 80.37 -32.27 0.12 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.882 0.873 . . . . 1.29 112.646 176.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 24.0 mt -99.94 -57.24 4.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 O-C-N 122.122 -0.361 . . . . 1.89 111.724 -175.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.408 ' H ' ' CG ' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -66.99 -33.46 75.62 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.98 0.419 . . . . 2.99 110.92 -176.701 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.448 HD12 ' HA ' ' A' ' 68' ' ' LEU . 2.8 tp -90.27 -5.85 55.84 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.121 -0.49 . . . . 1.66 110.843 177.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 57.44 57.15 4.55 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.843 -0.617 . . . . 1.74 111.242 -178.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.423 ' O ' ' HB2' ' A' ' 73' ' ' TYR . 25.9 mt -129.07 64.51 71.07 Favored Pre-proline 0 C--N 1.326 -0.419 0 CA-C-N 115.564 -0.744 . . . . 1.61 110.812 176.486 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -77.23 -27.74 6.37 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.322 2.015 . . . . 1.3 111.891 -179.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -84.52 2.98 38.65 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.653 -0.703 . . . . 1.97 110.114 -179.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.442 ' HA ' ' CE1' ' A' ' 115' ' ' TYR . 1.5 t80 -65.19 -45.46 84.71 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.418 -0.81 . . . . 1.13 110.929 179.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 85.2 m-70 -78.45 5.97 9.54 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.595 -0.73 . . . . 0.91 111.59 -172.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.0 mmmt -89.77 -22.84 21.95 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 108.989 -0.745 . . . . 2.86 108.989 178.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 53.6 mt -118.3 -56.09 3.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 CA-C-N 115.257 -0.883 . . . . 1.0 110.332 179.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 37.5 mm -88.83 107.46 17.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.959 -0.564 . . . . 0.75 110.564 -177.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.95 -10.43 59.27 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.895 -0.593 . . . . 1.99 110.889 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -117.58 82.94 16.45 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 116.004 -0.544 . . . . 2.05 110.109 176.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -76.32 91.05 1.14 Allowed 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.755 2.304 . . . . 0.89 112.0 -176.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -129.94 171.22 12.99 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.457 0.646 . . . . 0.82 111.245 -175.016 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.424 ' O ' HG12 ' A' ' 86' ' ' ILE . 12.9 p-10 -153.98 -134.81 0.05 OUTLIER 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.519 -1.219 . . . . 1.42 108.248 -174.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 1.2 ttm -113.25 -19.92 11.6 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 109.123 -0.695 . . . . 0.8 109.123 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.425 ' O ' ' HB2' ' A' ' 88' ' ' LYS . . . -79.81 -30.88 41.84 Favored Glycine 0 N--CA 1.44 -1.093 0 N-CA-C 109.863 -1.295 . . . . 0.32 109.863 178.006 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 28.5 m -77.14 -29.83 54.82 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.441 -0.379 . . . . 0.95 111.047 174.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.539 HD12 ' HB2' ' A' ' 104' ' ' ASP . 0.2 OUTLIER -65.52 -51.7 60.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 109.305 -0.628 . . . . 0.97 109.305 177.076 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.539 ' O ' ' HG2' ' A' ' 91' ' ' GLU . 0.0 OUTLIER -63.91 -27.35 69.09 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.156 -0.474 . . . . 1.15 110.164 177.548 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.558 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 0.8 OUTLIER -63.09 -52.27 63.31 Favored 'General case' 0 C--O 1.227 -0.09 0 CA-C-N 116.129 -0.487 . . . . 2.46 110.616 177.454 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 5.2 mmm-85 -63.91 -33.88 76.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.748 0.309 . . . . 1.16 110.724 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.8 mt -66.58 -57.89 6.31 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.936 -0.575 . . . . 0.49 111.598 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 11.4 pt-20 -78.55 -14.99 59.07 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.197 0.443 . . . . 1.39 112.197 -173.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.558 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 1.0 OUTLIER -90.41 -4.02 57.3 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 110.058 -0.349 . . . . 1.3 110.058 174.977 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.49 58.99 2.75 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 115.408 -0.815 . . . . 1.75 111.347 179.361 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . 0.601 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 24.7 t80 -71.85 -45.12 62.46 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.999 0.428 . . . . 0.96 110.773 179.349 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -108.59 -171.71 1.91 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.9 -0.591 . . . . 1.28 110.896 -175.263 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . 0.498 ' CE2' ' HG3' ' A' ' 34' ' ' ARG . 2.0 t90 -86.9 -41.59 13.86 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.556 -0.747 . . . . 1.05 110.394 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 28.6 t -148.96 175.67 11.09 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.255 0.55 . . . . 1.0 111.62 -172.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.41 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -75.0 -10.93 59.94 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 115.618 -0.719 . . . . 0.66 110.653 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.66 -33.25 72.54 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.792 0.806 . . . . 0.85 109.493 173.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -82.19 -35.31 28.46 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 114.647 -1.16 . . . . 2.44 110.144 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.511 ' HA ' ' OD1' ' A' ' 104' ' ' ASP . 48.5 t -64.76 -24.61 67.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.984 -0.553 . . . . 0.95 110.709 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.5 mtt -59.73 -25.9 65.2 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.079 -0.509 . . . . 1.13 110.282 176.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.404 ' OE1' ' HA ' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -75.61 -47.36 26.92 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.025 -0.534 . . . . 2.96 110.896 179.981 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . 0.539 ' HB2' HD12 ' A' ' 86' ' ' ILE . 0.2 OUTLIER -70.77 -37.21 73.36 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.806 -0.357 . . . . 1.87 110.472 -179.367 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.573 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -56.09 -48.22 76.53 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.153 0.502 . . . . 0.38 110.043 173.543 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -64.54 -47.29 79.33 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.619 -0.719 . . . . 0.97 110.508 177.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 90.1 m -52.27 -45.4 65.44 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.372 -0.376 . . . . 0.43 111.332 -178.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 6.2 ttp -54.64 -38.97 67.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.348 -0.387 . . . . 0.88 111.453 179.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -78.78 -51.82 9.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.739 0.304 . . . . 0.29 110.605 -175.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.45 -39.72 73.61 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.171 -0.468 . . . . 0.66 111.165 178.267 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -53.82 -49.3 68.68 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.073 -0.512 . . . . 1.84 110.964 178.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.46 -38.16 90.04 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 116.391 -0.368 . . . . 0.63 110.612 179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.414 ' HD1' HG22 ' A' ' 123' ' ' VAL . 15.2 m-85 -67.85 -33.19 74.28 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.288 -0.414 . . . . 0.81 111.135 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 70.0 mt -80.79 -50.65 16.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.36 -0.382 . . . . 0.55 111.971 -176.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.442 ' CE1' ' HA ' ' A' ' 73' ' ' TYR . 64.3 t80 -68.3 -34.37 76.02 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.862 0.363 . . . . 1.22 111.154 -175.491 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 -98.7 -163.73 1.07 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.991 -0.549 . . . . 1.04 110.892 -175.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.67 156.51 44.72 Favored Pre-proline 0 C--N 1.325 -0.464 0 N-CA-C 109.999 -0.371 . . . . 3.47 109.999 179.545 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -59.41 -21.64 62.16 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.333 2.022 . . . . 0.96 111.99 176.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.94 8.64 42.17 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.55 -0.75 . . . . 1.23 111.56 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.548 ' OD2' ' HA2' ' B' ' 313' ' ' GLY . 3.3 t70 -76.04 155.98 34.39 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.186 0.517 . . . . 1.34 111.401 -175.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.47 -42.73 74.45 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.144 -0.935 . . . . 1.44 109.889 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.531 HG22 ' OD1' ' A' ' 120' ' ' ASP . 2.4 tp -66.17 -33.75 65.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 115.977 -0.556 . . . . 0.42 110.535 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.414 HG22 ' HD1' ' A' ' 113' ' ' TYR . 2.8 t -69.94 -41.4 79.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.128 0.49 . . . . 0.35 110.131 177.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.29 -33.52 71.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.92 -0.582 . . . . 0.52 109.968 177.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . 0.462 ' O ' HD13 ' A' ' 129' ' ' LEU . 21.5 mtt -76.49 -46.6 26.0 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.524 -0.762 . . . . 0.62 110.746 178.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -52.83 -36.71 59.02 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.284 -0.416 . . . . 0.31 111.634 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -60.73 -39.11 87.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.132 -0.486 . . . . 1.94 111.272 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -79.91 -36.9 35.76 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.153 0.501 . . . . 0.32 110.438 178.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.594 HD21 ' HA ' ' A' ' 56' ' ' ALA . 5.2 mp -60.46 -40.2 90.33 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.46 -0.791 . . . . 0.33 110.697 179.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -60.52 -24.54 65.43 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.943 -0.571 . . . . 1.47 111.961 -178.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.475 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -65.15 -39.41 92.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.681 0.277 . . . . 2.24 110.41 -177.521 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.597 HD12 HD23 ' A' ' 50' ' ' LEU . 11.3 mt -67.47 -28.55 42.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.18 -0.464 . . . . 1.23 110.846 -178.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.438 ' O ' HG23 ' A' ' 137' ' ' VAL . 33.3 t80 -61.46 -63.05 1.41 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.955 -0.566 . . . . 0.46 110.487 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.3 pp -65.89 -25.3 67.1 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.334 0.588 . . . . 0.64 110.51 -178.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.475 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -63.95 -34.15 77.33 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.484 -0.78 . . . . 1.61 111.446 -179.339 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . 0.577 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -102.13 -21.98 14.31 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.891 0.377 . . . . 1.52 111.036 -178.459 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 133' ' ' PHE . 40.9 t -73.13 -31.28 34.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.078 0.466 . . . . 0.35 110.518 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -72.25 -6.35 42.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.322 0.582 . . . . 0.5 110.36 178.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -111.55 2.79 17.58 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.541 -0.754 . . . . 1.76 110.117 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . 0.424 ' HG3' ' HA ' ' A' ' 137' ' ' VAL . 0.1 OUTLIER -65.54 149.85 96.73 Favored Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 115.941 -0.572 . . . . 0.86 111.623 -179.736 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -84.84 87.26 1.07 Allowed 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.435 2.09 . . . . 0.67 111.165 177.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 6.6 mm-40 -70.47 11.03 0.39 Allowed 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.407 0.521 . . . . 2.91 112.407 -174.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -83.76 -39.6 19.86 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 108.85 -0.796 . . . . 2.7 108.85 173.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 67.82 98.55 0.05 Allowed 'General case' 0 C--O 1.231 0.115 0 CA-C-N 114.263 -1.335 . . . . 2.34 111.017 -177.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 9.4 t -100.55 107.47 21.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.746 -0.661 . . . . 0.99 109.304 175.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.447 ' HG3' HG22 ' A' ' 36' ' ' THR . 5.7 tt0 -66.21 140.13 58.15 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.741 -0.466 . . . . 1.53 109.741 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 11.1 mt . . . . . 0 C--O 1.246 0.906 0 CA-C-O 118.661 -0.685 . . . . 1.57 110.205 -177.308 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.695 0 N-CA-C 111.687 -0.565 . . . . 2.17 111.687 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 313' ' ' GLY . . . . . 0.548 ' HA2' ' OD2' ' A' ' 120' ' ' ASP . . . 99.71 -38.34 3.16 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.796 -0.716 . . . . 1.97 112.115 -179.113 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -128.8 79.29 1.9 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.214 0.531 . . . . 3.58 110.446 179.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.645 -0.693 . . . . 4.6 110.273 -177.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo . . . . . 0 N--CA 1.482 0.813 0 N-CA-C 109.99 -0.812 . . . . 6.18 109.99 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -101.17 138.81 37.71 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.428 -0.582 . . . . 5.71 109.428 177.656 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.77 -32.79 5.78 Favored Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 110.703 -0.959 . . . . 3.45 110.703 -174.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 92.6 p -78.46 177.35 8.59 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.632 -0.784 . . . . 2.44 109.942 173.395 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.506 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 9.6 mt-10 -57.28 127.35 31.56 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.255 0.55 . . . . 1.64 112.125 177.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.456 ' O ' ' HB2' ' A' ' 94' ' ' TYR . 4.4 p -123.49 -13.12 6.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.118 -0.946 . . . . 0.93 109.157 172.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.7 m -173.66 116.4 0.25 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 114.976 -1.011 . . . . 1.61 108.855 -179.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.469 ' OD1' ' HD2' ' A' ' 29' ' ' PRO . 20.3 t30 -140.5 132.69 14.39 Favored Pre-proline 0 C--N 1.319 -0.734 0 C-N-CA 120.918 -0.313 . . . . 1.6 110.75 -173.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.469 ' HD2' ' OD1' ' A' ' 28' ' ' ASN . 70.7 Cg_endo -69.42 -38.76 8.08 Favored 'Trans proline' 0 N--CA 1.474 0.368 0 C-N-CA 123.044 2.496 . . . . 1.87 112.002 177.332 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 7.2 m -71.65 -17.22 62.27 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.392 -0.822 . . . . 2.18 110.571 -179.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.8 tmtm? -101.55 110.29 61.39 Favored Pre-proline 0 C--N 1.318 -0.802 0 CA-C-N 115.348 -0.842 . . . . 2.75 109.453 175.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.633 ' HB2' ' CZ3' ' A' ' 96' ' ' TRP . 24.5 Cg_endo -63.54 133.95 42.2 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 121.549 1.5 . . . . 1.38 111.978 -179.01 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -160.18 80.67 0.15 Allowed Glycine 0 N--CA 1.44 -1.099 0 CA-C-N 115.023 -0.989 . . . . 0.97 110.917 -177.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.1 mtm180 -73.92 -117.09 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.95 0.405 . . . . 1.93 110.186 -179.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -175.06 129.04 0.29 Allowed 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 109.447 -0.575 . . . . 2.64 109.447 178.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.779 HG22 ' HG3' ' A' ' 146' ' ' GLU . 4.1 p -118.94 159.76 23.22 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 109.841 -0.429 . . . . 0.68 109.841 174.002 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 46.3 t30 -57.71 -36.47 72.06 Favored 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 110.091 -0.337 . . . . 1.47 110.091 178.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.429 ' OE1' ' HB3' ' A' ' 140' ' ' MET . 0.9 OUTLIER -57.05 -44.09 82.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.696 -0.683 . . . . 1.04 110.922 178.32 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.515 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.4 OUTLIER -63.41 -55.63 22.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.059 -0.518 . . . . 0.8 110.822 -179.052 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -62.98 -33.98 76.55 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.849 -0.614 . . . . 1.75 110.516 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -57.74 -63.38 1.26 Allowed 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 115.973 -0.558 . . . . 0.64 110.388 176.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.561 ' HB2' ' SD ' ' A' ' 140' ' ' MET . 8.6 ttp -59.81 -30.66 69.07 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.41 -0.359 . . . . 1.13 110.54 -175.656 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.552 ' HB2' HD22 ' A' ' 90' ' ' LEU . 3.0 tt0 -61.5 -55.92 25.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.665 -0.698 . . . . 1.3 111.101 178.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 62.6 m-80 -85.72 -27.24 25.41 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.092 0.404 . . . . 0.5 112.092 -176.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 94.9 t -89.36 -57.73 4.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 N-CA-C 112.305 0.483 . . . . 0.3 112.305 -177.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.668 HG22 ' HB3' ' A' ' 136' ' ' LYS . 48.0 t -82.15 -66.66 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 N-CA-C 112.143 0.423 . . . . 0.26 112.143 -169.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.462 HG12 ' O ' ' A' ' 42' ' ' MET . 0.9 OUTLIER -65.97 -37.18 79.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 C-N-CA 120.707 -0.397 . . . . 0.83 111.248 -174.248 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.533 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 0.2 OUTLIER -56.7 -39.95 74.76 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.544 0.212 . . . . 2.4 111.164 178.702 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 12.2 m -77.47 -35.78 53.44 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 121.131 -0.228 . . . . 0.55 111.158 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.684 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -62.02 -39.05 90.95 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.269 0.557 . . . . 0.33 109.581 175.012 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 33.1 t-105 -62.74 -29.35 70.62 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.549 -0.751 . . . . 0.39 111.235 177.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.533 ' HG3' ' O ' ' A' ' 48' ' ' LYS . 12.7 mtpt -82.5 -5.54 58.78 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 111.949 0.352 . . . . 2.24 111.949 -175.394 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.525 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 4.7 t-80 -74.71 128.19 34.95 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.01 0.433 . . . . 0.39 110.028 177.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -82.61 15.7 2.47 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.247 -0.433 . . . . 1.91 111.445 -176.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.525 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.4 OUTLIER -112.15 -7.42 14.05 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.175 -0.676 . . . . 0.93 109.175 171.296 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.597 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -96.24 11.42 34.58 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.63 -0.713 . . . . 0.28 110.498 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.489 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 42.9 p-90 -63.27 -33.33 10.32 Favored Pre-proline 0 CA--C 1.545 0.778 0 N-CA-C 113.849 1.055 . . . . 0.58 113.849 -175.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.489 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 10.3 Cg_exo -73.37 -13.76 25.35 Favored 'Trans proline' 0 C--N 1.356 0.956 0 C-N-CA 121.423 1.415 . . . . 0.47 111.88 176.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -94.91 -0.89 53.58 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.986 -0.552 . . . . 1.11 110.665 -178.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 12.5 m-30 -66.64 -34.53 78.07 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.017 -0.538 . . . . 0.63 110.987 -179.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -94.68 138.35 22.26 Favored Pre-proline 0 C--N 1.325 -0.479 0 CA-C-N 115.857 -0.611 . . . . 1.63 110.663 -175.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.617 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 41.2 Cg_endo -69.38 141.95 48.23 Favored 'Trans proline' 0 C--O 1.237 0.468 0 C-N-CA 122.523 2.149 . . . . 0.87 112.65 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.414 HG11 ' CD2' ' A' ' 73' ' ' TYR . 53.1 t -77.32 87.93 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.798 0.809 . . . . 0.88 109.319 177.243 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.45 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.0 OUTLIER -102.98 1.92 34.29 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.286 -0.87 . . . . 1.85 110.41 -178.015 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.45 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 85.72 -21.31 0.22 Allowed 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 114.804 -1.089 . . . . 1.29 112.186 177.091 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 35.0 mm -112.26 -49.37 5.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 120.859 0.361 . . . . 1.89 111.002 -178.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.43 -36.32 73.46 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.004 -0.544 . . . . 2.99 111.699 -178.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -108.58 4.8 24.43 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.328 -0.396 . . . . 1.66 110.456 178.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 55.33 52.27 11.69 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 115.349 -0.842 . . . . 1.74 111.597 -179.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 19.2 mt -127.05 64.9 62.37 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 116.058 -0.519 . . . . 1.61 111.61 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . 0.42 ' HA ' ' HB1' ' A' ' 65' ' ' ALA . 64.6 Cg_endo -75.76 -20.23 15.59 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 121.956 1.771 . . . . 1.3 110.865 176.667 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -75.78 -19.8 58.72 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.958 -1.019 . . . . 1.97 110.361 179.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.469 ' OH ' ' HB3' ' A' ' 111' ' ' ASN . 0.5 OUTLIER -64.77 -39.07 93.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.336 -0.847 . . . . 1.13 110.299 178.98 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.414 ' HE1' HG12 ' A' ' 63' ' ' VAL . 0.3 OUTLIER -78.29 6.28 8.59 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.507 -0.769 . . . . 0.91 111.456 -174.44 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -97.36 -53.99 3.29 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.096 0.474 . . . . 2.86 109.727 -179.291 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.9 mp -90.53 -47.02 14.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.563 -0.744 . . . . 1.0 110.878 -178.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 26.8 mm -78.18 114.83 19.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.964 -0.562 . . . . 0.75 110.353 -177.187 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.9 mtmm -72.86 -27.01 61.67 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.677 -0.692 . . . . 1.99 111.441 -176.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -127.13 81.78 69.32 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 116.276 -0.42 . . . . 2.05 110.817 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -65.95 93.63 0.27 Allowed 'Trans proline' 0 C--O 1.236 0.392 0 C-N-CA 122.601 2.201 . . . . 0.89 111.94 178.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 1.6 mmt -126.26 157.55 38.02 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.893 -0.594 . . . . 0.82 110.335 -178.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.617 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 1.2 p-10 -139.65 -121.72 0.12 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.023 -0.989 . . . . 1.42 109.427 -172.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . 0.422 ' SD ' HD13 ' A' ' 50' ' ' LEU . 3.6 ttp -130.72 -17.31 3.23 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.033 0.444 . . . . 0.8 110.434 178.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -88.71 -27.76 23.44 Favored Glycine 0 N--CA 1.442 -0.944 0 N-CA-C 110.235 -1.146 . . . . 0.32 110.235 -179.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -74.23 -36.0 63.9 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.271 -0.464 . . . . 0.95 110.655 176.138 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.438 HG23 ' SG ' ' A' ' 101' ' ' CYS . 75.5 mt -61.73 -53.05 53.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.796 -0.638 . . . . 0.97 110.093 175.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.526 ' O ' ' HG2' ' A' ' 91' ' ' GLU . 0.2 OUTLIER -63.08 -28.18 69.9 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.157 -0.474 . . . . 1.15 111.247 178.843 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.409 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 2.3 tptt -64.36 -47.18 80.3 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.894 0.378 . . . . 2.46 110.581 178.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.505 ' HB3' ' CE2' ' A' ' 95' ' ' TYR . 6.9 mtp180 -65.33 -29.71 70.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.008 -0.542 . . . . 1.16 110.447 178.222 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.552 HD22 ' HB2' ' A' ' 43' ' ' GLN . 12.4 mt -73.22 -54.92 7.24 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.759 -0.655 . . . . 0.49 111.674 -179.139 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.526 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 2.6 pt-20 -66.77 -31.56 72.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.432 -0.349 . . . . 1.39 111.215 -175.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.409 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 0.7 OUTLIER -81.32 -4.78 56.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.33 -0.395 . . . . 1.3 110.507 178.877 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.5 t30 56.82 58.56 4.0 Favored 'General case' 0 CA--C 1.522 -0.097 0 CA-C-N 115.731 -0.668 . . . . 1.75 111.363 -179.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . 0.506 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 62.1 t80 -87.54 -35.2 18.28 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.31 -0.404 . . . . 0.96 111.067 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.505 ' CE2' ' HB3' ' A' ' 89' ' ' ARG . 54.1 m-85 -77.71 168.8 19.36 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-O 121.823 0.821 . . . . 1.28 111.624 -176.031 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . 0.633 ' CZ3' ' HB2' ' A' ' 32' ' ' PRO . 2.0 t90 -87.48 -44.25 11.45 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 114.116 -1.402 . . . . 1.05 109.432 168.166 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.479 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 3.3 t -153.22 170.89 19.45 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 114.949 -1.023 . . . . 1.0 110.265 -170.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.515 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -65.43 -23.43 66.94 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.746 0.308 . . . . 0.66 111.121 -177.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.3 -25.25 67.76 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.09 -0.505 . . . . 0.85 111.03 178.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.406 ' HB3' ' CD1' ' A' ' 95' ' ' TYR . 16.6 tt0 -83.86 -29.5 27.19 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.227 0.537 . . . . 2.44 109.653 179.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.438 ' SG ' HG23 ' A' ' 86' ' ' ILE . 5.2 t -82.45 -30.98 29.7 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.715 -0.675 . . . . 0.95 111.076 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.02 -30.96 69.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.258 -0.428 . . . . 1.13 110.775 -179.533 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -63.59 -43.07 98.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.13 -0.486 . . . . 2.96 110.261 175.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -68.31 -43.16 78.23 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.036 -0.529 . . . . 1.87 109.715 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.684 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -54.92 -52.18 63.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.478 -0.783 . . . . 0.38 110.508 176.138 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -59.78 -40.65 88.98 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.838 -0.619 . . . . 0.97 110.67 178.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.433 ' HA ' ' OG1' ' A' ' 110' ' ' THR . 97.3 m -63.34 -43.71 96.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.118 -0.492 . . . . 0.43 111.276 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -53.49 -44.3 68.9 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.987 0.422 . . . . 0.88 110.82 177.024 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -71.63 -41.08 69.29 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.124 -0.489 . . . . 0.29 111.24 -179.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.433 ' OG1' ' HA ' ' A' ' 107' ' ' THR . 0.1 OUTLIER -65.0 -42.15 94.73 Favored 'General case' 0 CA--C 1.52 -0.21 0 C-N-CA 120.88 -0.328 . . . . 0.66 110.623 -179.851 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . 0.469 ' HB3' ' OH ' ' A' ' 73' ' ' TYR . 59.6 m-20 -48.75 -52.55 23.1 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.656 -0.702 . . . . 1.84 111.114 178.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 1.8 t -56.26 -46.42 79.68 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.694 -0.684 . . . . 0.63 111.573 177.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -73.58 -20.81 60.52 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.83 0.307 . . . . 0.81 111.83 -174.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 89.0 mt -91.8 -55.93 5.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.653 0.263 . . . . 0.55 111.301 -176.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -76.19 -39.98 53.48 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.823 0.344 . . . . 1.22 110.905 -175.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -93.01 150.9 20.22 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.339 -0.391 . . . . 1.04 110.414 -176.232 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 2.9 ttpp -64.98 142.03 98.55 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.859 -0.609 . . . . 3.47 110.195 178.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . 0.44 ' HA ' HG11 ' A' ' 123' ' ' VAL . 16.7 Cg_endo -59.46 -13.1 19.31 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.832 2.355 . . . . 0.96 112.376 178.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -111.45 26.91 10.17 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.119 -0.491 . . . . 1.23 110.811 178.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.412 ' OD1' HG22 ' A' ' 122' ' ' ILE . 6.2 t70 -88.09 158.7 18.5 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.178 -0.465 . . . . 1.34 110.76 179.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . 0.429 ' HB3' ' HG3' ' B' ' 315' ' ' ALY . 0.3 OUTLIER -61.81 -43.66 98.41 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.153 -0.93 . . . . 1.44 110.611 -179.313 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.578 HG21 ' HD2' ' B' ' 312' ' ' ALY . 1.0 OUTLIER -69.16 -36.65 74.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-O 120.998 0.428 . . . . 0.42 110.872 -178.688 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.44 HG11 ' HA ' ' A' ' 118' ' ' PRO . 3.1 t -67.66 -36.52 76.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.075 0.464 . . . . 0.35 110.302 -179.187 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.34 -33.78 71.56 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.812 -0.631 . . . . 0.52 110.112 178.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . 0.421 ' O ' HD13 ' A' ' 129' ' ' LEU . 16.9 mtt -79.61 -42.93 23.86 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.819 -0.628 . . . . 0.62 110.677 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.94 -36.79 65.67 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.042 -0.526 . . . . 0.31 111.755 -178.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -62.43 -40.91 98.09 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.471 . . . . 1.94 111.055 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.04 -37.71 61.62 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.078 0.466 . . . . 0.32 110.523 179.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.597 HD21 ' HA ' ' A' ' 56' ' ' ALA . 1.6 mp -58.85 -39.59 81.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.416 -0.811 . . . . 0.33 110.536 179.037 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -61.47 -25.12 67.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.517 -0.765 . . . . 1.47 112.075 -177.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.517 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -66.45 -39.45 88.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.777 0.322 . . . . 2.24 110.433 -176.924 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.573 HD12 HD23 ' A' ' 50' ' ' LEU . 8.9 mt -70.06 -30.9 45.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.069 -0.514 . . . . 1.23 110.416 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.54 ' O ' HG23 ' A' ' 137' ' ' VAL . 61.5 t80 -59.78 -62.87 1.55 Allowed 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 115.835 -0.621 . . . . 0.46 110.491 179.447 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.61 -30.26 71.28 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.937 0.398 . . . . 0.64 110.665 -177.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.517 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -57.16 -47.42 81.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.491 -0.777 . . . . 1.61 111.267 179.724 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . 0.668 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -89.18 -18.55 26.91 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.91 -0.587 . . . . 1.52 111.139 -176.304 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' ' 133' ' ' PHE . 40.5 t -72.34 -31.79 40.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 109.77 -0.455 . . . . 0.35 109.77 177.174 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -60.3 -27.38 67.26 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.48 -0.782 . . . . 0.5 110.588 175.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -91.02 -8.86 47.89 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.054 -0.975 . . . . 1.76 111.123 -173.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . 0.561 ' SD ' ' HB2' ' A' ' 42' ' ' MET . 0.9 OUTLIER -64.81 144.59 98.93 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.11 -0.495 . . . . 0.86 111.171 -178.208 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.435 ' C ' ' H ' ' A' ' 143' ' ' GLU . 57.9 Cg_endo -70.34 107.38 1.96 Allowed 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.453 2.102 . . . . 0.67 111.324 178.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.78 29.45 0.11 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.273 0.559 . . . . 2.91 111.759 -173.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.435 ' H ' ' C ' ' A' ' 141' ' ' PRO . 22.3 mt-10 -105.33 -39.71 6.07 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.782 -0.644 . . . . 2.7 109.631 174.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 18.2 tt0 63.27 73.27 0.46 Allowed 'General case' 0 C--N 1.334 -0.089 0 CA-C-N 114.788 -1.096 . . . . 2.34 109.829 -174.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 1.5 t -89.62 122.01 40.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.698 -0.683 . . . . 0.99 109.734 -176.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.779 ' HG3' HG22 ' A' ' 36' ' ' THR . 7.9 tt0 -70.71 147.58 48.91 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.758 0.313 . . . . 1.53 110.698 -179.291 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 64.9 mt . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.584 -0.722 . . . . 1.57 110.239 -178.856 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.578 0 N-CA-C 111.769 -0.533 . . . . 2.17 111.769 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 312' ' ' ALY . . . . . 0.578 ' HD2' HG21 ' A' ' 122' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 120.96 -33.72 4.3 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.987 -0.625 . . . . 1.97 111.766 -179.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -142.89 127.48 17.99 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.884 -0.413 . . . . 3.58 109.884 178.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 315' ' ' ALY . . . . . 0.429 ' HG3' ' HB3' ' A' ' 121' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 316' ' ' LYS . . . . . 0.407 ' HD2' ' HA ' ' B' ' 316' ' ' LYS . 26.2 mmmt . . . . . 0 C--O 1.251 1.137 0 O-C-N 124.253 0.971 . . . . 4.6 112.507 179.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo . . . . . 0 N--CA 1.477 0.558 0 N-CA-C 109.952 -0.826 . . . . 6.18 109.952 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.1 mt -149.67 -178.78 6.64 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.862 -0.421 . . . . 5.71 109.862 177.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.76 -73.09 2.72 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.786 -0.721 . . . . 3.45 112.38 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.3 p -124.72 178.19 5.59 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.86 0.362 . . . . 2.44 110.791 -178.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -69.4 151.25 46.36 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.933 -0.576 . . . . 1.64 111.177 174.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.5 p -120.15 -14.99 7.93 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 115.556 -0.747 . . . . 0.93 109.48 171.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.2 m -177.11 138.78 0.25 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-N 114.957 -1.02 . . . . 1.61 109.827 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.5 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 35.3 t-20 -135.34 127.17 17.73 Favored Pre-proline 0 C--N 1.322 -0.625 0 N-CA-C 109.472 -0.566 . . . . 1.6 109.472 178.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -61.46 -38.3 64.55 Favored 'Trans proline' 0 N--CA 1.475 0.426 0 C-N-CA 123.239 2.626 . . . . 1.87 113.034 -178.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.1 m -80.34 -19.65 46.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.216 0.531 . . . . 2.18 110.49 -178.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.5 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 5.6 tttp -96.61 107.07 34.15 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 115.522 -0.763 . . . . 2.75 110.502 178.432 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.461 ' HB2' ' CZ3' ' A' ' 96' ' ' TRP . 3.2 Cg_exo -72.85 149.02 46.99 Favored 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 122.413 2.075 . . . . 1.38 112.391 -178.119 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -145.92 85.68 0.18 Allowed Glycine 0 N--CA 1.442 -0.965 0 N-CA-C 110.746 -0.941 . . . . 0.97 110.746 178.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -74.54 159.25 32.44 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.15 0.5 . . . . 1.93 110.976 -175.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.59 104.74 17.19 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.241 -0.436 . . . . 2.64 109.886 179.382 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.589 HG22 ' HG3' ' A' ' 146' ' ' GLU . 1.5 p -104.36 164.29 11.84 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.048 -0.524 . . . . 0.68 110.513 178.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -60.46 -41.37 93.99 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 116.268 -0.424 . . . . 1.47 110.551 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -61.92 -44.66 96.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.238 -0.437 . . . . 1.04 110.565 178.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.16 -52.96 63.11 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.824 -0.625 . . . . 0.8 111.092 -178.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 20.7 mm100 -69.26 -28.25 66.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.042 -0.526 . . . . 1.75 110.919 -179.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.466 ' CE1' ' HG2' ' A' ' 140' ' ' MET . 53.2 t80 -61.23 -63.84 1.15 Allowed 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.994 -0.548 . . . . 0.64 110.137 177.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.517 ' O ' HG12 ' A' ' 47' ' ' VAL . 0.3 OUTLIER -61.52 -30.52 70.68 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 120.946 -0.301 . . . . 1.13 110.611 -173.091 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -58.71 -59.18 5.81 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.684 -0.689 . . . . 1.3 111.245 179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 63.4 m-80 -87.81 -25.95 23.09 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 112.231 0.456 . . . . 0.5 112.231 -177.016 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.404 HG11 ' CZ ' ' A' ' 41' ' ' TYR . 97.4 t -89.1 -57.97 3.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 N-CA-C 112.386 0.513 . . . . 0.3 112.386 -175.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.475 HG23 ' HA ' ' A' ' 42' ' ' MET . 59.6 t -81.97 -66.25 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 111.941 0.348 . . . . 0.26 111.941 -170.06 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.517 HG12 ' O ' ' A' ' 42' ' ' MET . 2.1 p -66.99 -32.7 59.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 C-N-CA 120.925 -0.31 . . . . 0.83 111.345 -174.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.2 -34.0 75.63 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.775 -0.37 . . . . 2.4 111.001 176.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 38.2 m -79.89 -36.59 36.31 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.725 0.297 . . . . 0.55 110.302 177.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.653 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -60.5 -44.7 95.7 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.169 -0.469 . . . . 0.33 109.768 175.399 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 17.6 t-105 -62.76 -30.43 71.44 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.457 -0.792 . . . . 0.39 111.556 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.9 mtpp -90.7 7.62 38.6 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.018 0.377 . . . . 2.24 112.018 -174.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.493 ' HB3' ' HB2' ' A' ' 56' ' ' ALA . 41.3 t-80 -75.61 143.55 42.25 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.913 0.387 . . . . 0.39 110.133 177.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -69.12 -25.09 64.22 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.166 -0.47 . . . . 1.91 112.205 -175.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.568 ' HB3' ' HB2' ' A' ' 125' ' ' MET . 21.7 m-85 -105.23 8.42 33.96 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.065 0.459 . . . . 0.93 110.619 -178.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.609 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -93.15 8.13 41.4 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.135 0.493 . . . . 0.28 110.837 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.419 ' CG ' ' HD3' ' A' ' 58' ' ' PRO . 62.3 p-90 -62.44 -34.47 15.06 Favored Pre-proline 0 CA--C 1.548 0.872 0 N-CA-C 113.873 1.064 . . . . 0.58 113.873 -175.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.643 ' HG2' ' SD ' ' A' ' 125' ' ' MET . 5.6 Cg_exo -80.14 3.66 7.44 Favored 'Trans proline' 0 C--N 1.36 1.173 0 C-N-CA 121.636 1.557 . . . . 0.47 112.221 179.219 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 31.4 m-85 -113.9 47.05 1.23 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.702 0.763 . . . . 1.11 109.166 178.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -114.18 -13.61 12.38 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.146 -0.934 . . . . 0.63 109.903 -178.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.76 117.0 24.43 Favored Pre-proline 0 C--N 1.321 -0.637 0 CA-C-N 115.268 -0.878 . . . . 1.63 110.602 -169.377 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.32 143.23 93.55 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 122.337 2.024 . . . . 0.87 112.196 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.479 HG11 ' CD2' ' A' ' 73' ' ' TYR . 2.9 t -67.5 106.09 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 CA-C-O 121.715 0.769 . . . . 0.88 110.047 178.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.404 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.0 OUTLIER -107.51 0.93 23.06 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.859 -1.064 . . . . 1.85 109.379 178.774 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.404 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 77.31 -55.73 0.53 Allowed 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 114.274 -1.33 . . . . 1.29 111.595 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.0 mt -77.77 -49.41 21.99 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.817 0 N-CA-C 111.635 0.235 . . . . 1.89 111.635 -173.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.71 -19.73 64.38 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 111.805 0.298 . . . . 2.99 111.805 -175.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.46 HD12 ' HA ' ' A' ' 68' ' ' LEU . 1.4 tp -109.84 -0.86 18.17 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.888 -0.325 . . . . 1.66 111.288 179.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 61.88 42.78 9.98 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.711 -0.677 . . . . 1.74 112.129 178.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -126.51 68.37 67.74 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 115.969 -0.56 . . . . 1.61 110.683 176.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -72.1 -26.0 18.61 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.093 1.862 . . . . 1.3 111.869 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 -84.28 -4.14 58.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.741 -0.663 . . . . 1.97 110.484 -178.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.479 ' CD2' HG11 ' A' ' 63' ' ' VAL . 27.0 t80 -65.29 -30.89 71.79 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.699 -0.682 . . . . 1.13 110.307 178.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 2.8 m-70 -80.89 2.93 24.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.548 -0.751 . . . . 0.91 111.613 -171.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.7 mtpt -96.75 -51.08 4.43 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.078 0.466 . . . . 2.86 109.859 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.7 mp -81.58 -45.0 20.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.865 -0.607 . . . . 1.0 110.539 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 45.0 mm -89.56 123.32 41.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.192 -0.458 . . . . 0.75 110.019 -178.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.468 ' O ' ' HD3' ' A' ' 80' ' ' PRO . 0.9 OUTLIER -86.44 -36.12 19.29 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.263 -0.426 . . . . 1.99 111.295 -175.235 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -112.33 90.4 14.15 Favored Pre-proline 0 C--N 1.325 -0.485 0 N-CA-C 109.708 -0.479 . . . . 2.05 109.708 176.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.468 ' HD3' ' O ' ' A' ' 78' ' ' LYS . 13.1 Cg_exo -69.11 87.11 0.47 Allowed 'Trans proline' 0 C--N 1.342 0.226 0 C-N-CA 122.996 2.464 . . . . 0.89 111.937 -178.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 8.0 mmt -124.0 164.38 19.47 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.888 -0.596 . . . . 0.82 110.766 -176.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.46 ' CG ' ' H ' ' A' ' 83' ' ' MET . 19.9 t70 -143.18 -144.64 0.16 Allowed 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 106.755 -1.572 . . . . 1.42 106.755 -177.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . 0.46 ' H ' ' CG ' ' A' ' 82' ' ' ASP . 0.5 OUTLIER -107.84 -18.06 13.91 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 107.924 -1.139 . . . . 0.8 107.924 177.758 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -74.98 -26.26 67.16 Favored Glycine 0 N--CA 1.439 -1.135 0 N-CA-C 109.398 -1.481 . . . . 0.32 109.398 177.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -83.9 -37.22 22.65 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 114.868 -0.666 . . . . 0.95 111.079 177.324 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -61.11 -49.96 82.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.003 -0.544 . . . . 0.97 109.719 178.095 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.415 ' HG3' ' N ' ' A' ' 88' ' ' LYS . 0.1 OUTLIER -66.58 -26.44 67.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.863 -0.608 . . . . 1.15 111.001 179.957 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.415 ' N ' ' HG3' ' A' ' 87' ' ' LYS . 1.2 tptt -67.47 -51.36 52.26 Favored 'General case' 0 N--CA 1.456 -0.127 0 CA-C-O 120.688 0.28 . . . . 2.46 110.703 -179.327 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.453 HH22 ' CG ' ' A' ' 104' ' ' ASP . 10.0 mtm-85 -67.66 -24.05 65.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.944 0.402 . . . . 1.16 110.81 -179.153 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 4.0 mt -73.33 -59.52 2.67 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.957 -0.565 . . . . 0.49 111.041 177.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 19.9 pt-20 -66.63 -36.73 83.29 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.738 -0.665 . . . . 1.39 111.114 -175.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -79.26 -4.41 50.57 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.384 -0.371 . . . . 1.3 110.6 -179.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 58.25 72.04 0.55 Allowed 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 121.428 0.632 . . . . 1.75 110.731 176.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . . . . . . . . . 32.0 t80 -93.97 -49.94 5.56 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.002 -0.544 . . . . 0.96 110.98 179.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.438 ' CE1' ' HB2' ' A' ' 101' ' ' CYS . 0.2 OUTLIER -96.07 -179.67 4.76 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.846 0.355 . . . . 1.28 110.94 -177.933 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . 0.461 ' CZ3' ' HB2' ' A' ' 32' ' ' PRO . 2.1 t-105 -82.58 -46.52 13.23 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.74 -0.664 . . . . 1.05 111.878 -174.055 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.4 t -144.93 172.3 13.24 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 120.424 -0.511 . . . . 1.0 110.929 -173.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -68.16 -17.88 64.46 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.081 -0.508 . . . . 0.66 111.458 -176.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.06 -33.81 73.91 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 121.019 0.437 . . . . 0.85 109.976 175.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.4 -37.35 63.4 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.877 -0.601 . . . . 2.44 109.571 177.179 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.438 ' HB2' ' CE1' ' A' ' 95' ' ' TYR . 41.3 t -68.01 -39.49 83.17 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.565 -0.743 . . . . 0.95 111.322 -178.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -64.23 -22.99 67.15 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.359 -0.382 . . . . 1.13 110.912 -177.029 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.8 mm-40 -67.2 -44.29 79.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.064 0.459 . . . . 2.96 110.466 175.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . 0.453 ' CG ' HH22 ' A' ' 89' ' ' ARG . 0.6 OUTLIER -78.76 -29.97 45.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.36 -0.382 . . . . 1.87 110.194 -179.348 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.653 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -60.84 -40.72 93.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.77 -0.65 . . . . 0.38 109.647 173.145 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -68.72 -34.52 75.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.771 -0.65 . . . . 0.97 110.126 174.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 86.3 m -63.02 -51.93 64.86 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.891 -0.595 . . . . 0.43 111.265 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 10.7 ptm -59.57 -32.75 70.65 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.783 0.325 . . . . 0.88 111.291 -178.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -73.13 -47.51 43.46 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.509 -0.314 . . . . 0.29 110.764 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.1 p -64.84 -38.97 92.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.756 0.312 . . . . 0.66 110.589 179.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 26.0 m-20 -47.83 -53.08 16.65 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.529 -0.759 . . . . 1.84 110.731 177.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 10.6 t -60.84 -43.81 97.78 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.312 -0.858 . . . . 0.63 111.02 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -66.14 -33.98 77.02 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.492 -0.322 . . . . 0.81 111.541 -177.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 70.6 mt -80.32 -55.46 8.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.575 -0.284 . . . . 0.55 111.622 -176.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.475 ' CE1' ' HA ' ' A' ' 73' ' ' TYR . 57.6 t80 -68.3 -35.87 78.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.908 0.385 . . . . 1.22 111.43 -174.048 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 63.6 m-80 -94.23 -170.23 2.24 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.137 -0.483 . . . . 1.04 110.725 -175.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.31 154.5 40.54 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 116.32 -0.4 . . . . 3.47 110.363 -177.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -61.9 -25.54 78.21 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.415 2.076 . . . . 0.96 111.67 176.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.26 22.07 12.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.787 -0.642 . . . . 1.23 111.018 178.273 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.41 ' OD1' HG22 ' A' ' 122' ' ' ILE . 3.8 t70 -87.23 155.57 20.03 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.171 -0.468 . . . . 1.34 110.341 179.431 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . 0.506 ' HB3' ' HB3' ' B' ' 315' ' ' ALY . 42.8 m-20 -68.83 -42.36 77.31 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.728 -0.669 . . . . 1.44 110.244 -178.292 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.707 ' HA ' ' SD ' ' A' ' 125' ' ' MET . 1.4 tp -65.21 -32.81 59.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.853 -0.612 . . . . 0.42 110.743 -177.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 2.7 t -74.09 -37.71 47.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 121.145 0.498 . . . . 0.35 110.105 178.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.14 -38.45 79.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.681 -0.691 . . . . 0.52 110.515 -178.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . 0.707 ' SD ' ' HA ' ' A' ' 122' ' ' ILE . 0.0 OUTLIER -82.5 -39.28 22.67 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.325 -0.398 . . . . 0.62 111.311 177.991 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.23 -32.24 64.26 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.753 0.311 . . . . 0.31 111.566 -178.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -63.98 -44.39 92.84 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.17 -0.468 . . . . 1.94 110.692 177.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.63 -41.23 84.23 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.236 -0.438 . . . . 0.32 110.565 177.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.609 HD21 ' HA ' ' A' ' 56' ' ' ALA . 9.3 mp -56.73 -45.34 82.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.81 -0.632 . . . . 0.33 110.549 177.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -65.05 -23.32 67.15 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.649 -0.705 . . . . 1.47 111.551 -177.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.2 -49.16 53.07 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 110.17 -0.308 . . . . 2.24 110.17 -177.11 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.442 HG13 ' O ' ' A' ' 129' ' ' LEU . 1.0 OUTLIER -72.41 -24.92 22.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.41 -0.359 . . . . 1.23 110.324 178.07 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -60.76 -62.07 2.12 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.97 -0.559 . . . . 0.46 110.406 174.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.82 -25.58 67.28 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.897 0.379 . . . . 0.64 110.629 -177.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 -60.84 -44.06 97.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.68 -0.691 . . . . 1.61 111.042 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 30.6 mttm -91.73 -13.0 32.36 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.955 0.407 . . . . 1.52 111.017 -177.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 19.5 t -81.73 -29.12 10.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.207 0.527 . . . . 0.35 110.04 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -71.76 -7.76 50.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.436 0.636 . . . . 0.5 110.324 176.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -107.68 2.87 24.12 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.237 -0.892 . . . . 1.76 110.378 179.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . 0.466 ' HG2' ' CE1' ' A' ' 41' ' ' TYR . 0.6 OUTLIER -61.77 149.51 84.85 Favored Pre-proline 0 C--O 1.232 0.182 0 CA-C-N 115.669 -0.696 . . . . 0.86 110.676 177.022 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -74.02 90.68 0.96 Allowed 'Trans proline' 0 N--CA 1.457 -0.675 0 C-N-CA 121.902 1.734 . . . . 0.67 110.832 175.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -63.79 -4.15 2.94 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.996 -0.547 . . . . 2.91 111.736 -175.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -79.06 -34.77 43.42 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.771 -0.649 . . . . 2.7 110.066 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 67.68 93.26 0.08 Allowed 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 114.813 -1.085 . . . . 2.34 109.524 -177.024 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -113.04 118.73 58.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.818 -0.628 . . . . 0.99 110.142 -176.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.589 ' HG3' HG22 ' A' ' 36' ' ' THR . 2.4 tt0 -74.28 132.59 42.23 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.676 -0.49 . . . . 1.53 109.676 178.291 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 34.3 mt . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.744 -0.646 . . . . 1.57 110.133 -177.062 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.692 0 N-CA-C 111.648 -0.581 . . . . 2.17 111.648 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 123.09 -38.29 2.54 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.864 -0.684 . . . . 1.97 111.716 -177.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.88 136.13 26.72 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.793 -0.447 . . . . 3.58 109.793 175.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 315' ' ' ALY . . . . . 0.506 ' HB3' ' HB3' ' A' ' 121' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 3.9 pttt . . . . . 0 C--O 1.247 0.963 0 CA-C-O 118.812 -0.613 . . . . 4.6 110.122 175.785 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_endo . . . . . 0 N--CA 1.477 0.547 0 N-CA-C 110.729 -0.527 . . . . 6.18 110.729 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -152.88 91.35 1.54 Allowed 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.381 -0.6 . . . . 5.71 109.381 178.347 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.77 40.73 5.85 Favored Glycine 0 N--CA 1.449 -0.485 0 N-CA-C 110.059 -1.216 . . . . 3.45 110.059 -170.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -76.77 158.45 30.89 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 114.892 -0.654 . . . . 2.44 111.808 -175.451 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.543 ' HG3' ' CE1' ' A' ' 94' ' ' TYR . 11.1 pt-20 -99.76 165.62 11.5 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.757 -0.656 . . . . 1.64 109.511 174.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 7.9 p -126.63 -10.35 4.64 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.103 0 CA-C-O 121.897 0.856 . . . . 0.93 108.696 173.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -146.43 138.42 24.88 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 114.32 -1.309 . . . . 1.61 108.416 177.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.527 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 16.4 t-20 -143.01 122.33 7.6 Favored Pre-proline 0 C--N 1.313 -0.98 0 C-N-CA 120.786 -0.366 . . . . 1.6 110.459 176.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -67.39 -46.29 2.97 Favored 'Trans proline' 0 N--CA 1.475 0.439 0 C-N-CA 123.43 2.753 . . . . 1.87 113.351 -177.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.8 m -71.81 -39.52 69.79 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.975 -0.557 . . . . 2.18 110.502 -175.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.527 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 0.2 OUTLIER -66.38 130.37 94.2 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.338 -0.846 . . . . 2.75 110.005 179.638 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -60.97 156.79 42.11 Favored 'Trans proline' 0 C--O 1.235 0.342 0 C-N-CA 122.7 2.267 . . . . 1.38 112.554 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -160.67 63.11 0.29 Allowed Glycine 0 N--CA 1.446 -0.667 0 N-CA-C 110.658 -0.977 . . . . 0.97 110.658 -179.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.461 ' HG3' ' CZ2' ' A' ' 96' ' ' TRP . 5.8 mtm-85 -79.53 132.54 36.34 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.848 0.356 . . . . 1.93 110.142 -174.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.4 ttmt -80.33 119.75 23.47 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.104 -0.498 . . . . 2.64 110.438 -173.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.758 HG22 ' HG3' ' A' ' 146' ' ' GLU . 0.6 OUTLIER -112.76 160.34 18.06 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.815 -0.354 . . . . 0.68 111.154 178.421 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.648 ' ND2' ' HG3' ' A' ' 141' ' ' PRO . 11.9 t30 -55.51 -46.56 76.96 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 115.786 -0.643 . . . . 1.47 110.321 176.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -54.32 -46.31 72.82 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.648 -0.706 . . . . 1.04 110.925 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.0 -57.96 10.75 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.643 -0.708 . . . . 0.8 111.561 -177.409 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -70.86 -25.29 62.74 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.066 -0.515 . . . . 1.75 110.79 -176.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.584 ' CE1' ' HG2' ' A' ' 140' ' ' MET . 54.0 t80 -61.85 -62.39 1.83 Allowed 'General case' 0 N--CA 1.442 -0.84 0 CA-C-N 116.064 -0.516 . . . . 0.64 110.345 175.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.578 ' O ' HG13 ' A' ' 47' ' ' VAL . 0.1 OUTLIER -59.15 -35.22 73.14 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-O 120.792 0.33 . . . . 1.13 110.15 -175.329 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -56.75 -54.66 43.74 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.567 -0.742 . . . . 1.3 111.159 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.454 ' O ' ' HB2' ' A' ' 48' ' ' LYS . 69.5 m-80 -87.02 -28.62 22.51 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.362 0.504 . . . . 0.5 112.362 -177.217 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 74.8 t -89.19 -58.24 3.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 112.3 0.482 . . . . 0.3 112.3 -175.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.697 HG22 ' HB3' ' A' ' 136' ' ' LYS . 43.3 t -79.52 -62.67 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 116.482 -0.326 . . . . 0.26 111.359 -170.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.578 HG13 ' O ' ' A' ' 42' ' ' MET . 1.5 m -62.92 -33.22 59.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 111.669 0.248 . . . . 0.83 111.669 -175.146 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -67.48 -35.24 78.79 Favored 'General case' 0 CA--C 1.528 0.118 0 C-N-CA 120.936 -0.305 . . . . 2.4 111.488 179.275 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.4 m -74.24 -37.76 63.7 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.78 -0.368 . . . . 0.55 110.51 178.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.716 HD23 HD12 ' A' ' 132' ' ' ILE . 0.1 OUTLIER -66.59 -37.61 85.27 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.255 0.55 . . . . 0.33 109.844 175.253 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 9.7 t-105 -65.41 -25.72 67.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.47 -0.786 . . . . 0.39 111.623 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -89.74 3.16 53.65 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 120.61 -0.436 . . . . 2.24 111.665 -177.107 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.525 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 15.7 t-80 -89.1 129.96 35.63 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.647 -0.501 . . . . 0.39 109.647 175.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.97 -3.27 41.1 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.188 0.44 . . . . 1.91 112.188 -172.198 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.525 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 2.1 m-30 -93.05 -10.38 36.36 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.157 0.503 . . . . 0.93 110.114 175.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.513 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -92.4 19.93 6.67 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.972 -0.558 . . . . 0.28 110.514 178.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.642 ' HA ' ' CE2' ' A' ' 60' ' ' TYR . 44.8 p-90 -67.89 -34.45 6.34 Favored Pre-proline 0 CA--C 1.543 0.675 0 N-CA-C 113.309 0.855 . . . . 0.58 113.309 -175.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.601 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 3.4 Cg_exo -82.31 10.15 3.68 Favored 'Trans proline' 0 C--N 1.358 1.055 0 C-N-CA 121.711 1.607 . . . . 0.47 111.203 174.129 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -112.57 -15.65 13.0 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.546 -0.752 . . . . 1.11 111.182 -177.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.642 ' CE2' ' HA ' ' A' ' 57' ' ' TRP . 12.5 m-85 -66.6 -28.58 68.61 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.389 0.614 . . . . 0.63 110.147 177.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -98.35 116.57 65.48 Favored Pre-proline 0 C--N 1.32 -0.693 0 CA-C-N 115.063 -0.971 . . . . 1.63 110.431 -172.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.653 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 18.0 Cg_endo -62.56 133.08 40.77 Favored 'Trans proline' 0 C--O 1.24 0.597 0 C-N-CA 122.564 2.176 . . . . 0.87 112.52 -178.589 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.401 HG11 ' CD2' ' A' ' 73' ' ' TYR . 5.1 t -62.33 111.14 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 CA-C-O 121.893 0.854 . . . . 0.88 109.846 178.066 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.415 ' HB3' ' HG2' ' A' ' 67' ' ' LYS . 0.2 OUTLIER -122.5 -3.53 8.84 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.684 -1.144 . . . . 1.85 109.717 -175.058 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 74.95 -40.43 0.44 Allowed 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 114.967 -1.015 . . . . 1.29 111.596 -178.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.8 mt -86.43 -60.92 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 120.677 0.275 . . . . 1.89 111.25 -176.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.415 ' HG2' ' HB3' ' A' ' 64' ' ' ASP . 6.1 pttt -71.5 -10.6 60.01 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.246 0.462 . . . . 2.99 112.246 -175.342 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.461 HD13 ' HA ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -114.58 -1.57 13.34 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.921 0.391 . . . . 1.66 110.596 175.949 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 52.9 50.33 18.24 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.849 -0.614 . . . . 1.74 111.735 -178.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.442 HD11 ' HG ' ' A' ' 68' ' ' LEU . 12.7 mt -120.81 71.07 19.32 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.804 -0.634 . . . . 1.61 109.628 174.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.71 -31.47 20.7 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.805 2.337 . . . . 1.3 113.458 -170.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.456 ' OD1' ' HG3' ' A' ' 75' ' ' LYS . 0.4 OUTLIER -100.11 10.86 40.6 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.925 0.393 . . . . 1.97 111.316 -176.763 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.401 ' CD2' HG11 ' A' ' 63' ' ' VAL . 15.8 t80 -63.46 -37.41 87.19 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.073 -0.512 . . . . 1.13 110.266 178.071 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 8.6 m-70 -78.99 -1.11 33.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.678 -0.692 . . . . 0.91 111.415 -175.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.456 ' HG3' ' OD1' ' A' ' 72' ' ' ASP . 13.0 mmtm -96.24 -18.01 20.35 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.216 0.531 . . . . 2.86 110.159 -179.272 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.3 mp -114.82 -45.43 4.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 115.66 -0.7 . . . . 1.0 110.171 178.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 33.3 mm -93.72 116.38 34.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 120.953 0.406 . . . . 0.75 110.116 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.85 -28.41 60.66 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.904 -0.589 . . . . 1.99 111.282 -177.028 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -122.33 85.33 47.4 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 116.23 -0.441 . . . . 2.05 110.842 -177.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -68.34 89.95 0.39 Allowed 'Trans proline' 0 CA--C 1.528 0.209 0 C-N-CA 122.527 2.152 . . . . 0.89 112.198 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 10.2 mmt -131.73 157.38 43.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.067 -0.515 . . . . 0.82 110.331 -178.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.653 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 1.2 p-10 -151.67 -115.39 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.699 -0.682 . . . . 1.42 109.637 -172.227 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . 0.421 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 11.6 ttp -129.45 -22.28 3.06 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 121.922 -0.486 . . . . 0.8 110.789 176.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -83.3 -25.88 46.0 Favored Glycine 0 N--CA 1.444 -0.816 0 N-CA-C 110.607 -0.997 . . . . 0.32 110.607 179.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.442 HG23 ' HB3' ' A' ' 62' ' ' PRO . 0.6 OUTLIER -76.82 -44.86 30.83 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.375 -0.413 . . . . 0.95 110.504 175.76 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.404 HG12 ' HB3' ' A' ' 104' ' ' ASP . 83.6 mt -58.5 -48.68 84.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.732 -0.667 . . . . 0.97 110.257 175.199 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.421 ' HB3' ' O ' ' A' ' 83' ' ' MET . 0.0 OUTLIER -59.6 -32.93 70.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.116 -0.493 . . . . 1.15 110.902 178.397 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 8.6 tppt? -67.4 -50.39 59.81 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-O 120.601 0.239 . . . . 2.46 110.696 -179.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.706 ' HB3' ' CE1' ' A' ' 95' ' ' TYR . 15.2 mtp180 -68.22 -28.25 67.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.911 0.386 . . . . 1.16 110.643 179.29 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 5.8 mt -68.14 -56.59 8.24 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.86 -0.609 . . . . 0.49 111.635 177.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -65.92 -26.36 67.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.982 0.42 . . . . 1.39 111.24 -176.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -87.96 -4.68 58.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.989 -0.551 . . . . 1.3 110.715 179.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 50.63 61.66 3.1 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.739 -0.664 . . . . 1.75 110.766 -176.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . 0.543 ' CE1' ' HG3' ' A' ' 25' ' ' GLU . 72.4 t80 -85.07 -32.83 22.64 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 115.913 -0.585 . . . . 0.96 111.014 179.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.706 ' CE1' ' HB3' ' A' ' 89' ' ' ARG . 0.1 OUTLIER -80.71 -145.15 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.797 0.808 . . . . 1.28 110.398 178.885 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . 0.461 ' CZ2' ' HG3' ' A' ' 34' ' ' ARG . 2.3 t-105 -126.83 -53.59 1.43 Allowed 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 114.479 -1.237 . . . . 1.05 108.091 174.397 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 12.6 t -133.93 -173.06 3.14 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 115.043 -0.98 . . . . 1.0 110.072 -177.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -81.81 -5.49 58.24 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.611 0.243 . . . . 0.66 111.345 -177.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.45 -41.92 98.65 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.902 0.382 . . . . 0.85 110.552 177.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -69.66 -28.68 66.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.332 0.587 . . . . 2.44 109.593 177.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 4.2 t -71.77 -30.75 65.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.305 -0.862 . . . . 0.95 110.543 177.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.6 ttm -64.89 -40.37 94.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.08 -0.509 . . . . 1.13 109.935 177.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.2 -37.37 83.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.73 -0.668 . . . . 2.96 110.123 176.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . 0.404 ' HB3' HG12 ' A' ' 86' ' ' ILE . 1.1 m-20 -58.6 -55.58 33.28 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.601 -0.727 . . . . 1.87 110.509 177.14 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.642 ' HE2' HD12 ' A' ' 50' ' ' LEU . 3.5 m-85 -58.31 -44.58 88.65 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.782 -0.645 . . . . 0.38 110.913 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -56.87 -44.98 82.77 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.28 -0.418 . . . . 0.97 110.294 177.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 54.3 m -65.12 -47.53 76.81 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.125 -0.489 . . . . 0.43 111.037 178.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.72 -41.57 74.05 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.083 -0.508 . . . . 0.88 111.313 -179.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -73.41 -45.79 52.59 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.422 -0.354 . . . . 0.29 110.633 -177.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.0 p -63.81 -35.6 81.14 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.607 -0.27 . . . . 0.66 110.871 -179.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 49.2 m-20 -46.28 -52.08 13.3 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.638 -0.71 . . . . 1.84 111.348 176.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 7.4 t -61.02 -38.42 86.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.451 -0.795 . . . . 0.63 111.085 -178.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -75.97 -16.21 60.03 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.336 -0.393 . . . . 0.81 111.71 -175.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 57.1 mt -92.39 -51.66 11.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.95 0.405 . . . . 0.55 110.816 178.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -71.52 -35.6 70.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.841 -0.618 . . . . 1.22 111.654 -175.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -105.3 -179.82 4.05 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.912 0.387 . . . . 1.04 110.982 -175.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.4 154.83 39.27 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.195 -0.457 . . . . 3.47 110.921 -177.027 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -61.48 -17.8 55.81 Favored 'Trans proline' 0 N--CA 1.476 0.49 0 C-N-CA 122.733 2.289 . . . . 0.96 112.373 177.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.16 0.42 51.22 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.832 -0.622 . . . . 1.23 111.515 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.489 ' OD2' ' HA2' ' B' ' 313' ' ' GLY . 1.4 t70 -71.43 156.25 39.68 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.446 0.641 . . . . 1.34 111.734 -173.488 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -69.58 -41.59 75.61 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.91 -1.041 . . . . 1.44 109.884 -179.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 3.1 tp -67.46 -28.11 40.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.602 -0.727 . . . . 0.42 110.627 -179.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 1.3 t -70.48 -45.61 73.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 N-CA-C 109.794 -0.447 . . . . 0.35 109.794 176.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.68 -33.23 71.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.668 -0.696 . . . . 0.52 109.736 177.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 30.5 mtt -71.15 -46.62 61.12 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.475 -0.784 . . . . 0.62 110.506 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.58 -40.42 75.2 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.253 -0.43 . . . . 0.31 111.481 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -44.96 96.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.468 -0.333 . . . . 1.94 111.217 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -70.68 -36.89 73.54 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.074 0.464 . . . . 0.32 110.564 178.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.513 HD21 ' HA ' ' A' ' 56' ' ' ALA . 0.6 OUTLIER -64.29 -44.06 92.82 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.567 -0.742 . . . . 0.33 110.667 179.589 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -62.18 -25.91 68.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.744 -0.662 . . . . 1.47 111.349 -178.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.46 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 17.0 ttpt -64.25 -42.39 96.52 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.22 -0.445 . . . . 2.24 110.029 -179.237 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.716 HD12 HD23 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -77.27 -23.69 14.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.09 -0.505 . . . . 1.23 110.501 -179.625 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.491 ' O ' HG23 ' A' ' 137' ' ' VAL . 30.3 t80 -62.09 -62.1 2.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.074 -0.512 . . . . 0.46 110.168 176.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.11 -26.46 68.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.126 0.489 . . . . 0.64 110.205 -178.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.46 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.01 -33.66 72.3 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.385 -0.825 . . . . 1.61 111.762 179.314 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . 0.697 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -97.96 -25.14 15.09 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.135 0.493 . . . . 1.52 110.597 -179.692 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.517 ' O ' ' HB2' ' A' ' 140' ' ' MET . 53.9 t -69.79 -32.35 51.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.948 -0.569 . . . . 0.35 110.619 179.176 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.59 -16.98 64.03 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.124 -0.489 . . . . 0.5 110.49 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -100.29 0.03 39.37 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.741 -0.663 . . . . 1.76 110.223 -179.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . 0.584 ' HG2' ' CE1' ' A' ' 41' ' ' TYR . 0.1 OUTLIER -71.65 161.2 79.86 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-N 115.69 -0.686 . . . . 0.86 110.195 176.903 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.648 ' HG3' ' ND2' ' A' ' 37' ' ' ASN . 65.3 Cg_endo -74.7 107.67 2.52 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 121.714 1.609 . . . . 0.67 109.796 173.306 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -72.29 2.39 6.12 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.801 0.334 . . . . 2.91 111.881 -171.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -100.22 -111.52 0.19 Allowed 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 108.652 -0.87 . . . . 2.7 108.652 171.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 178.3 131.35 0.07 Allowed 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.606 -0.887 . . . . 2.34 108.606 173.164 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 2.8 t -129.04 94.05 2.27 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.705 -0.48 . . . . 0.99 109.705 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.758 ' HG3' HG22 ' A' ' 36' ' ' THR . 4.8 tt0 -67.99 146.28 53.7 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 110.148 -0.316 . . . . 1.53 110.148 177.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 9.8 mt . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.427 -0.797 . . . . 1.57 110.133 -178.598 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.586 0 N-CA-C 112.177 -0.369 . . . . 2.17 112.177 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 313' ' ' GLY . . . . . 0.489 ' HA2' ' OD2' ' A' ' 120' ' ' ASP . . . 114.4 -37.33 3.58 Favored Glycine 0 N--CA 1.445 -0.713 0 N-CA-C 111.276 -0.73 . . . . 1.97 111.276 -174.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -158.09 126.06 5.3 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.907 -0.775 . . . . 3.58 108.907 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.842 -0.599 . . . . 4.6 109.597 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_endo . . . . . 0 N--CA 1.48 0.709 0 N-CA-C 110.483 -0.622 . . . . 6.18 110.483 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -137.2 70.08 1.4 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.167 0.508 . . . . 5.71 110.244 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 121.03 43.04 0.45 Allowed Glycine 0 N--CA 1.447 -0.61 0 CA-C-N 115.696 -0.684 . . . . 3.45 112.058 -179.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 33.3 p -69.4 151.3 46.29 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.63 -0.285 . . . . 2.44 110.438 178.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.473 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 6.1 mt-10 -55.85 123.51 14.49 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 121.471 0.653 . . . . 1.64 112.407 -178.169 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.471 ' O ' ' HB2' ' A' ' 94' ' ' TYR . 5.1 p -116.43 -16.68 8.47 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.939 0 CA-C-N 114.783 -1.099 . . . . 0.93 109.216 173.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -160.52 142.14 12.38 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.305 -0.861 . . . . 1.61 109.053 175.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.45 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 23.0 t-20 -134.92 127.12 18.16 Favored Pre-proline 0 C--N 1.316 -0.871 0 CA-C-O 120.639 0.257 . . . . 1.6 110.57 -179.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -72.97 -44.89 0.52 Allowed 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 122.837 2.358 . . . . 1.87 112.344 175.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.0 m -74.15 -38.22 63.81 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.743 -0.662 . . . . 2.18 110.719 -175.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.45 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 0.2 OUTLIER -85.78 130.31 51.22 Favored Pre-proline 0 C--N 1.322 -0.612 0 N-CA-C 109.055 -0.72 . . . . 2.75 109.055 177.183 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.448 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 18.6 Cg_endo -57.5 137.8 83.14 Favored 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.794 2.329 . . . . 1.38 112.907 -175.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -150.67 84.66 0.16 Allowed Glycine 0 N--CA 1.446 -0.656 0 CA-C-N 114.775 -1.102 . . . . 0.97 110.503 -178.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -100.78 -177.84 3.59 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.101 0.477 . . . . 1.93 111.338 -172.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 11.3 ttmt -123.76 100.0 6.56 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.712 -0.676 . . . . 2.64 110.09 177.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.542 HG22 ' HG3' ' A' ' 146' ' ' GLU . 18.0 p -101.13 173.94 6.23 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 116.41 -0.359 . . . . 0.68 110.042 175.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.567 HD21 ' HG2' ' A' ' 141' ' ' PRO . 0.0 OUTLIER -65.68 -38.4 89.18 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.252 -0.431 . . . . 1.47 110.598 178.779 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.517 ' NE2' ' HG2' ' A' ' 144' ' ' GLU . 1.5 tt0 -62.9 -42.77 99.89 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-O 120.619 0.247 . . . . 1.04 110.856 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.432 ' HB2' ' HA ' ' A' ' 97' ' ' SER . 0.8 OUTLIER -61.07 -54.09 49.03 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.165 -0.471 . . . . 0.8 110.601 179.917 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.3 mm-40 -63.36 -35.55 80.78 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.988 -0.551 . . . . 1.75 110.781 178.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -58.39 -64.05 1.06 Allowed 'General case' 0 C--O 1.217 -0.641 0 CA-C-N 116.181 -0.463 . . . . 0.64 110.359 177.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.569 ' SD ' ' HB3' ' A' ' 101' ' ' CYS . 3.3 ttm -60.15 -32.84 71.42 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.414 -0.217 . . . . 1.13 110.414 -174.479 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -59.31 -58.11 10.06 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.904 -0.589 . . . . 1.3 111.056 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.4 m-80 -86.19 -28.04 24.14 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.146 -0.479 . . . . 0.5 112.054 -175.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.422 HG12 ' HD3' ' A' ' 136' ' ' LYS . 95.7 t -88.63 -56.57 5.06 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.926 0 CA-C-N 116.093 -0.503 . . . . 0.3 111.641 -176.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.507 HG23 ' HA ' ' A' ' 42' ' ' MET . 92.5 t -80.08 -65.74 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 116.395 -0.366 . . . . 0.26 111.892 -170.703 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -63.57 -34.45 67.69 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 C-N-CA 120.601 -0.439 . . . . 0.83 111.526 -174.425 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.89 -32.0 73.25 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.935 -0.306 . . . . 2.4 111.442 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 51.1 m -75.64 -37.5 59.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.842 0.353 . . . . 0.55 110.329 177.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.629 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -63.56 -40.81 97.94 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.162 -0.681 . . . . 0.33 109.162 174.031 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 12.4 t-105 -59.12 -37.56 77.51 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.115 -0.948 . . . . 0.39 111.494 178.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 14.3 mttm -88.86 9.27 25.37 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 112.178 0.436 . . . . 2.24 112.178 -175.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 16.3 t-80 -79.51 144.98 33.46 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.422 -0.584 . . . . 0.39 109.422 174.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -79.9 -12.75 59.72 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.616 0.246 . . . . 1.91 111.543 -174.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 3.7 m-30 -99.43 -8.16 25.12 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.992 0.425 . . . . 0.93 110.653 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.434 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -95.36 16.34 17.07 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.084 0.469 . . . . 0.28 110.808 -179.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.447 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 60.3 p-90 -62.38 -34.14 14.14 Favored Pre-proline 0 CA--C 1.548 0.867 0 N-CA-C 114.282 1.216 . . . . 0.58 114.282 -174.577 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.447 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 59.4 Cg_endo -90.58 9.88 3.05 Favored 'Trans proline' 0 C--N 1.36 1.148 0 CA-C-N 121.204 1.466 . . . . 0.47 112.866 -178.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -106.39 6.97 30.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.184 -0.462 . . . . 1.11 110.88 -177.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.8 m-30 -75.66 -24.87 56.4 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.212 -0.449 . . . . 0.63 111.966 -175.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.16 128.15 31.43 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 116.482 -0.326 . . . . 1.63 111.325 -171.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.499 ' HA ' ' OD2' ' A' ' 82' ' ' ASP . 27.0 Cg_endo -63.12 133.22 39.91 Favored 'Trans proline' 0 C--O 1.236 0.424 0 C-N-CA 122.667 2.244 . . . . 0.87 111.482 178.037 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.7 t -59.62 110.48 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 122.189 0.995 . . . . 0.88 111.676 -178.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -121.17 125.89 48.3 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 113.848 -1.524 . . . . 1.85 106.977 167.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.561 ' HB2' ' NE2' ' A' ' 74' ' ' HIS . . . -63.09 -12.49 27.26 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.62 0.6 . . . . 1.29 112.62 -170.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.9 mp -106.58 -42.44 6.48 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 120.84 0.352 . . . . 1.89 110.497 -177.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 36.1 tptt -67.09 -44.12 80.81 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.056 -0.52 . . . . 2.99 111.076 179.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.767 ' HB3' HD22 ' A' ' 70' ' ' LEU . 0.2 OUTLIER -97.54 -3.77 39.12 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.374 -0.375 . . . . 1.66 110.693 -179.123 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 53.37 63.04 2.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.607 -0.724 . . . . 1.74 110.689 -176.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.767 HD22 ' HB3' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -119.81 70.09 13.58 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 115.749 -0.66 . . . . 1.61 110.235 -179.037 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.79 -24.78 8.34 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.388 2.059 . . . . 1.3 112.622 -175.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -96.76 -8.18 31.9 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.004 0.43 . . . . 1.97 110.708 -178.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.578 ' O ' ' HB ' ' A' ' 77' ' ' ILE . 17.6 t80 -61.91 -40.17 94.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.762 -0.654 . . . . 1.13 110.208 178.209 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.561 ' NE2' ' HB2' ' A' ' 65' ' ' ALA . 9.5 m-70 -80.33 3.82 19.83 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.877 -0.601 . . . . 0.91 111.174 -178.336 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -108.16 -50.12 3.09 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.032 0.444 . . . . 2.86 110.114 179.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 38.0 mt -78.71 -36.95 20.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.74 -0.664 . . . . 1.0 110.692 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.578 ' HB ' ' O ' ' A' ' 73' ' ' TYR . 28.1 mm -99.79 135.6 34.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.903 -0.59 . . . . 0.75 109.819 -178.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.66 -40.64 14.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.813 0.339 . . . . 1.99 111.019 -176.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 10.1 m-20 -113.26 95.73 36.5 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.196 -0.456 . . . . 2.05 110.03 177.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -68.59 92.87 0.42 Allowed 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.924 2.416 . . . . 0.89 112.306 -178.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 13.3 mmt -135.79 167.28 21.46 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.121 -0.49 . . . . 0.82 110.633 -178.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.499 ' OD2' ' HA ' ' A' ' 62' ' ' PRO . 3.0 p-10 -151.49 -123.19 0.04 OUTLIER 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.044 -0.98 . . . . 1.42 108.788 -177.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -125.31 -17.77 5.55 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.082 0.467 . . . . 0.8 110.301 177.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.459 ' O ' ' HB2' ' A' ' 88' ' ' LYS . . . -88.65 -23.97 34.57 Favored Glycine 0 N--CA 1.44 -1.088 0 N-CA-C 110.304 -1.118 . . . . 0.32 110.304 179.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -76.89 -39.98 49.08 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.332 -0.434 . . . . 0.95 110.442 175.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.606 HG23 ' SG ' ' A' ' 101' ' ' CYS . 38.9 mt -59.8 -49.09 85.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.707 -0.679 . . . . 0.97 110.369 176.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.421 ' HG3' ' O ' ' A' ' 84' ' ' GLY . 0.2 OUTLIER -67.14 -28.94 68.55 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.367 -0.379 . . . . 1.15 110.682 179.138 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.459 ' HB2' ' O ' ' A' ' 84' ' ' GLY . 11.1 tttt -64.89 -41.73 95.38 Favored 'General case' 0 N--CA 1.457 -0.089 0 CA-C-O 121.049 0.452 . . . . 2.46 110.691 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 10.0 mtp180 -75.25 -32.35 61.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.012 -0.54 . . . . 1.16 110.68 178.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 8.1 mt -63.52 -53.17 56.09 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.863 -0.608 . . . . 0.49 111.167 178.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -66.79 -30.38 70.56 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.079 -0.51 . . . . 1.39 111.211 -176.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 12.4 m-80 -84.15 0.0 50.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.151 -0.477 . . . . 1.3 111.184 -177.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 60.52 50.97 5.42 Favored 'General case' 0 N--CA 1.466 0.373 0 O-C-N 123.705 0.628 . . . . 1.75 111.393 178.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . 0.473 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 61.3 t80 -82.87 -33.59 26.99 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.082 -0.508 . . . . 0.96 111.193 179.279 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.689 ' CD1' ' HB3' ' A' ' 100' ' ' GLU . 41.0 m-85 -90.78 169.45 10.94 Favored 'General case' 0 CA--C 1.507 -0.692 0 CA-C-O 121.541 0.686 . . . . 1.28 111.607 -176.148 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . 0.448 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 2.0 t90 -88.3 -44.7 10.62 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 114.526 -1.215 . . . . 1.05 109.2 169.314 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.432 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 35.3 t -152.12 177.18 10.77 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.139 -0.937 . . . . 1.0 110.224 -172.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -69.29 -18.05 63.8 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.928 0.394 . . . . 0.66 111.284 -177.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.57 -18.44 64.87 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.075 -0.511 . . . . 0.85 110.874 178.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.689 ' HB3' ' CD1' ' A' ' 95' ' ' TYR . 1.5 mt-10 -86.32 -39.95 15.96 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 109.435 -0.58 . . . . 2.44 109.435 177.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.606 ' SG ' HG23 ' A' ' 86' ' ' ILE . 0.1 OUTLIER -68.58 -30.84 69.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.432 -0.804 . . . . 0.95 110.758 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 9.6 ttm -56.78 -33.43 66.63 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.031 -0.532 . . . . 1.13 110.595 177.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -66.28 -41.35 89.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.847 -0.615 . . . . 2.96 110.539 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -76.51 -38.91 54.44 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.089 -0.505 . . . . 1.87 110.494 -178.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.629 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -59.7 -47.0 87.36 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.159 -0.473 . . . . 0.38 110.194 177.06 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -57.53 -47.1 82.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.852 -0.613 . . . . 0.97 109.823 175.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 89.1 m -59.95 -50.15 74.88 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.657 -0.701 . . . . 0.43 111.077 179.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.03 -41.69 68.33 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 122.594 0.357 . . . . 0.88 111.496 -178.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -70.31 -47.5 60.84 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.0 0.429 . . . . 0.29 110.043 -177.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 38.1 p -66.63 -30.52 70.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.883 -0.599 . . . . 0.66 111.144 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 23.3 m-20 -54.9 -45.54 74.72 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-O 121.188 0.518 . . . . 1.84 110.127 178.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 18.6 t -61.76 -41.5 97.76 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.252 -0.885 . . . . 0.63 110.808 179.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.492 ' HD1' HG22 ' A' ' 123' ' ' VAL . 22.8 m-85 -71.16 -22.96 61.98 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.168 -0.469 . . . . 0.81 111.531 -176.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 51.7 mt -93.15 -52.3 10.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.968 0.413 . . . . 0.55 111.609 -179.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -66.31 -35.31 80.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.685 -0.689 . . . . 1.22 111.474 -173.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -106.49 -174.41 2.53 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.119 -0.491 . . . . 1.04 110.73 -176.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.45 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 0.0 OUTLIER -80.93 145.73 57.83 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 116.585 -0.28 . . . . 3.47 110.257 178.978 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -64.29 -9.08 18.55 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.671 2.248 . . . . 0.96 112.628 179.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -124.35 26.68 7.28 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.037 -0.528 . . . . 1.23 110.369 177.154 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 0.4 OUTLIER -84.18 171.35 12.89 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.499 . . . . 1.34 111.197 -177.518 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -65.03 -53.05 51.95 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.745 -0.661 . . . . 1.44 110.607 -177.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 3.1 tp -63.97 -29.61 47.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.629 -0.714 . . . . 0.42 111.104 -178.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.492 HG22 ' HD1' ' A' ' 113' ' ' TYR . 2.0 t -70.35 -43.62 78.19 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-O 121.085 0.469 . . . . 0.35 110.02 177.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -58.32 -37.29 74.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.508 -0.769 . . . . 0.52 109.55 177.315 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . 0.495 ' O ' HD13 ' A' ' 129' ' ' LEU . 33.1 mtt -70.54 -45.68 65.05 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.179 -0.919 . . . . 0.62 110.825 178.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.84 -34.91 63.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 0.31 111.973 -178.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.39 -47.06 85.78 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.69 -0.232 . . . . 1.94 111.054 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -70.81 -39.27 73.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.061 0.457 . . . . 0.32 110.606 178.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.495 HD13 ' O ' ' A' ' 125' ' ' MET . 4.7 mp -56.9 -41.37 77.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.431 -0.804 . . . . 0.33 110.491 177.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -59.82 -30.34 68.86 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.281 -0.872 . . . . 1.47 112.355 -178.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.517 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 9.3 mmtp -63.25 -49.1 75.45 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-O 120.629 0.252 . . . . 2.24 110.605 -171.26 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -72.49 -24.57 21.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.359 -0.382 . . . . 1.23 110.86 -179.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.463 ' O ' HG23 ' A' ' 137' ' ' VAL . 26.4 t80 -63.16 -62.58 1.6 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.247 -0.433 . . . . 0.46 110.564 178.165 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.59 -22.75 62.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.888 0.375 . . . . 0.64 110.689 -175.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.517 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -65.03 -51.16 63.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.849 -0.614 . . . . 1.61 110.447 179.798 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . 0.422 ' HD3' HG12 ' A' ' 45' ' ' VAL . 40.8 mttt -80.8 -15.31 56.74 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.058 -0.519 . . . . 1.52 111.146 -175.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 133' ' ' PHE . 38.8 t -80.49 -35.22 15.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.227 -0.442 . . . . 0.35 110.083 177.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -69.51 -11.17 60.62 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.215 0.531 . . . . 0.5 110.793 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -97.48 -8.63 28.81 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.84 -0.618 . . . . 1.76 110.616 179.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -71.71 139.66 83.51 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 116.094 -0.503 . . . . 0.86 111.018 -177.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.567 ' HG2' HD21 ' A' ' 37' ' ' ASN . 56.2 Cg_endo -72.0 98.43 0.9 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.653 2.235 . . . . 0.67 111.969 177.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . 0.427 ' HA ' ' NE2' ' A' ' 38' ' ' GLN . 0.3 OUTLIER -73.66 -8.45 56.04 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.014 0.435 . . . . 2.91 110.604 -179.996 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -66.81 -35.46 80.11 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.082 -0.71 . . . . 2.7 109.082 174.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.517 ' HG2' ' NE2' ' A' ' 38' ' ' GLN . 0.0 OUTLIER 74.72 143.17 0.07 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 114.037 -1.438 . . . . 2.34 112.651 174.31 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . 0.439 ' O ' ' HB3' ' A' ' 37' ' ' ASN . 2.9 t -140.62 104.16 1.58 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-N 114.321 -1.309 . . . . 0.99 108.86 176.025 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.542 ' HG3' HG22 ' A' ' 36' ' ' THR . 16.8 tt0 -72.29 141.32 48.88 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.877 -0.416 . . . . 1.53 109.877 178.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 34.8 mt . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.495 -0.764 . . . . 1.57 109.829 -178.543 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.658 0 N-CA-C 111.759 -0.536 . . . . 2.17 111.759 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 104.71 -68.79 0.26 Allowed Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.927 -0.654 . . . . 1.97 111.708 -177.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -114.54 115.02 26.54 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.252 -0.647 . . . . 3.58 109.252 -179.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 315' ' ' ALY . . . . . 0.637 HH32 HD11 ' A' ' 68' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.729 0 CA-C-O 118.73 -0.652 . . . . 4.6 109.861 179.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_endo . . . . . 0 N--CA 1.48 0.707 0 N-CA-C 110.255 -0.709 . . . . 6.18 110.255 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -104.08 152.5 22.01 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.788 -0.449 . . . . 5.71 109.788 178.007 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.45 -83.37 0.88 Allowed Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.852 -0.69 . . . . 3.45 112.122 179.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 78.5 p -86.45 133.84 33.73 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.742 0.306 . . . . 2.44 111.401 -177.404 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.648 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 6.0 mt-10 -65.89 132.04 47.7 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.882 -0.599 . . . . 1.64 111.836 177.323 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -113.04 -12.46 11.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.512 -0.767 . . . . 0.93 110.218 176.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.2 m -156.21 138.92 15.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.502 -0.772 . . . . 1.61 109.204 178.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.493 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 19.6 t-20 -144.5 138.01 14.27 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-O 120.696 0.284 . . . . 1.6 110.412 178.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -69.94 -48.25 0.72 Allowed 'Trans proline' 0 CA--C 1.531 0.366 0 C-N-CA 123.138 2.559 . . . . 1.87 113.287 177.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.513 ' O ' ' HD3' ' A' ' 32' ' ' PRO . 28.2 t -77.1 -33.07 57.01 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.952 0.406 . . . . 2.18 110.729 -175.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.493 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 0.6 OUTLIER -92.01 104.22 10.11 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.82 -0.627 . . . . 2.75 109.85 177.981 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.513 ' HD3' ' O ' ' A' ' 30' ' ' SER . 16.2 Cg_exo -68.64 154.13 72.05 Favored 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 122.69 2.26 . . . . 1.38 112.845 -177.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -131.27 121.85 3.29 Favored Glycine 0 N--CA 1.441 -0.973 0 N-CA-C 110.291 -1.124 . . . . 0.97 110.291 178.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.479 ' HG3' ' CE2' ' A' ' 96' ' ' TRP . 1.5 mmm180 -131.47 171.91 12.83 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.895 0.379 . . . . 1.93 110.576 -174.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.485 ' HA ' HD22 ' A' ' 39' ' ' LEU . 0.1 OUTLIER -108.94 103.32 12.34 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.105 -0.498 . . . . 2.64 110.134 179.341 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.687 HG22 ' HG3' ' A' ' 146' ' ' GLU . 23.9 p -109.05 170.18 8.21 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.182 -0.463 . . . . 0.68 111.066 178.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.444 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 55.6 t30 -62.67 -49.78 73.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.964 -0.562 . . . . 1.47 110.8 -179.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.8 tt0 -61.6 -37.43 83.88 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 120.689 0.281 . . . . 1.04 110.781 -179.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.779 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.6 OUTLIER -61.2 -59.2 5.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.932 -0.576 . . . . 0.8 110.884 -179.954 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 7.5 mm100 -67.37 -29.44 68.97 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 116.081 -0.509 . . . . 1.75 110.742 -178.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.444 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 44.7 t80 -60.63 -63.39 1.32 Allowed 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.796 -0.638 . . . . 0.64 110.872 177.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.493 ' O ' HG12 ' A' ' 47' ' ' VAL . 23.6 ttp -61.04 -28.62 69.19 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.851 0.358 . . . . 1.13 110.358 -173.217 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.536 ' HB2' HD22 ' A' ' 90' ' ' LEU . 12.4 tt0 -61.41 -58.48 8.02 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.54 -0.755 . . . . 1.3 111.273 177.159 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -86.01 -26.59 25.33 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.364 -0.38 . . . . 0.5 111.777 -175.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.685 HG12 ' HG2' ' A' ' 136' ' ' LYS . 93.6 t -89.37 -57.84 3.94 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 N-CA-C 112.382 0.512 . . . . 0.3 112.382 -176.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.794 HG22 ' HB3' ' A' ' 136' ' ' LYS . 67.9 t -81.82 -66.59 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 N-CA-C 112.016 0.376 . . . . 0.26 112.016 -170.385 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.493 HG12 ' O ' ' A' ' 42' ' ' MET . 0.9 OUTLIER -66.43 -34.21 68.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 120.477 -0.489 . . . . 0.83 111.298 -174.016 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.461 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -59.53 -38.04 79.95 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 121.012 -0.275 . . . . 2.4 111.437 178.456 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.7 m -74.6 -35.83 62.97 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.865 -0.334 . . . . 0.55 110.711 179.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.62 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -67.26 -33.86 76.22 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.266 0.555 . . . . 0.33 109.574 176.767 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 18.2 t-105 -65.06 -31.18 72.27 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.472 -0.786 . . . . 0.39 110.877 177.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.461 ' HG3' ' O ' ' A' ' 48' ' ' LYS . 13.6 mtpp -83.65 14.87 3.51 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.888 0.375 . . . . 2.24 111.646 -176.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.432 ' CD2' HD11 ' A' ' 132' ' ' ILE . 4.6 t-80 -98.82 128.43 45.03 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.095 -0.705 . . . . 0.39 109.095 173.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.415 ' NE2' ' HA ' ' A' ' 54' ' ' GLN . 0.0 OUTLIER -85.57 9.74 15.15 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.698 -0.401 . . . . 1.91 111.797 -173.991 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 6.2 m-85 -103.35 -6.95 21.43 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.26 -0.644 . . . . 0.93 109.26 170.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.517 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -94.64 14.99 19.29 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.43 -0.804 . . . . 0.28 110.11 177.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.567 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 48.9 p-90 -66.92 -34.54 7.57 Favored Pre-proline 0 CA--C 1.544 0.74 0 N-CA-C 113.467 0.914 . . . . 0.58 113.467 -175.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.567 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 7.6 Cg_exo -73.79 -2.67 12.55 Favored 'Trans proline' 0 C--N 1.364 1.357 0 CA-C-N 121.108 1.431 . . . . 0.47 111.512 177.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.439 ' HB3' ' HB2' ' A' ' 83' ' ' MET . 1.9 m-85 -105.64 0.16 26.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.824 -0.626 . . . . 1.11 110.462 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 6.2 m-30 -66.47 -40.47 89.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.331 0.586 . . . . 0.63 110.88 -178.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.64 129.48 28.76 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-N 115.467 -0.788 . . . . 1.63 110.179 -176.587 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.572 ' HA ' ' OD2' ' A' ' 82' ' ' ASP . 19.5 Cg_endo -59.95 147.12 94.03 Favored 'Trans proline' 0 C--O 1.238 0.512 0 C-N-CA 122.964 2.443 . . . . 0.87 113.475 -176.233 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.411 ' O ' HG12 ' A' ' 63' ' ' VAL . 2.5 t -86.84 98.88 7.56 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 N-CA-C 108.408 -0.96 . . . . 0.88 108.408 177.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -109.78 12.12 24.14 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 114.812 -1.085 . . . . 1.85 110.896 -174.328 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 77.93 -17.55 0.56 Allowed 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 114.721 -1.127 . . . . 1.29 112.526 177.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 3.6 mt -109.29 -49.11 7.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 120.811 0.339 . . . . 1.89 110.762 -177.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.6 ttmm -56.96 -43.38 81.53 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.96 -0.563 . . . . 2.99 110.95 -179.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.585 ' HB3' HD22 ' A' ' 70' ' ' LEU . 0.0 OUTLIER -95.2 0.99 54.56 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.038 -0.528 . . . . 1.66 111.086 179.043 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 53.16 60.43 3.76 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 109.106 -0.701 . . . . 1.74 109.106 -174.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.585 HD22 ' HB3' ' A' ' 68' ' ' LEU . 0.4 OUTLIER -128.6 66.07 73.52 Favored Pre-proline 0 C--N 1.326 -0.426 0 CA-C-N 115.497 -0.774 . . . . 1.61 111.662 -170.124 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -77.49 -27.79 6.03 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.186 1.924 . . . . 1.3 111.828 177.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -76.83 -23.99 52.74 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.591 -0.731 . . . . 1.97 110.448 -179.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.46 -43.59 93.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.452 -0.795 . . . . 1.13 110.468 178.254 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -77.66 6.31 7.56 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.254 -0.885 . . . . 0.91 111.195 -175.323 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -108.93 -57.98 2.08 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 120.869 0.366 . . . . 2.86 110.046 -179.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 26.9 mt -73.45 -42.7 56.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.835 -0.62 . . . . 1.0 110.852 -179.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.487 HD11 ' HB2' ' A' ' 115' ' ' TYR . 27.1 mm -87.54 126.39 41.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.188 0.518 . . . . 0.75 110.004 -178.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.05 -53.99 45.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.515 -0.766 . . . . 1.99 110.879 -176.67 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.742 ' HB2' HG21 ' A' ' 107' ' ' THR . 0.3 OUTLIER -120.48 95.3 49.02 Favored Pre-proline 0 C--N 1.324 -0.539 0 N-CA-C 109.75 -0.463 . . . . 2.05 109.75 178.01 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -67.87 100.25 0.6 Allowed 'Trans proline' 0 CA--C 1.528 0.206 0 C-N-CA 122.19 1.926 . . . . 0.89 111.775 178.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -127.81 159.64 34.22 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.449 0.642 . . . . 0.82 111.428 -176.234 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.572 ' OD2' ' HA ' ' A' ' 62' ' ' PRO . 2.3 p-10 -136.99 -116.21 0.16 Allowed 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 114.383 -1.281 . . . . 1.42 108.649 -177.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . 0.439 ' HB2' ' HB3' ' A' ' 59' ' ' PHE . 3.5 ttp -132.71 -19.51 2.34 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.795 0.331 . . . . 0.8 110.645 176.045 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -84.1 -29.13 31.97 Favored Glycine 0 N--CA 1.442 -0.905 0 N-CA-C 110.556 -1.018 . . . . 0.32 110.556 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.19 -39.01 68.93 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.925 0.393 . . . . 0.95 110.492 176.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.513 HG23 ' SG ' ' A' ' 101' ' ' CYS . 62.1 mt -59.76 -50.41 80.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.559 -0.746 . . . . 0.97 110.304 177.015 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.505 ' O ' ' HG2' ' A' ' 91' ' ' GLU . 0.0 OUTLIER -70.6 -21.9 62.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.337 -0.392 . . . . 1.15 111.37 -178.6 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.533 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 12.5 tppt? -65.09 -42.6 93.93 Favored 'General case' 0 CA--C 1.526 0.043 0 CA-C-O 120.714 0.292 . . . . 2.46 110.765 179.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.484 HH21 ' HE2' ' A' ' 94' ' ' TYR . 63.4 mtp180 -68.26 -32.33 72.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.96 0.409 . . . . 1.16 110.456 176.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.63 ' HG ' ' OH ' ' A' ' 95' ' ' TYR . 4.7 mt -69.13 -59.72 2.84 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.543 -0.753 . . . . 0.49 111.662 -177.195 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.505 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 16.6 pt-20 -73.95 -15.98 61.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.044 -0.526 . . . . 1.39 111.819 -173.031 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.533 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 0.9 OUTLIER -94.9 -3.39 48.79 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.997 -0.281 . . . . 1.3 110.363 176.962 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 52.3 57.43 6.46 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.653 -0.703 . . . . 1.75 111.186 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . 0.648 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 27.6 t80 -75.7 -48.91 19.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.322 -0.399 . . . . 0.96 110.888 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.63 ' OH ' ' HG ' ' A' ' 90' ' ' LEU . 0.1 OUTLIER -97.92 177.65 5.37 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.211 0.529 . . . . 1.28 111.212 -175.212 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . 0.479 ' CE2' ' HG3' ' A' ' 34' ' ' ARG . 1.9 t-105 -77.92 -48.03 17.28 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.277 -0.874 . . . . 1.05 110.761 -179.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 17.3 t -142.42 168.47 19.66 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.862 0.363 . . . . 1.0 110.892 -173.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.779 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -78.23 -11.71 59.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.033 -0.53 . . . . 0.66 111.613 -175.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.98 -27.39 66.8 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.002 0.43 . . . . 0.85 110.581 178.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.98 -36.19 59.33 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.073 -0.512 . . . . 2.44 110.245 177.537 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.513 ' SG ' HG23 ' A' ' 86' ' ' ILE . 0.5 OUTLIER -70.75 -19.81 62.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.197 -0.456 . . . . 0.95 110.897 179.678 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.582 ' HE1' HG22 ' A' ' 137' ' ' VAL . 11.3 mmt -55.95 -26.12 46.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.191 0.519 . . . . 1.13 110.144 173.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.16 -39.88 60.03 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.751 -0.659 . . . . 2.96 109.995 176.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -59.88 -53.98 51.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.817 -0.629 . . . . 1.87 110.345 178.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.62 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.6 OUTLIER -57.26 -47.7 80.76 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.497 -0.774 . . . . 0.38 110.605 -179.934 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -56.85 -44.01 81.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.787 -0.642 . . . . 0.97 110.256 177.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.742 HG21 ' HB2' ' A' ' 79' ' ' ASN . 90.5 m -64.3 -47.47 79.36 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.02 -0.537 . . . . 0.43 111.317 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.402 ' HG3' ' O ' ' A' ' 82' ' ' ASP . 0.3 OUTLIER -51.12 -44.4 61.34 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.734 0.302 . . . . 0.88 111.011 179.298 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -72.68 -47.55 46.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.02 -0.536 . . . . 0.29 110.953 -177.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 2.4 p -64.75 -37.5 87.82 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.46 -0.336 . . . . 0.66 110.91 -178.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . 0.467 ' OD1' HG13 ' A' ' 77' ' ' ILE . 0.4 OUTLIER -54.33 -45.43 72.67 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.803 -0.635 . . . . 1.84 110.32 178.1 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . 0.588 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 1.2 m -60.93 -40.58 93.78 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.948 -0.569 . . . . 0.63 110.813 176.328 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 17.3 m-85 -74.6 -19.7 60.21 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.265 -0.425 . . . . 0.81 111.094 -176.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 68.0 mt -93.42 -61.41 2.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.49 -0.323 . . . . 0.55 111.557 -179.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.487 ' HB2' HD11 ' A' ' 77' ' ' ILE . 43.2 t80 -68.89 -49.62 56.68 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 121.062 0.458 . . . . 1.22 110.446 -175.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . 0.588 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 14.0 m120 -80.02 167.58 20.27 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.654 -0.703 . . . . 1.04 110.214 177.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.484 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 6.4 mttp -98.0 160.73 27.7 Favored Pre-proline 0 C--N 1.318 -0.769 0 N-CA-C 109.739 -0.467 . . . . 3.47 109.739 177.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . 0.691 ' HA ' HG11 ' A' ' 123' ' ' VAL . 18.9 Cg_endo -61.51 -13.63 30.56 Favored 'Trans proline' 0 C--N 1.344 0.342 0 C-N-CA 122.474 2.116 . . . . 0.96 111.762 175.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -95.82 -4.11 44.39 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.251 -0.886 . . . . 1.23 111.284 178.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.618 ' OD2' ' HA2' ' B' ' 313' ' ' GLY . 1.9 m-20 -74.06 148.3 42.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.987 0.422 . . . . 1.34 110.471 -176.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.77 -43.56 98.6 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.612 -0.722 . . . . 1.44 111.105 -175.537 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.412 ' HB ' HH33 ' B' ' 312' ' ' ALY . 2.0 tp -66.4 -33.1 61.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.874 -0.603 . . . . 0.42 111.291 -178.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.691 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.1 t -66.09 -42.06 90.69 Favored 'Isoleucine or valine' 0 C--O 1.234 0.282 0 CA-C-O 121.109 0.48 . . . . 0.35 109.792 178.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.81 -32.14 70.37 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.549 -0.75 . . . . 0.52 110.05 178.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . 0.505 ' O ' HD13 ' A' ' 129' ' ' LEU . 11.2 mtt -79.24 -46.07 18.54 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.591 -0.731 . . . . 0.62 110.518 177.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -55.46 -41.69 73.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.361 -0.381 . . . . 0.31 111.711 -178.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.66 -31.79 73.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.801 0.334 . . . . 1.94 111.235 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -78.06 -38.88 43.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.094 0.473 . . . . 0.32 110.121 176.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.517 HD21 ' HA ' ' A' ' 56' ' ' ALA . 2.2 mp -59.47 -42.46 92.08 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.414 -0.812 . . . . 0.33 110.172 177.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -52.16 -29.36 21.79 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 114.953 -1.021 . . . . 1.47 112.867 -176.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.509 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.1 OUTLIER -60.64 -44.21 96.64 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-O 120.667 0.27 . . . . 2.24 110.757 -173.955 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.44 ' H ' HG13 ' A' ' 132' ' ' ILE . 0.4 OUTLIER -77.77 -23.61 14.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.159 -0.473 . . . . 1.23 111.105 -176.449 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.553 ' O ' HG23 ' A' ' 137' ' ' VAL . 34.1 t80 -65.92 -63.05 1.17 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.504 -0.316 . . . . 0.46 110.578 -179.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.446 ' H ' ' HG ' ' A' ' 134' ' ' LEU . 0.4 OUTLIER -68.97 -21.74 64.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.948 0.404 . . . . 0.64 110.657 -176.298 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.509 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -68.01 -45.47 73.94 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.697 -0.683 . . . . 1.61 110.185 178.089 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . 0.794 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -79.25 -28.51 42.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.042 -0.526 . . . . 1.52 111.082 -179.216 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.582 HG22 ' HE1' ' A' ' 102' ' ' MET . 54.2 t -65.08 -34.47 70.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.135 0.493 . . . . 0.35 110.573 178.019 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.79 -12.61 61.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.308 0.575 . . . . 0.5 110.509 177.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -105.02 0.37 27.59 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.765 -0.652 . . . . 1.76 110.343 179.013 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . 0.472 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 11.3 mtp -75.74 141.73 72.57 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.955 -0.566 . . . . 0.86 110.924 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -73.44 92.43 0.85 Allowed 'Trans proline' 0 N--CA 1.462 -0.355 0 C-N-CA 122.324 2.016 . . . . 0.67 110.964 177.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -74.24 -1.65 21.5 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.042 -0.526 . . . . 2.91 111.648 -173.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -82.1 -39.37 23.45 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.65 -0.5 . . . . 2.7 109.65 175.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 72.93 134.23 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 114.504 -1.226 . . . . 2.34 111.697 178.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 34.4 t -142.49 112.24 2.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.299 -0.864 . . . . 0.99 109.14 179.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.687 ' HG3' HG22 ' A' ' 36' ' ' THR . 31.1 tt0 -63.13 138.51 58.57 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 120.719 -0.392 . . . . 1.53 110.396 179.463 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 96.5 mt . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.528 -0.749 . . . . 1.57 110.618 -174.03 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.519 0 N-CA-C 112.09 -0.404 . . . . 2.17 112.09 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 312' ' ' ALY . . . . . 0.46 ' HB3' HD11 ' A' ' 70' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 313' ' ' GLY . . . . . 0.618 ' HA2' ' OD2' ' A' ' 120' ' ' ASP . . . 113.7 -66.42 0.26 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.928 -0.653 . . . . 1.97 112.862 176.303 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 314' ' ' LYS . . . . . 0.422 ' HG3' ' H ' ' B' ' 314' ' ' LYS . 0.0 OUTLIER -111.59 149.22 31.76 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.81 0.338 . . . . 3.58 110.722 -175.43 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.924 0 CA-C-O 118.115 -0.945 . . . . 4.6 109.969 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo . . . . . 0 N--CA 1.479 0.646 0 N-CA-C 110.453 -0.634 . . . . 6.18 110.453 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.474 HD13 ' HA ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -131.09 97.88 4.42 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.687 -0.486 . . . . 5.71 109.687 178.797 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 91.22 72.16 1.23 Allowed Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.731 -0.747 . . . . 3.45 111.849 -179.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 9.5 p -57.98 129.6 42.67 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-O 120.957 0.408 . . . . 2.44 111.225 179.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.591 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 19.9 mt-10 -75.68 130.26 38.43 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.591 -0.731 . . . . 1.64 112.627 -175.391 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.4 p -117.81 -7.1 11.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.107 -0.951 . . . . 0.93 109.235 172.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.4 m -162.97 135.38 5.4 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 114.979 -1.01 . . . . 1.61 109.375 175.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.427 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 23.4 t-20 -126.94 125.86 24.3 Favored Pre-proline 0 C--N 1.321 -0.633 0 N-CA-C 109.742 -0.466 . . . . 1.6 109.742 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -66.06 -46.63 4.36 Favored 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 123.057 2.505 . . . . 1.87 113.017 -176.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 48.8 m -77.93 -22.02 50.24 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.987 0.422 . . . . 2.18 110.97 -176.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.427 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 4.6 ttmt -81.94 113.38 42.64 Favored Pre-proline 0 C--N 1.325 -0.484 0 N-CA-C 109.172 -0.677 . . . . 2.75 109.172 173.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.457 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 12.6 Cg_exo -65.34 147.17 87.28 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 121.778 1.652 . . . . 1.38 111.767 -179.234 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -127.81 130.27 6.66 Favored Glycine 0 N--CA 1.442 -0.913 0 CA-C-N 115.417 -0.811 . . . . 0.97 111.197 -176.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 34' ' ' ARG . 1.1 ttp180 -140.3 -179.96 6.3 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 120.975 0.417 . . . . 1.93 110.167 -178.4 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.3 106.06 10.76 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.835 -0.62 . . . . 2.64 109.602 177.565 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.524 HG22 ' HG3' ' A' ' 146' ' ' GLU . 1.3 p -109.14 166.68 10.67 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 120.711 -0.396 . . . . 0.68 110.281 175.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.667 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 0.2 OUTLIER -66.83 -26.56 66.98 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.859 -0.609 . . . . 1.47 110.661 -178.211 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -75.38 -39.29 59.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.817 0.341 . . . . 1.04 110.3 177.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.52 -53.45 56.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.924 -0.58 . . . . 0.8 110.555 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 8.9 mm100 -70.85 -24.11 62.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.825 -0.625 . . . . 1.75 110.682 -178.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.667 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 35.7 t80 -61.14 -64.11 1.06 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 116.169 -0.468 . . . . 0.64 110.905 177.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.511 ' O ' HG12 ' A' ' 47' ' ' VAL . 2.2 ttm -60.28 -31.71 70.5 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.813 -0.355 . . . . 1.13 110.506 -174.093 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -59.07 -57.27 13.81 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.734 -0.666 . . . . 1.3 110.997 179.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 69.3 m-80 -86.28 -29.53 22.99 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.104 0.409 . . . . 0.5 112.104 -176.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 99.3 t -88.31 -57.82 3.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 112.161 0.43 . . . . 0.3 112.161 -175.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.653 HG22 ' HB3' ' A' ' 136' ' ' LYS . 60.2 t -82.14 -66.8 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 112.11 0.411 . . . . 0.26 112.11 -169.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.511 HG12 ' O ' ' A' ' 42' ' ' MET . 1.5 p -68.91 -32.9 56.49 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.326 0 C-N-CA 120.711 -0.395 . . . . 0.83 111.411 -174.099 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.11 -26.1 68.1 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 122.092 -0.38 . . . . 2.4 111.084 177.178 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 35.2 m -85.65 -38.1 18.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.77 0.319 . . . . 0.55 110.503 177.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.66 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -66.48 -39.94 89.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.039 0.447 . . . . 0.33 110.211 177.687 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 29.2 t-105 -60.37 -35.52 75.91 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.47 -0.787 . . . . 0.39 111.662 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.59 -4.1 52.83 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.064 0.394 . . . . 2.24 112.064 -174.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.589 ' ND1' ' HB2' ' A' ' 55' ' ' PHE . 10.0 t-80 -75.56 128.71 35.88 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.265 -0.643 . . . . 0.39 109.265 176.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -81.08 7.13 11.66 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.83 0.348 . . . . 1.91 111.46 -174.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.589 ' HB2' ' ND1' ' A' ' 53' ' ' HIS . 2.3 m-30 -103.36 -8.51 20.19 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.514 -0.55 . . . . 0.93 109.514 172.361 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.616 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -91.18 9.98 28.93 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.786 -0.643 . . . . 0.28 110.641 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.495 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 57.8 p-90 -61.9 -35.38 21.22 Favored Pre-proline 0 CA--C 1.547 0.842 0 N-CA-C 113.916 1.08 . . . . 0.58 113.916 -175.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.495 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 3.0 Cg_exo -76.98 -10.78 18.08 Favored 'Trans proline' 0 C--N 1.364 1.358 0 CA-C-N 121.016 1.399 . . . . 0.47 111.733 178.716 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -101.6 10.84 39.84 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.702 -0.681 . . . . 1.11 110.431 -177.028 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 2.9 m-30 -73.23 -31.67 64.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.794 -0.639 . . . . 0.63 111.001 -179.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -114.59 144.7 32.35 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 115.77 -0.65 . . . . 1.63 110.564 -173.634 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.549 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 33.3 Cg_endo -66.35 151.46 83.24 Favored 'Trans proline' 0 C--O 1.237 0.474 0 C-N-CA 122.885 2.39 . . . . 0.87 112.905 -178.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.467 ' O ' HG12 ' A' ' 63' ' ' VAL . 1.4 t -70.42 101.79 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 CA-C-O 122.258 1.028 . . . . 0.88 109.253 173.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -96.16 6.1 49.57 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.336 -1.302 . . . . 1.85 108.993 176.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 69.4 -71.68 0.12 Allowed 'General case' 0 C--O 1.226 -0.137 0 CA-C-N 114.525 -1.216 . . . . 1.29 110.555 -175.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 5.7 mt -65.0 -39.68 86.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 116.372 -0.376 . . . . 1.89 111.09 -176.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.41 -24.25 65.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.034 -0.53 . . . . 2.99 111.766 -179.593 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.488 HD13 ' HA ' ' A' ' 68' ' ' LEU . 0.2 OUTLIER -117.06 5.74 12.83 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.636 0.255 . . . . 1.66 111.513 -178.662 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 65.24 35.37 7.76 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.826 -0.624 . . . . 1.74 111.576 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.702 HD21 ' HG2' ' B' ' 312' ' ' ALY . 2.6 mt -120.19 74.03 21.01 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 115.86 -0.609 . . . . 1.61 110.303 177.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.19 -29.85 25.88 Favored 'Trans proline' 0 C--O 1.233 0.25 0 C-N-CA 122.413 2.075 . . . . 1.3 113.216 -173.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -101.74 13.37 35.06 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.263 0.554 . . . . 1.97 111.057 -177.142 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.401 ' CD2' HG11 ' A' ' 63' ' ' VAL . 13.9 t80 -57.52 -41.25 80.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.68 -0.691 . . . . 1.13 110.442 177.323 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 18.7 m-70 -76.2 3.42 10.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.738 -0.665 . . . . 0.91 111.744 -176.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 2.0 mmpt? -97.28 -38.32 9.72 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.05 0.452 . . . . 2.86 109.972 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.9 mt -94.81 -47.7 13.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.962 -0.563 . . . . 1.0 110.037 177.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 41.9 mm -91.66 102.42 13.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.822 -0.626 . . . . 0.75 109.469 179.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.1 mtmt -72.35 -29.15 63.53 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.375 -0.83 . . . . 1.99 111.308 -174.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -116.22 80.17 9.36 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 115.719 -0.673 . . . . 2.05 110.315 178.109 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -69.16 97.69 0.6 Allowed 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.9 2.4 . . . . 0.89 111.865 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.6 mmt -133.36 155.02 50.21 Favored 'General case' 0 CA--C 1.51 -0.566 0 CA-C-O 121.363 0.601 . . . . 0.82 110.673 -177.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.549 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 5.0 p-10 -134.98 -129.85 0.16 Allowed 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 114.411 -1.268 . . . . 1.42 109.078 -172.029 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.25 -14.54 4.82 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.299 0.571 . . . . 0.8 110.266 178.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -90.62 -32.03 9.71 Favored Glycine 0 N--CA 1.441 -1.021 0 N-CA-C 109.921 -1.271 . . . . 0.32 109.921 -178.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.471 ' OG1' ' HB3' ' A' ' 62' ' ' PRO . 98.0 m -67.79 -37.32 81.88 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.004 -0.598 . . . . 0.95 110.5 173.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 54.9 mt -63.22 -50.87 77.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.984 -0.553 . . . . 0.97 109.976 176.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.542 ' O ' ' HG2' ' A' ' 91' ' ' GLU . 0.0 OUTLIER -65.47 -29.9 70.62 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.691 -0.686 . . . . 1.15 110.9 -179.737 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 30.6 tttt -66.79 -37.82 85.31 Favored 'General case' 0 C--N 1.337 0.053 0 CA-C-O 120.986 0.422 . . . . 2.46 110.687 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.403 HH12 ' CG ' ' A' ' 104' ' ' ASP . 29.5 mtp180 -74.56 -29.97 61.56 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.072 -0.513 . . . . 1.16 110.594 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.566 ' HG ' ' OH ' ' A' ' 95' ' ' TYR . 2.8 mt -70.09 -57.54 4.85 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.791 -0.64 . . . . 0.49 111.084 179.031 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.542 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 9.0 pt-20 -72.25 -7.23 48.23 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.888 -0.596 . . . . 1.39 112.081 -173.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -106.58 -4.22 19.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.412 0.148 . . . . 1.3 111.168 178.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 57.69 63.8 1.72 Allowed 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.337 0.589 . . . . 1.75 110.854 -177.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . 0.591 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 18.1 t80 -78.23 -26.4 47.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.603 -0.726 . . . . 0.96 111.404 -179.066 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.627 ' HE2' ' HG ' ' A' ' 101' ' ' CYS . 0.1 OUTLIER -135.62 179.19 6.49 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.056 -0.52 . . . . 1.28 111.202 -172.21 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . 0.457 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 1.8 t-105 -66.55 -47.5 72.65 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.451 -0.795 . . . . 1.05 110.742 178.272 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 26.9 t -150.35 167.06 28.15 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.996 -0.547 . . . . 1.0 110.888 -174.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -76.1 -4.69 42.89 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.762 -0.653 . . . . 0.66 111.682 -175.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -60.36 -32.08 70.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.05 0.452 . . . . 0.85 110.476 178.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -66.42 -43.25 86.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.755 -0.657 . . . . 2.44 110.011 177.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.627 ' HG ' ' HE2' ' A' ' 95' ' ' TYR . 0.0 OUTLIER -75.73 -20.28 58.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.925 -0.579 . . . . 0.95 111.381 -177.226 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -55.55 -29.17 58.5 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-O 121.199 0.523 . . . . 1.13 109.989 174.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -73.55 -41.18 63.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.679 -0.691 . . . . 2.96 110.281 175.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . 0.452 ' OD1' ' HA ' ' A' ' 101' ' ' CYS . 8.9 m-20 -68.04 -38.9 83.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.029 -0.532 . . . . 1.87 110.453 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.66 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -59.21 -46.88 87.28 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.871 -0.604 . . . . 0.38 110.466 177.938 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 4.1 t30 -62.55 -42.69 99.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.884 -0.598 . . . . 0.97 109.977 177.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 94.7 m -63.27 -40.21 96.77 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.487 -0.779 . . . . 0.43 111.687 -179.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.75 -42.68 62.51 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.057 0.456 . . . . 0.88 110.902 177.026 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -71.1 -40.33 71.57 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.93 -0.577 . . . . 0.29 110.988 -178.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -41.56 75.01 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.604 -0.271 . . . . 0.66 111.115 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -48.16 -53.26 17.42 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.619 -0.718 . . . . 1.84 111.062 178.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.62 -34.41 77.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.695 -0.684 . . . . 0.63 111.011 -179.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.561 ' HD1' HG22 ' A' ' 123' ' ' VAL . 18.5 m-30 -77.22 -17.77 58.21 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.457 -0.338 . . . . 0.81 111.663 -177.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 67.5 mt -92.72 -53.63 8.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 120.668 0.27 . . . . 0.55 111.305 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -68.59 -37.75 80.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.322 -0.399 . . . . 1.22 110.53 -176.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -108.7 140.94 41.4 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.082 -0.508 . . . . 1.04 109.654 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.33 146.18 97.77 Favored Pre-proline 0 C--N 1.322 -0.599 0 CA-C-N 116.434 -0.348 . . . . 3.47 110.507 -179.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . 0.822 ' HA ' HG11 ' A' ' 123' ' ' VAL . 37.0 Cg_exo -58.93 -12.12 14.25 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 123.215 2.61 . . . . 0.96 113.511 -177.532 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.93 -7.59 59.39 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.432 -0.349 . . . . 1.23 111.655 178.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.457 ' OD2' ' HA2' ' B' ' 313' ' ' GLY . 2.0 t70 -81.88 171.03 14.96 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.506 0.669 . . . . 1.34 112.043 -174.209 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . 0.442 ' HB2' ' HA ' ' B' ' 314' ' ' LYS . 12.0 t0 -76.5 -41.58 46.44 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.497 -1.229 . . . . 1.44 110.791 -174.232 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.634 ' HA ' ' SD ' ' A' ' 125' ' ' MET . 2.6 tp -62.15 -35.55 69.47 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.11 0 CA-C-O 120.974 0.416 . . . . 0.42 110.043 179.313 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.822 HG11 ' HA ' ' A' ' 118' ' ' PRO . 12.5 t -69.74 -49.32 58.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.118 -0.492 . . . . 0.35 110.04 177.201 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.9 -40.09 72.52 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.305 -0.862 . . . . 0.52 110.892 -177.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . 0.634 ' SD ' ' HA ' ' A' ' 122' ' ' ILE . 0.1 OUTLIER -75.58 -38.7 58.93 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.163 -0.472 . . . . 0.62 111.21 179.742 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . 0.42 ' N ' ' HG2' ' A' ' 125' ' ' MET . . . -60.15 -28.82 68.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.394 -0.366 . . . . 0.31 111.099 177.305 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.88 -38.52 91.22 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.26 -0.427 . . . . 1.94 110.815 177.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -73.59 -37.63 65.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.094 -0.503 . . . . 0.32 110.151 177.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.616 HD21 ' HA ' ' A' ' 56' ' ' ALA . 7.1 mp -58.25 -44.75 88.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.532 -0.758 . . . . 0.33 110.213 177.011 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -59.54 -30.56 68.7 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.081 -0.963 . . . . 1.47 111.842 -176.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.477 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -65.38 -46.58 79.54 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.576 -0.284 . . . . 2.24 110.467 -175.023 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.49 HD12 HD23 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -74.0 -21.73 18.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.537 -0.301 . . . . 1.23 110.746 179.828 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.514 ' O ' HG23 ' A' ' 137' ' ' VAL . 30.0 t80 -65.12 -62.23 1.67 Allowed 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.334 -0.394 . . . . 0.46 110.299 177.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.5 pp -66.59 -26.96 67.35 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.035 0.445 . . . . 0.64 110.341 -177.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.477 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -57.93 -48.22 80.55 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.446 -0.797 . . . . 1.61 111.046 178.708 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . 0.653 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -82.81 -24.41 33.38 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.14 -0.482 . . . . 1.52 110.948 -177.873 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 133' ' ' PHE . 59.2 t -70.97 -32.04 47.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.086 0.47 . . . . 0.35 110.362 178.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -69.53 -10.49 58.34 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.064 0.459 . . . . 0.5 110.471 177.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -103.34 -3.55 25.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.946 -0.57 . . . . 1.76 110.926 178.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . 0.492 ' HG3' ' HA ' ' A' ' 137' ' ' VAL . 0.7 OUTLIER -67.91 143.9 96.76 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.094 -0.503 . . . . 0.86 111.337 -177.883 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -70.77 110.79 2.85 Favored 'Trans proline' 0 N--CA 1.462 -0.356 0 C-N-CA 122.52 2.147 . . . . 0.67 111.675 177.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.05 5.79 7.51 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.913 -0.585 . . . . 2.91 111.917 -175.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.413 ' O ' ' HB3' ' A' ' 144' ' ' GLU . 18.3 mt-10 -103.17 -41.18 6.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.436 -0.347 . . . . 2.7 111.244 -177.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.413 ' HB3' ' O ' ' A' ' 143' ' ' GLU . 2.7 tt0 70.95 101.57 0.06 Allowed 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.991 0.807 . . . . 2.34 110.866 -177.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 2.6 t -108.52 133.96 51.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.135 -0.691 . . . . 0.99 109.135 176.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.524 ' HG3' HG22 ' A' ' 36' ' ' THR . 1.2 tt0 -80.63 148.18 30.37 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.004 0.43 . . . . 1.53 111.13 -176.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 22.0 mt . . . . . 0 C--O 1.247 0.955 0 CA-C-O 118.896 -0.573 . . . . 1.57 110.142 178.134 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.663 0 N-CA-C 111.57 -0.612 . . . . 2.17 111.57 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 312' ' ' ALY . . . . . 0.702 ' HG2' HD21 ' A' ' 70' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 313' ' ' GLY . . . . . 0.59 ' O ' ' HB2' ' B' ' 314' ' ' LYS . . . 141.66 76.6 0.04 OUTLIER Glycine 0 N--CA 1.443 -0.861 0 N-CA-C 110.482 -1.047 . . . . 1.97 110.482 -175.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 314' ' ' LYS . . . . . 0.59 ' HB2' ' O ' ' B' ' 313' ' ' GLY . 11.8 mtmt 79.37 99.87 0.06 Allowed 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.442 0.697 . . . . 3.58 109.465 -174.524 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 315' ' ' ALY . . . . . 0.406 ' HD3' ' HB ' ' A' ' 122' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 52.7 mttt . . . . . 0 C--O 1.248 0.994 0 CA-C-N 115.541 -0.754 . . . . 4.6 109.796 179.008 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.455 ' HD2' ' OD1' ' A' ' 79' ' ' ASN . 8.2 Cg_endo . . . . . 0 N--CA 1.48 0.719 0 N-CA-C 110.384 -0.66 . . . . 6.18 110.384 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 33.0 tp -95.29 111.68 23.5 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.894 -0.41 . . . . 5.71 109.894 176.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.23 81.9 1.2 Allowed Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.59 -0.814 . . . . 3.45 111.152 -176.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 61.1 p -90.64 142.3 27.9 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 122.105 0.162 . . . . 2.44 111.056 -178.049 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.627 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 7.4 mt-10 -52.12 125.08 14.56 Favored 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 123.595 0.56 . . . . 1.64 111.812 175.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 7.2 p -106.71 -18.09 7.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 115.773 -0.649 . . . . 0.93 109.847 175.257 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -158.95 137.08 10.55 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.123 -0.944 . . . . 1.61 110.001 176.26 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.469 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 23.8 t-20 -136.8 122.92 13.47 Favored Pre-proline 0 C--N 1.32 -0.69 0 N-CA-C 109.357 -0.608 . . . . 1.6 109.357 173.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -60.4 -46.31 18.5 Favored 'Trans proline' 0 N--CA 1.474 0.338 0 C-N-CA 123.249 2.633 . . . . 1.87 113.008 -175.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.3 m -78.97 -30.04 44.25 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 116.037 -0.529 . . . . 2.18 110.957 -175.201 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.469 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 24.4 tttp -67.41 134.03 93.04 Favored Pre-proline 0 C--N 1.327 -0.402 0 CA-C-N 115.564 -0.744 . . . . 2.75 111.419 -177.378 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_exo -49.18 141.11 24.2 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 123.182 2.588 . . . . 1.38 112.993 173.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -158.91 117.07 0.75 Allowed Glycine 0 N--CA 1.443 -0.84 0 N-CA-C 110.218 -1.153 . . . . 0.97 110.218 177.282 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.434 ' HE ' ' CD ' ' A' ' 146' ' ' GLU . 7.2 mmm180 -131.55 158.82 39.94 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.013 0.435 . . . . 1.93 110.935 -175.377 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.518 ' HA ' HD22 ' A' ' 39' ' ' LEU . 1.5 mtpp -103.6 84.52 2.3 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.981 -0.554 . . . . 2.64 109.598 176.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.643 HG22 ' HG3' ' A' ' 146' ' ' GLU . 1.6 p -87.17 168.56 13.13 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.244 -0.434 . . . . 0.68 110.515 -179.285 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -59.12 -50.98 71.97 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-N 116.489 -0.323 . . . . 1.47 110.749 -178.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.512 ' HB2' ' OE2' ' A' ' 144' ' ' GLU . 1.7 mt-30 -59.21 -39.83 83.92 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.711 0.291 . . . . 1.04 111.222 -179.006 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.653 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.8 OUTLIER -61.66 -55.17 33.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.109 -0.496 . . . . 0.8 110.72 -179.638 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 18.2 mm100 -68.53 -30.47 69.29 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.872 -0.603 . . . . 1.75 110.862 -179.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -61.6 -63.36 1.3 Allowed 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.825 -0.625 . . . . 0.64 110.488 176.556 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.581 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -58.44 -33.62 69.9 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 110.175 -0.306 . . . . 1.13 110.175 -175.418 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -56.98 -56.62 19.34 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.569 -0.741 . . . . 1.3 111.121 178.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 61.3 m-80 -86.66 -28.16 23.34 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.285 -0.416 . . . . 0.5 112.039 -176.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 94.5 t -89.61 -56.89 4.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 N-CA-C 112.243 0.46 . . . . 0.3 112.243 -176.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.702 HG22 ' HB3' ' A' ' 136' ' ' LYS . 59.9 t -79.41 -65.82 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 C-N-CA 121.012 -0.275 . . . . 0.26 111.521 -172.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.5 HG13 ' O ' ' A' ' 42' ' ' MET . 1.9 m -63.49 -33.58 62.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 N-CA-C 111.75 0.278 . . . . 0.83 111.75 -174.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.05 -39.35 86.92 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 121.102 -0.239 . . . . 2.4 111.53 -178.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 5.9 m -75.1 -33.26 61.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.728 0.299 . . . . 0.55 110.642 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.578 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -67.03 -41.06 87.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.324 0.583 . . . . 0.33 109.595 174.128 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 6.9 t-105 -63.03 -35.79 81.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.607 -0.724 . . . . 0.39 111.253 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 3.3 mmpt? -87.62 22.75 2.15 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.25 0.463 . . . . 2.24 112.25 -175.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.55 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 12.9 t-80 -96.24 139.99 31.59 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.42 -0.354 . . . . 0.39 110.07 175.232 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 40.6 mm-40 -81.44 7.03 12.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.777 0.323 . . . . 1.91 111.852 -176.126 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.55 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.7 OUTLIER -115.2 -7.29 12.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.022 0.439 . . . . 0.93 110.165 175.673 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.519 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -99.0 11.05 40.16 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.059 0.457 . . . . 0.28 110.939 -177.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.586 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 32.4 p-90 -63.24 -33.84 11.75 Favored Pre-proline 0 CA--C 1.547 0.855 0 N-CA-C 113.88 1.067 . . . . 0.58 113.88 -175.114 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.586 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 5.9 Cg_exo -78.97 -0.61 10.9 Favored 'Trans proline' 0 C--N 1.359 1.124 0 CA-C-N 121.2 1.464 . . . . 0.47 112.289 176.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -97.99 -2.01 41.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.121 -0.491 . . . . 1.11 110.614 -175.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.555 ' CZ ' ' HA ' ' A' ' 57' ' ' TRP . 13.1 m-30 -74.55 -11.7 60.28 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.02 -0.536 . . . . 0.63 110.603 179.24 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -106.96 119.71 50.42 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 115.902 -0.59 . . . . 1.63 111.23 -170.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.619 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 21.5 Cg_exo -63.44 145.45 92.36 Favored 'Trans proline' 0 C--O 1.237 0.438 0 C-N-CA 122.933 2.422 . . . . 0.87 113.103 -178.621 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 22.3 t -91.01 90.1 3.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 122.119 0.961 . . . . 0.88 108.847 177.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.4 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.6 OUTLIER -108.14 5.12 25.61 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.783 -1.099 . . . . 1.85 110.677 -176.774 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.508 ' HB2' ' NE2' ' A' ' 74' ' ' HIS . . . 79.28 -29.73 0.14 Allowed 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.003 -0.999 . . . . 1.29 112.58 177.385 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -98.76 -49.54 11.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 120.855 0.359 . . . . 1.89 111.901 -174.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.01 -22.45 49.28 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.136 -0.484 . . . . 2.99 111.632 -173.109 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 6.2 tp -112.87 3.59 16.44 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.864 0.364 . . . . 1.66 110.767 177.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . 0.534 ' O ' HD13 ' A' ' 70' ' ' LEU . 15.4 t-20 53.68 69.41 0.71 Allowed 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.461 -0.791 . . . . 1.74 110.88 -178.378 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.534 HD13 ' O ' ' A' ' 69' ' ' ASN . 0.0 OUTLIER -133.31 64.18 68.46 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.584 -0.735 . . . . 1.61 110.596 178.218 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -78.54 -38.8 0.47 Allowed 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.417 2.078 . . . . 1.3 112.548 -178.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -77.97 -15.95 58.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.512 0.672 . . . . 1.97 109.896 -178.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.499 ' HA ' ' CE1' ' A' ' 115' ' ' TYR . 13.2 t80 -53.43 -41.6 66.23 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.845 -1.07 . . . . 1.13 111.007 177.102 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.508 ' NE2' ' HB2' ' A' ' 65' ' ' ALA . 1.8 m-70 -80.35 3.84 19.85 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.585 -0.734 . . . . 0.91 111.724 -173.053 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 15.9 mttp -88.14 -21.98 24.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.396 0.617 . . . . 2.86 109.589 178.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.8 mp -117.63 -46.42 3.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.143 -0.935 . . . . 1.0 110.339 -179.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.5 mm -86.84 111.56 21.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 116.009 -0.541 . . . . 0.75 110.476 -179.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.91 -29.5 58.43 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.072 -0.513 . . . . 1.99 110.87 -179.5 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.455 ' OD1' ' HD2' ' A' ' 21' ' ' PRO . 57.1 m-20 -119.84 81.95 27.06 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 116.031 -0.531 . . . . 2.05 109.962 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -76.06 98.85 1.23 Allowed 'Trans proline' 0 N--CA 1.464 -0.235 0 C-N-CA 123.265 2.644 . . . . 0.89 112.091 -177.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -132.81 174.97 9.75 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.51 0.671 . . . . 0.82 111.087 -176.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.619 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 3.1 p-10 -152.38 -126.99 0.04 OUTLIER 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.555 -1.202 . . . . 1.42 109.135 -173.255 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -126.24 -14.28 5.98 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.185 0.517 . . . . 0.8 110.188 -179.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.475 ' O ' ' HG3' ' A' ' 88' ' ' LYS . . . -92.7 -33.19 7.59 Favored Glycine 0 N--CA 1.438 -1.191 0 N-CA-C 110.157 -1.177 . . . . 0.32 110.157 -179.066 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.612 HG23 ' HB3' ' A' ' 62' ' ' PRO . 0.8 OUTLIER -65.56 -41.0 93.43 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.107 0.48 . . . . 0.95 110.435 176.875 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.439 HG12 ' HB3' ' A' ' 104' ' ' ASP . 79.0 mt -61.79 -47.95 90.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.365 -0.834 . . . . 0.97 109.935 175.074 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -32.28 73.39 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.692 -0.686 . . . . 1.15 111.136 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.475 ' HG3' ' O ' ' A' ' 84' ' ' GLY . 33.4 mttm -59.9 -52.9 63.43 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 120.951 0.405 . . . . 2.46 110.515 178.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -70.47 -30.42 67.23 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.633 -0.712 . . . . 1.16 111.233 -177.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.2 mt -66.14 -56.69 10.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.022 0.439 . . . . 0.49 111.119 178.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -68.42 -28.78 67.38 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.853 -0.612 . . . . 1.39 111.167 -177.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -80.69 -10.92 59.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.524 -0.307 . . . . 1.3 110.873 179.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 60.34 61.87 1.69 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.674 -0.694 . . . . 1.75 110.189 -178.013 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . 0.627 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 31.9 t80 -79.75 -52.73 7.56 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.79 -0.641 . . . . 0.96 111.434 -178.223 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -97.03 -178.71 4.29 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.071 0.462 . . . . 1.28 110.955 -175.32 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 -72.59 -54.08 10.12 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.589 -0.732 . . . . 1.05 111.216 -179.255 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 26.4 t -145.32 -178.82 6.26 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.054 0.454 . . . . 1.0 111.495 -172.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.653 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -76.81 -7.07 54.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.997 -0.547 . . . . 0.66 111.132 -177.028 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -34.86 73.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.323 0.583 . . . . 0.85 109.82 175.183 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.09 -30.79 62.52 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.418 -0.81 . . . . 2.44 110.14 177.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.48 ' HB3' ' SD ' ' A' ' 42' ' ' MET . 0.1 OUTLIER -74.36 -28.56 61.18 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.485 -0.779 . . . . 0.95 111.242 -179.258 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.77 -36.07 73.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.148 0.499 . . . . 1.13 110.326 177.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -70.05 -40.24 75.22 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.572 -0.74 . . . . 2.96 110.417 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . 0.439 ' HB3' HG12 ' A' ' 86' ' ' ILE . 0.3 OUTLIER -70.06 -49.65 49.01 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.015 -0.539 . . . . 1.87 111.05 -176.55 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.578 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -55.66 -45.26 77.72 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.073 -0.512 . . . . 0.38 110.948 -179.496 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -60.56 -45.33 94.29 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.142 -0.481 . . . . 0.97 110.294 177.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 66.4 m -64.4 -37.15 86.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.79 -0.641 . . . . 0.43 111.462 -178.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -34.73 71.08 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.214 -0.448 . . . . 0.88 110.69 177.176 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -79.21 -36.93 39.36 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 116.37 -0.377 . . . . 0.29 110.515 -178.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.0 -37.23 86.96 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.764 0.316 . . . . 0.66 110.611 175.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -43.63 -55.06 4.56 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.271 -0.877 . . . . 1.84 110.925 177.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . 0.49 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 2.1 t -58.76 -47.73 83.66 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.196 -0.911 . . . . 0.63 111.906 -179.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 47.7 m-85 -74.85 -15.92 60.7 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.719 0.637 . . . . 0.81 112.719 -170.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 85.5 mt -91.77 -54.33 7.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.759 0.314 . . . . 0.55 111.271 -179.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.499 ' CE1' ' HA ' ' A' ' 73' ' ' TYR . 41.7 t80 -78.24 -40.35 37.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.78 0.324 . . . . 1.22 111.194 -175.31 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . 0.49 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 72.6 m-20 -86.12 -168.57 2.28 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.376 -0.375 . . . . 1.04 110.481 -177.252 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.26 154.07 43.78 Favored Pre-proline 0 C--N 1.32 -0.693 0 N-CA-C 110.526 -0.176 . . . . 3.47 110.526 -177.466 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -58.61 -25.97 77.08 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.409 2.072 . . . . 0.96 112.276 177.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.79 16.37 25.28 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.124 -0.489 . . . . 1.23 111.325 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.433 ' OD1' HG22 ' A' ' 122' ' ' ILE . 3.8 t70 -76.52 159.72 30.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.47 . . . . 1.34 110.976 -177.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -69.56 -47.88 62.17 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.362 -0.836 . . . . 1.44 110.02 -178.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.433 HG22 ' OD1' ' A' ' 120' ' ' ASP . 2.2 tp -68.28 -30.4 47.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.384 -0.825 . . . . 0.42 110.666 -177.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 1.4 t -71.75 -41.36 70.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.225 -0.443 . . . . 0.35 110.163 177.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.07 -32.24 71.89 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.955 -0.566 . . . . 0.52 110.045 179.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 25.8 mtt -75.39 -39.16 59.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.539 -0.755 . . . . 0.62 110.546 177.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.35 -28.0 66.44 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.201 -0.454 . . . . 0.31 111.837 -178.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.68 -44.79 89.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.849 0.357 . . . . 1.94 111.213 179.286 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -76.72 -36.87 56.88 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.127 0.489 . . . . 0.32 110.433 179.166 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.519 HD21 ' HA ' ' A' ' 56' ' ' ALA . 1.0 OUTLIER -59.39 -43.51 92.92 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.357 -0.838 . . . . 0.33 111.047 179.909 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -65.93 -24.42 66.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.903 -0.589 . . . . 1.47 111.687 -175.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.508 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 19.1 ttmt -64.89 -41.62 95.46 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.768 -0.456 . . . . 2.24 109.768 -178.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.531 HD12 HD23 ' A' ' 50' ' ' LEU . 3.3 mt -69.39 -34.78 64.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.918 -0.583 . . . . 1.23 110.316 178.01 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.443 ' O ' HG23 ' A' ' 137' ' ' VAL . 29.9 t80 -58.35 -61.75 2.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.652 -0.703 . . . . 0.46 110.662 179.273 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 2.0 pp -63.94 -30.02 71.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.923 0.392 . . . . 0.64 110.406 -177.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.508 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.56 -50.73 72.36 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.549 -0.75 . . . . 1.61 111.13 178.894 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . 0.702 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -77.53 -23.29 50.18 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.77 -0.65 . . . . 1.52 111.055 -176.611 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.45 ' HA ' ' HG3' ' A' ' 140' ' ' MET . 46.4 t -78.15 -33.74 18.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.011 -0.54 . . . . 0.35 110.56 -179.476 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.03 -13.35 61.83 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.116 0.484 . . . . 0.5 110.616 179.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -106.71 4.2 27.51 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.681 -0.691 . . . . 1.76 110.869 -179.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . 0.45 ' HG3' ' HA ' ' A' ' 137' ' ' VAL . 0.7 OUTLIER -66.36 143.03 98.09 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.296 -0.411 . . . . 0.86 110.505 176.908 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -63.82 114.13 2.45 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.27 1.98 . . . . 0.67 111.272 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 13.6 mm-40 -79.37 26.29 0.29 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.184 -0.462 . . . . 2.91 111.622 -173.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.06 -40.16 3.0 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 115.936 -0.574 . . . . 2.7 110.763 -178.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . 0.512 ' OE2' ' HB2' ' A' ' 38' ' ' GLN . 0.0 OUTLIER 63.28 93.8 0.05 Allowed 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.063 -0.972 . . . . 2.34 110.313 -174.696 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 1.5 t -112.89 116.83 53.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 CA-C-N 115.522 -0.763 . . . . 0.99 109.961 -178.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.643 ' HG3' HG22 ' A' ' 36' ' ' THR . 7.5 tt0 -64.8 133.14 51.37 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.693 0.283 . . . . 1.53 110.392 178.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 14.9 mt . . . . . 0 C--O 1.246 0.897 0 CA-C-O 118.697 -0.668 . . . . 1.57 110.372 -177.808 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.627 0 N-CA-C 111.828 -0.509 . . . . 2.17 111.828 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 312' ' ' ALY . . . . . 0.435 ' HCA' ' OH ' ' B' ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 155.21 -47.17 0.52 Allowed Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.494 -0.86 . . . . 1.97 112.736 179.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -151.81 136.11 16.75 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 122.523 -0.398 . . . . 3.58 111.177 -178.436 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 315' ' ' ALY . . . . . 0.435 ' OH ' ' HCA' ' B' ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 316' ' ' LYS . . . . . 0.429 ' HA ' ' HD2' ' B' ' 316' ' ' LYS . 11.1 tptp . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.487 -0.768 . . . . 4.6 110.23 -177.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo . . . . . 0 N--CA 1.476 0.499 0 N-CA-C 111.002 -0.422 . . . . 6.18 111.002 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.1 tp -96.61 115.02 26.74 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.509 -0.552 . . . . 5.71 109.509 177.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 87.49 43.91 5.7 Favored Glycine 0 N--CA 1.449 -0.456 0 N-CA-C 110.959 -0.857 . . . . 3.45 110.959 -173.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 8.5 p -75.2 146.98 40.78 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.239 -0.481 . . . . 2.44 111.768 -176.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 25.3 pt-20 -123.46 155.96 36.46 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.978 -0.555 . . . . 1.64 110.051 176.542 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.2 p -128.28 -0.98 3.43 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.027 0 CA-C-O 122.058 0.932 . . . . 0.93 108.57 174.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.2 m -149.17 141.35 23.99 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 114.159 -1.382 . . . . 1.61 108.192 176.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -145.11 136.67 12.77 Favored Pre-proline 0 C--N 1.315 -0.929 0 C-N-CA 121.112 -0.235 . . . . 1.6 110.579 -177.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -65.76 -48.13 3.27 Favored 'Trans proline' 0 N--CA 1.473 0.278 0 C-N-CA 123.061 2.507 . . . . 1.87 112.955 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.467 ' O ' ' HD3' ' A' ' 32' ' ' PRO . 5.4 m -75.74 -19.31 59.14 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.082 -0.508 . . . . 2.18 110.872 -176.175 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.468 ' HE3' ' CZ ' ' A' ' 94' ' ' TYR . 0.0 OUTLIER -102.33 100.63 16.14 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.55 -0.75 . . . . 2.75 110.598 178.409 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.467 ' HD3' ' O ' ' A' ' 30' ' ' SER . 15.2 Cg_exo -66.63 152.57 80.41 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.096 1.864 . . . . 1.38 111.564 178.675 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -136.02 88.78 0.23 Allowed Glycine 0 N--CA 1.444 -0.778 0 N-CA-C 111.662 -0.575 . . . . 0.97 111.662 -177.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.463 ' HG3' ' CZ2' ' A' ' 96' ' ' TRP . 7.3 mtm180 -91.87 148.81 21.94 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.723 -0.473 . . . . 1.93 109.723 178.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.0 120.62 32.14 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.395 -0.366 . . . . 2.64 110.103 -178.157 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.626 HG22 ' HG3' ' A' ' 146' ' ' GLU . 1.0 OUTLIER -111.36 160.58 16.92 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.827 -0.349 . . . . 0.68 110.722 177.89 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.489 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 8.1 t30 -60.69 -37.84 82.99 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-N 115.879 -0.6 . . . . 1.47 110.113 178.292 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.417 ' O ' ' HB3' ' A' ' 41' ' ' TYR . 23.4 tt0 -64.18 -42.37 96.71 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.303 -0.408 . . . . 1.04 110.433 178.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.785 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.4 OUTLIER -63.32 -52.01 63.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.216 -0.447 . . . . 0.8 110.549 179.027 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.422 ' O ' ' HG3' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -67.5 -22.98 65.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.288 0.566 . . . . 1.75 110.789 -179.541 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.489 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 62.3 t80 -64.45 -59.73 3.99 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 115.523 -0.762 . . . . 0.64 110.769 176.624 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.556 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -58.99 -34.39 71.79 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.573 -0.285 . . . . 1.13 111.749 -172.587 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.562 ' HA ' ' CG1' ' A' ' 47' ' ' VAL . 0.0 OUTLIER -65.68 -45.21 83.72 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.426 -0.509 . . . . 1.3 110.851 -177.521 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 -85.68 -34.24 21.34 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.085 -0.507 . . . . 0.5 111.795 -177.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 85.6 t -88.73 -57.81 3.96 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 112.332 0.493 . . . . 0.3 112.332 -175.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.664 HG22 ' HB3' ' A' ' 136' ' ' LYS . 42.4 t -79.63 -66.63 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 111.855 0.317 . . . . 0.26 111.855 -170.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.562 ' CG1' ' HA ' ' A' ' 43' ' ' GLN . 0.8 OUTLIER -68.94 -35.97 71.75 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.314 0 C-N-CA 120.677 -0.409 . . . . 0.83 111.624 -173.728 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.46 -38.64 87.95 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.678 -0.409 . . . . 2.4 111.376 179.066 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.2 m -73.64 -36.37 65.39 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 121.083 -0.247 . . . . 0.55 110.824 178.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.626 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -66.24 -39.63 89.65 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 109.588 -0.523 . . . . 0.33 109.588 174.991 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 11.6 t-105 -58.04 -36.38 72.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.641 -0.709 . . . . 0.39 110.98 177.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -84.78 10.59 11.04 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.198 0.444 . . . . 2.24 112.198 -175.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 19.1 t-80 -83.12 139.06 33.42 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.842 0.353 . . . . 0.39 110.465 177.15 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 10.9 mm-40 -72.26 1.79 7.11 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.005 -0.543 . . . . 1.91 112.308 -175.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -118.83 -7.84 10.4 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.771 0.32 . . . . 0.93 110.918 178.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.662 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -92.6 6.43 47.34 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.955 0.407 . . . . 0.28 111.217 -176.089 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.55 ' HA ' ' CZ ' ' A' ' 60' ' ' TYR . 40.4 p-90 -62.97 -35.14 16.38 Favored Pre-proline 0 CA--C 1.548 0.867 0 N-CA-C 114.099 1.148 . . . . 0.58 114.099 -174.397 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.51 ' HD3' ' CG ' ' A' ' 57' ' ' TRP . 15.3 Cg_exo -71.19 -17.9 30.93 Favored 'Trans proline' 0 C--N 1.357 0.987 0 CA-C-N 121.095 1.427 . . . . 0.47 112.435 177.478 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -85.36 -4.53 59.19 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.196 -0.456 . . . . 1.11 111.257 -175.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.55 ' CZ ' ' HA ' ' A' ' 57' ' ' TRP . 17.6 m-30 -60.54 -38.08 83.29 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.304 0.573 . . . . 0.63 110.883 -178.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -97.45 132.8 24.63 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-N 115.41 -0.814 . . . . 1.63 110.615 -177.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.73 145.09 25.42 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.334 2.023 . . . . 0.87 112.083 178.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.454 HG11 ' CD1' ' A' ' 73' ' ' TYR . 4.4 t -69.59 110.11 2.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-O 121.727 0.775 . . . . 0.88 110.794 177.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.406 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.5 OUTLIER -110.23 -0.74 17.67 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.897 -1.047 . . . . 1.85 109.559 179.474 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.406 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 74.69 -64.19 0.39 Allowed 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 114.627 -1.169 . . . . 1.29 111.055 -175.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 12.9 mt -68.56 -48.84 70.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 120.788 0.328 . . . . 1.89 111.115 -176.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 38.2 tttp -50.46 -51.92 42.67 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.73 -0.668 . . . . 2.99 112.331 -177.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.629 ' HB3' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -105.1 7.24 33.76 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.496 -0.32 . . . . 1.66 111.573 -171.958 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . 0.433 ' O ' HD13 ' A' ' 70' ' ' LEU . 17.7 t-20 59.11 67.28 0.93 Allowed 'General case' 0 N--CA 1.467 0.418 0 O-C-N 123.731 0.644 . . . . 1.74 111.207 -178.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.7 HD21 ' HG2' ' B' ' 312' ' ' ALY . 0.1 OUTLIER -128.06 66.94 73.44 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.349 -0.841 . . . . 1.61 110.798 -179.699 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -67.96 -34.93 21.97 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 121.909 1.739 . . . . 1.3 111.972 -179.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -72.0 -30.8 65.6 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.98 -0.554 . . . . 1.97 110.678 -178.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.454 ' CD1' HG11 ' A' ' 63' ' ' VAL . 2.8 t80 -59.67 -45.9 90.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.65 -0.705 . . . . 1.13 110.577 -178.478 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -75.73 -7.8 55.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.128 -0.487 . . . . 0.91 110.977 -177.144 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt -95.72 -44.6 7.37 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 116.082 -0.508 . . . . 2.86 110.004 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.6 mt -82.78 -50.31 15.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.859 -0.609 . . . . 1.0 111.026 -178.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 43.7 mm -83.1 138.08 19.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 116.438 -0.346 . . . . 0.75 110.339 -177.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.62 -47.43 12.09 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.205 -0.452 . . . . 1.99 110.936 -179.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -115.22 96.43 45.44 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 116.476 -0.329 . . . . 2.05 110.822 -179.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -73.38 99.01 1.07 Allowed 'Trans proline' 0 CA--C 1.529 0.271 0 C-N-CA 122.381 2.054 . . . . 0.89 112.516 178.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -135.24 145.76 47.94 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 116.056 -0.52 . . . . 0.82 110.085 -178.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.454 ' O ' HD13 ' A' ' 86' ' ' ILE . 5.4 m-20 -145.35 -153.93 0.51 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 114.862 -1.063 . . . . 1.42 108.297 -172.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.53 -18.72 21.94 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.065 -0.717 . . . . 0.8 109.065 -172.55 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -80.37 -25.07 57.86 Favored Glycine 0 N--CA 1.44 -1.084 0 N-CA-C 109.539 -1.424 . . . . 0.32 109.539 175.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -84.47 -41.28 16.75 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 114.705 -0.747 . . . . 0.95 111.486 178.385 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.486 ' CD1' ' HB3' ' A' ' 104' ' ' ASP . 0.2 OUTLIER -56.41 -47.42 81.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 CA-C-O 121.163 0.506 . . . . 0.97 109.727 178.398 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.6 ptmt -66.15 -27.54 68.1 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.765 -0.652 . . . . 1.15 111.506 -179.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 1.9 tttt -67.92 -43.02 80.15 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 120.935 0.398 . . . . 2.46 110.795 -179.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.543 ' HD3' ' OD2' ' A' ' 104' ' ' ASP . 1.6 mtt180 -69.84 -32.0 70.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.309 -0.405 . . . . 1.16 110.558 178.578 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.418 ' HG ' ' SG ' ' A' ' 101' ' ' CYS . 7.7 mt -67.71 -54.41 19.6 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.656 -0.702 . . . . 0.49 111.22 178.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 25.0 pt-20 -64.92 -26.74 68.44 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.119 -0.491 . . . . 1.39 111.313 -175.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -95.29 10.67 35.31 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.081 -0.509 . . . . 1.3 111.276 -178.098 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.3 p30 37.25 54.9 1.33 Allowed 'General case' 0 N--CA 1.475 0.825 0 O-C-N 124.169 0.918 . . . . 1.75 111.711 -177.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . 0.468 ' CZ ' ' HE3' ' A' ' 31' ' ' LYS . 29.8 t80 -66.06 -73.5 0.13 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.057 -0.974 . . . . 0.96 112.06 -175.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -94.87 39.44 1.1 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.518 -0.765 . . . . 1.28 112.582 -172.651 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . 0.463 ' CZ3' ' HB2' ' A' ' 32' ' ' PRO . 1.2 t-105 71.25 -66.07 0.31 Allowed 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.24 0.83 . . . . 1.05 113.24 169.012 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -125.15 161.26 27.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.114 0.483 . . . . 1.0 111.912 -168.143 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.785 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -73.4 -12.71 60.91 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.973 -0.558 . . . . 0.66 111.071 -179.665 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 20.0 m -64.05 -26.32 68.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.293 0.568 . . . . 0.85 109.791 175.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -82.47 -26.68 32.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.522 -0.763 . . . . 2.44 110.35 176.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.418 ' SG ' ' HG ' ' A' ' 90' ' ' LEU . 0.5 OUTLIER -74.64 -23.08 58.63 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.539 -0.755 . . . . 0.95 110.62 179.475 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 6.5 ttm -60.94 -31.65 71.19 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.053 -0.521 . . . . 1.13 110.134 176.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -72.4 -38.16 68.49 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.696 -0.683 . . . . 2.96 110.252 178.18 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . 0.543 ' OD2' ' HD3' ' A' ' 89' ' ' ARG . 1.5 m-20 -67.3 -50.41 60.37 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.994 -0.548 . . . . 1.87 110.502 -178.405 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.626 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.3 OUTLIER -55.75 -43.92 77.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.692 -0.685 . . . . 0.38 110.272 177.479 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -60.41 -49.87 75.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.615 -0.72 . . . . 0.97 110.361 178.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 71.3 m -55.37 -51.14 67.76 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 123.584 0.552 . . . . 0.43 111.259 179.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 2.3 ttp -53.42 -40.88 65.5 Favored 'General case' 0 C--O 1.233 0.216 0 O-C-N 123.326 0.391 . . . . 0.88 111.151 178.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -67.8 -43.58 79.33 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.485 -0.325 . . . . 0.29 110.971 -178.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.37 -43.71 98.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.738 0.304 . . . . 0.66 110.888 177.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . 0.416 ' HB3' ' OH ' ' A' ' 73' ' ' TYR . 7.1 m-20 -47.24 -48.86 24.28 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.455 -0.793 . . . . 1.84 111.335 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 14.0 t -57.24 -42.46 81.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.724 -0.671 . . . . 0.63 111.518 179.124 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -80.44 -21.06 42.52 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.857 0.36 . . . . 0.81 111.833 -173.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 55.5 mt -87.01 -50.86 13.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.935 0.398 . . . . 0.55 110.75 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 48.3 t80 -73.43 -42.83 61.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.054 -0.521 . . . . 1.22 110.739 -177.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . 0.414 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 67.0 m-80 -100.01 161.5 13.57 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.233 -0.439 . . . . 1.04 110.728 -174.541 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 3.1 mmtt -82.83 147.95 56.22 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.95 -0.568 . . . . 3.47 109.844 178.007 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . 0.919 ' HA ' HG11 ' A' ' 123' ' ' VAL . 24.2 Cg_endo -62.26 -12.98 29.63 Favored 'Trans proline' 0 N--CA 1.473 0.271 0 C-N-CA 122.786 2.324 . . . . 0.96 112.386 178.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -102.41 9.35 39.77 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.82 -0.627 . . . . 1.23 111.338 179.686 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -85.92 164.0 17.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.081 0.467 . . . . 1.34 111.062 -177.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.76 -45.41 94.01 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.234 -0.894 . . . . 1.44 110.943 -177.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -69.33 -34.85 64.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.176 -0.92 . . . . 0.42 111.487 -174.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.919 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.3 t -71.32 -35.04 56.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.881 0.372 . . . . 0.35 110.088 179.507 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.87 -32.06 65.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.5 0.667 . . . . 0.52 109.646 177.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . 0.487 ' O ' HD13 ' A' ' 129' ' ' LEU . 8.7 mtt -80.13 -43.95 20.78 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 114.992 -1.004 . . . . 0.62 110.787 179.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.86 -35.16 63.72 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.246 -0.434 . . . . 0.31 111.885 -177.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.63 -41.98 98.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.403 -0.362 . . . . 1.94 111.386 -179.542 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -78.06 -36.56 48.2 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.174 0.512 . . . . 0.32 110.466 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.662 HD21 ' HA ' ' A' ' 56' ' ' ALA . 4.0 mp -60.8 -42.06 96.86 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.445 -0.798 . . . . 0.33 111.042 -179.333 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -61.13 -28.63 69.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.883 -0.599 . . . . 1.47 111.967 -175.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.491 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 7.0 mttm -64.53 -34.35 78.03 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.839 0.352 . . . . 2.24 110.441 -177.119 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 13.9 mt -75.54 -31.0 22.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.036 -0.529 . . . . 1.23 110.67 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.505 ' O ' HG23 ' A' ' 137' ' ' VAL . 29.4 t80 -58.66 -62.33 1.95 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.009 -0.541 . . . . 0.46 110.691 -179.426 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.28 -28.24 69.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.104 0.478 . . . . 0.64 110.488 -179.364 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.491 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.36 -39.8 88.48 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.469 -0.787 . . . . 1.61 111.481 179.231 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . 0.664 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -90.76 -26.56 19.43 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.895 0.378 . . . . 1.52 110.745 -178.677 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 133' ' ' PHE . 55.8 t -67.8 -32.03 54.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.1 -0.5 . . . . 0.35 110.23 177.403 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -64.96 -18.69 65.48 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.029 -0.532 . . . . 0.5 110.849 179.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.3 mm100 -103.58 -0.28 29.91 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.599 -0.728 . . . . 1.76 110.958 -178.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . 0.472 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 0.4 OUTLIER -66.43 142.32 97.65 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.155 -0.475 . . . . 0.86 111.371 -179.432 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -74.77 101.7 1.49 Allowed 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.472 2.114 . . . . 0.67 111.895 179.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 76.5 mm-40 -70.05 -2.24 12.21 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 112.192 0.441 . . . . 2.91 112.192 -175.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -81.83 -38.42 25.52 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.881 0.372 . . . . 2.7 110.384 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 67.09 86.33 0.13 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.842 -1.072 . . . . 2.34 110.347 -178.685 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 1.2 t -96.25 120.19 45.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.564 -0.744 . . . . 0.99 109.618 178.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.626 ' HG3' HG22 ' A' ' 36' ' ' THR . 0.4 OUTLIER -73.15 146.02 45.95 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.752 0.311 . . . . 1.53 110.625 179.972 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 69.1 mt . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.555 -0.736 . . . . 1.57 110.371 -177.432 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.676 0 N-CA-C 111.847 -0.501 . . . . 2.17 111.847 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 312' ' ' ALY . . . . . 0.7 ' HG2' HD21 ' A' ' 70' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 148.09 92.67 0.11 Allowed Glycine 0 N--CA 1.447 -0.62 0 CA-C-N 115.572 -0.74 . . . . 1.97 111.592 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 66.3 115.68 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.35 0.66 . . . . 3.58 111.554 -176.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 315' ' ' ALY . . . . . 0.461 HH31 ' HB3' ' A' ' 58' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.108 0 CA-C-O 117.965 -1.017 . . . . 4.6 109.659 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo . . . . . 0 N--CA 1.479 0.623 0 N-CA-C 110.023 -0.799 . . . . 6.18 110.023 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -117.27 123.13 45.83 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.722 0.296 . . . . 5.71 110.337 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 91.39 -50.21 2.98 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.782 -0.723 . . . . 3.45 113.062 175.256 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 87.5 p -105.19 135.9 45.7 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.209 0.528 . . . . 2.44 112.075 -177.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.601 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 8.8 mt-10 -65.01 137.37 57.68 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.343 -0.844 . . . . 1.64 111.151 172.514 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.536 HG21 ' HG2' ' A' ' 88' ' ' LYS . 2.3 p -119.52 -8.61 11.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.449 0.642 . . . . 0.93 110.059 173.012 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -148.92 132.68 16.95 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 115.645 -0.707 . . . . 1.61 110.027 177.21 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -140.77 131.01 13.39 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 116.366 -0.379 . . . . 1.6 110.319 178.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -67.35 -47.33 2.26 Favored 'Trans proline' 0 CA--C 1.53 0.316 0 C-N-CA 123.093 2.529 . . . . 1.87 113.093 -179.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 3.1 m -80.54 -22.48 40.79 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 116.083 -0.508 . . . . 2.18 111.331 -174.062 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.461 ' HA ' ' HD3' ' A' ' 32' ' ' PRO . 17.5 tttm -77.85 127.27 82.48 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 115.932 -0.577 . . . . 2.75 110.941 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 31' ' ' LYS . 3.8 Cg_exo -72.36 151.42 53.98 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.386 2.058 . . . . 1.38 111.952 177.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -151.84 113.36 0.58 Allowed Glycine 0 N--CA 1.443 -0.856 0 N-CA-C 110.681 -0.967 . . . . 0.97 110.681 179.674 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.6 mtm180 -124.7 159.74 30.16 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 110.099 -0.334 . . . . 1.93 110.099 -175.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.506 ' HA ' HD22 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -99.2 84.2 2.99 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.118 0.485 . . . . 2.64 110.99 179.284 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.489 ' HA ' ' HA ' ' A' ' 146' ' ' GLU . 5.4 p -94.46 176.6 6.23 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 120.927 0.394 . . . . 0.68 111.401 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.575 ' HA ' HD11 ' A' ' 147' ' ' LEU . 37.9 t30 -63.31 -54.92 29.55 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.613 -0.721 . . . . 1.47 110.679 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -56.74 -39.85 74.7 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.771 0.319 . . . . 1.04 111.105 -178.035 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.506 HD22 ' HA ' ' A' ' 35' ' ' LYS . 0.9 OUTLIER -60.53 -58.99 6.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.057 -0.52 . . . . 0.8 111.282 -179.767 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 9.4 mt-30 -69.54 -26.02 64.3 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.962 -0.563 . . . . 1.75 110.721 -177.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.406 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 47.8 t80 -60.85 -62.95 1.48 Allowed 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.739 -0.664 . . . . 0.64 110.669 177.164 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.554 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -61.06 -30.41 70.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.726 0.298 . . . . 1.13 110.529 -173.912 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.472 ' HB2' HD22 ' A' ' 90' ' ' LEU . 7.7 tt0 -59.14 -56.24 24.72 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.866 -0.606 . . . . 1.3 110.836 178.351 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 -86.4 -30.42 22.14 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.99 0.424 . . . . 0.5 111.927 -176.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 91.7 t -88.48 -57.6 4.12 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 N-CA-C 112.423 0.527 . . . . 0.3 112.423 -174.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.569 HG22 ' HB3' ' A' ' 136' ' ' LYS . 50.1 t -80.46 -66.51 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 C-N-CA 120.716 -0.394 . . . . 0.26 111.712 -170.015 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.472 HG12 ' O ' ' A' ' 42' ' ' MET . 1.5 p -70.67 -34.11 55.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 C-N-CA 120.581 -0.448 . . . . 0.83 111.437 -173.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.4 ' O ' ' HE3' ' A' ' 52' ' ' LYS . 0.0 OUTLIER -65.02 -34.79 79.27 Favored 'General case' 0 C--N 1.329 -0.29 0 O-C-N 122.195 -0.316 . . . . 2.4 111.578 179.345 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.0 m -77.5 -39.1 47.46 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.909 -0.316 . . . . 0.55 110.54 177.086 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.591 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -60.53 -38.05 83.19 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 121.246 0.546 . . . . 0.33 109.875 175.663 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 17.6 t-105 -60.76 -28.73 68.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.461 -0.79 . . . . 0.39 111.499 178.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.4 ' HE3' ' O ' ' A' ' 48' ' ' LYS . 4.7 mtmt -92.72 18.79 8.28 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 112.014 0.375 . . . . 2.24 112.014 -174.177 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.425 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 23.3 t-80 -89.48 139.12 30.85 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.963 -0.384 . . . . 0.39 109.963 175.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 3.4 mm-40 -70.76 -8.88 55.52 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.323 -0.399 . . . . 1.91 112.023 -175.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.425 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 1.8 m-30 -107.53 -1.49 21.27 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.96 0.409 . . . . 0.93 110.47 177.762 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.586 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -92.25 2.29 56.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.271 0.558 . . . . 0.28 110.972 -177.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.461 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 54.0 p-90 -63.87 -33.22 9.23 Favored Pre-proline 0 CA--C 1.547 0.855 0 N-CA-C 114.489 1.292 . . . . 0.58 114.489 -173.683 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.461 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 6.6 Cg_exo -74.59 -5.1 16.42 Favored 'Trans proline' 0 C--N 1.36 1.179 0 CA-C-N 121.296 1.499 . . . . 0.47 112.49 178.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -100.9 3.13 41.55 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.875 0.369 . . . . 1.11 110.269 -177.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.416 ' CZ ' ' HA ' ' A' ' 57' ' ' TRP . 16.0 m-30 -71.83 -26.15 62.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.048 -0.524 . . . . 0.63 111.159 -178.484 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.408 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 0.0 OUTLIER -110.52 123.91 34.52 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.098 -0.501 . . . . 1.63 110.896 -174.617 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.535 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 39.1 Cg_exo -60.41 159.62 26.66 Favored 'Trans proline' 0 C--O 1.237 0.45 0 C-N-CA 122.968 2.445 . . . . 0.87 113.166 179.395 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.514 HG11 ' CD2' ' A' ' 73' ' ' TYR . 2.7 t -100.77 105.14 17.23 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 CA-C-O 121.705 0.764 . . . . 0.88 109.103 -178.575 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -114.12 2.9 15.05 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.919 -1.037 . . . . 1.85 110.885 -176.211 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 73.02 -9.03 1.18 Allowed 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 115.195 -0.911 . . . . 1.29 112.812 175.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 21.5 mm -113.96 -55.39 4.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.019 0.438 . . . . 1.89 110.666 -175.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.68 -40.3 88.51 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.756 -0.656 . . . . 2.99 110.611 -177.548 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -89.61 -5.08 57.49 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.91 -0.586 . . . . 1.66 110.564 178.221 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 58.9 t30 53.21 68.11 0.89 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.774 -0.648 . . . . 1.74 110.507 -174.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -130.04 65.59 75.75 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 115.603 -0.726 . . . . 1.61 110.667 -177.067 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -70.5 -30.36 18.95 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.166 1.91 . . . . 1.3 112.414 -177.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -82.23 -9.14 59.6 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.043 -0.526 . . . . 1.97 110.951 -177.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.514 ' CD2' HG11 ' A' ' 63' ' ' VAL . 11.9 t80 -63.55 -42.27 98.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.144 -0.48 . . . . 1.13 110.468 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 5.1 m-70 -71.39 -7.82 49.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.0 -0.545 . . . . 0.91 111.637 -176.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 52.9 mmtt -92.5 -28.88 16.52 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.107 0.48 . . . . 2.86 110.095 -177.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.6 mt -101.72 -42.37 9.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.416 0.627 . . . . 1.0 110.184 178.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 47.8 mm -105.17 117.49 50.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 115.76 -0.655 . . . . 0.75 110.014 -179.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.66 -15.68 34.31 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.289 -0.414 . . . . 1.99 110.697 -176.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -120.36 84.45 35.14 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.921 -0.582 . . . . 2.05 109.896 177.333 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -70.7 91.24 0.61 Allowed 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.604 2.203 . . . . 0.89 112.318 -176.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 1.6 mmt -129.39 162.51 27.87 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.03 -0.532 . . . . 0.82 110.436 -178.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.535 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 8.4 p-10 -146.92 -126.01 0.06 Allowed 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 114.79 -1.096 . . . . 1.42 109.082 -173.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -120.0 -22.01 6.87 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.139 0.495 . . . . 0.8 110.15 -178.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -84.64 -24.89 44.37 Favored Glycine 0 N--CA 1.442 -0.931 0 N-CA-C 110.759 -0.937 . . . . 0.32 110.759 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -73.68 -38.56 64.86 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 121.104 0.478 . . . . 0.95 110.252 177.371 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.581 HG23 ' SG ' ' A' ' 101' ' ' CYS . 75.9 mt -60.17 -49.27 84.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.404 -0.816 . . . . 0.97 110.046 175.255 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.89 -27.45 66.67 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.562 -0.745 . . . . 1.15 111.303 -178.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.536 ' HG2' HG21 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -62.48 -44.63 95.93 Favored 'General case' 0 N--CA 1.456 -0.128 0 CA-C-O 120.521 0.2 . . . . 2.46 111.301 -178.837 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 24.0 mtp180 -75.97 -29.03 58.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.638 0.256 . . . . 1.16 110.698 -179.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.584 ' HG ' ' OH ' ' A' ' 95' ' ' TYR . 3.9 mt -63.67 -55.52 22.83 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.945 -0.57 . . . . 0.49 110.91 178.429 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -72.05 -22.53 61.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.229 -0.441 . . . . 1.39 111.249 -176.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.408 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 4.9 m-80 -83.72 -9.04 59.11 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.491 -0.322 . . . . 1.3 110.558 178.183 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 56.71 53.8 7.96 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.604 0.716 . . . . 1.75 110.142 -178.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . 0.601 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 61.7 t80 -81.35 -16.27 52.83 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.329 -0.85 . . . . 0.96 111.411 -175.503 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.584 ' OH ' ' HG ' ' A' ' 90' ' ' LEU . 0.2 OUTLIER -129.18 174.22 9.77 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.042 0.449 . . . . 1.28 110.936 -179.455 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 1.9 t-105 -73.64 -50.47 20.87 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.178 -0.919 . . . . 1.05 110.671 -178.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 29.1 t -143.55 176.74 8.97 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.033 -0.531 . . . . 1.0 110.228 -175.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.466 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -75.82 -7.35 54.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.475 -0.33 . . . . 0.66 111.741 -173.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.74 -32.23 71.52 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.937 0.398 . . . . 0.85 110.795 -179.515 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -73.26 -32.03 64.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.844 -0.617 . . . . 2.44 110.522 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.625 ' HA ' ' OD2' ' A' ' 104' ' ' ASP . 0.5 OUTLIER -75.44 -20.65 58.73 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.737 -0.665 . . . . 0.95 111.539 -175.94 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.38 -27.39 62.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.006 0.432 . . . . 1.13 110.182 176.555 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -71.9 -40.52 68.8 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.851 -0.613 . . . . 2.96 110.511 177.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . 0.625 ' OD2' ' HA ' ' A' ' 101' ' ' CYS . 5.3 m-20 -66.47 -48.21 70.62 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.977 -0.556 . . . . 1.87 110.404 -179.565 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.591 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.4 OUTLIER -56.82 -42.88 80.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.873 -0.603 . . . . 0.38 110.558 179.617 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -58.69 -50.47 73.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.169 -0.468 . . . . 0.97 110.054 175.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 30.9 m -57.88 -49.09 77.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.128 -0.487 . . . . 0.43 111.315 -179.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.31 -38.05 57.43 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.878 0.471 . . . . 0.88 111.927 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -77.87 -49.12 14.88 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.972 0.415 . . . . 0.29 110.167 -175.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.81 -36.39 80.98 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.937 -0.574 . . . . 0.66 111.61 178.044 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -49.31 -52.83 25.28 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.013 0.435 . . . . 1.84 111.201 178.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . 0.43 ' SG ' ' HA ' ' A' ' 123' ' ' VAL . 1.0 OUTLIER -63.95 -41.71 97.52 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.536 -0.756 . . . . 0.63 110.998 -178.753 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -63.28 -37.92 89.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.399 -0.364 . . . . 0.81 111.411 -177.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 55.8 mt -80.04 -48.96 19.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.451 -0.341 . . . . 0.55 111.887 -176.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 92.2 t80 -69.8 -26.63 64.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.75 0.31 . . . . 1.22 111.55 -174.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -111.46 175.8 5.28 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.15 0.5 . . . . 1.04 111.375 -173.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -97.06 152.04 38.08 Favored Pre-proline 0 C--N 1.322 -0.625 0 CA-C-N 115.543 -0.753 . . . . 3.47 110.298 -177.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . 0.464 ' HA ' HG11 ' A' ' 123' ' ' VAL . 18.5 Cg_endo -60.18 -21.69 67.17 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.798 2.332 . . . . 0.96 112.697 179.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.52 18.39 16.76 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.131 -0.486 . . . . 1.23 111.347 -179.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.492 ' OD2' ' HA2' ' B' ' 313' ' ' GLY . 2.8 t0 -96.7 155.71 16.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.236 -0.438 . . . . 1.34 110.361 178.648 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -71.7 -41.05 69.07 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.792 -0.64 . . . . 1.44 110.703 -175.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.2 tp -62.65 -34.02 62.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.99 -0.55 . . . . 0.42 110.853 -178.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.464 HG11 ' HA ' ' A' ' 118' ' ' PRO . 0.9 OUTLIER -68.99 -41.71 81.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.113 0.483 . . . . 0.35 109.861 177.102 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.37 -34.83 79.07 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.646 -0.707 . . . . 0.52 109.819 -179.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . 0.562 ' O ' HD13 ' A' ' 129' ' ' LEU . 14.5 mtt -69.0 -47.09 66.37 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 115.257 -0.883 . . . . 0.62 110.677 179.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -54.59 -39.43 67.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.239 -0.437 . . . . 0.31 111.394 -179.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.76 -36.74 83.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.14 -0.482 . . . . 1.94 111.386 -178.42 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -74.95 -37.15 62.04 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.198 0.523 . . . . 0.32 110.319 178.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.586 HD21 ' HA ' ' A' ' 56' ' ' ALA . 7.6 mp -61.05 -39.85 91.4 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.264 -0.88 . . . . 0.33 110.323 178.085 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -55.0 -32.75 62.03 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.574 -0.739 . . . . 1.47 112.071 -176.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.616 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.2 OUTLIER -62.59 -38.8 91.55 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 120.692 0.282 . . . . 2.24 110.676 -175.389 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 25.0 mt -72.2 -34.19 48.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.17 -0.468 . . . . 1.23 110.5 179.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.556 ' O ' HG23 ' A' ' 137' ' ' VAL . 30.7 t80 -60.52 -62.72 1.66 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.947 -0.57 . . . . 0.46 110.845 -178.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.428 ' HG ' ' H ' ' A' ' 134' ' ' LEU . 0.3 OUTLIER -64.8 -28.41 69.55 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 120.917 0.389 . . . . 0.64 110.612 -177.022 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.616 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -58.9 -57.53 12.64 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.611 -0.722 . . . . 1.61 110.777 176.626 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . 0.569 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -71.15 -26.48 63.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.786 -0.643 . . . . 1.52 111.081 -176.552 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' ' 133' ' ' PHE . 75.8 t -68.93 -31.87 52.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 120.936 0.398 . . . . 0.35 110.245 177.003 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -70.52 -12.5 61.61 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.111 0.482 . . . . 0.5 110.718 177.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -104.26 -1.36 27.17 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.877 -0.601 . . . . 1.76 110.333 179.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . 0.475 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 0.5 OUTLIER -68.29 144.94 97.15 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 115.907 -0.588 . . . . 0.86 111.193 -178.193 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.419 ' C ' ' H ' ' A' ' 143' ' ' GLU . 58.5 Cg_endo -73.95 91.14 0.93 Allowed 'Trans proline' 0 N--CA 1.459 -0.508 0 C-N-CA 122.4 2.067 . . . . 0.67 111.436 177.002 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 4.1 tp60 -78.98 26.4 0.25 Allowed 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.633 0.73 . . . . 2.91 111.875 -176.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.419 ' H ' ' C ' ' A' ' 141' ' ' PRO . 4.5 mp0 -114.13 -43.13 3.26 Favored 'General case' 0 N--CA 1.434 -1.243 0 CA-C-N 115.14 -0.937 . . . . 2.7 108.49 174.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 72.35 137.99 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 114.667 -1.151 . . . . 2.34 112.37 171.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -155.58 150.63 10.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 114.845 -1.07 . . . . 0.99 108.5 177.683 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.489 ' HA ' ' HA ' ' A' ' 36' ' ' THR . 0.9 OUTLIER -81.74 148.31 29.0 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 119.793 -0.763 . . . . 1.53 109.602 174.387 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.575 HD11 ' HA ' ' A' ' 37' ' ' ASN . 14.1 mt . . . . . 0 C--O 1.247 0.923 0 CA-C-O 118.581 -0.723 . . . . 1.57 110.906 -178.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.791 0 N-CA-C 111.354 -0.698 . . . . 2.17 111.354 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 313' ' ' GLY . . . . . 0.492 ' HA2' ' OD2' ' A' ' 120' ' ' ASP . . . 102.1 82.87 1.68 Allowed Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.846 -0.692 . . . . 1.97 111.499 -176.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 73.47 123.37 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.604 0.762 . . . . 3.58 110.371 -175.072 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 2.8 tptt . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.277 -0.868 . . . . 4.6 109.89 178.695 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo . . . . . 0 N--CA 1.478 0.603 0 N-CA-C 109.926 -0.836 . . . . 6.18 109.926 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.495 ' O ' ' HG ' ' A' ' 22' ' ' LEU . 0.1 OUTLIER -148.58 135.57 20.03 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 110.023 -0.362 . . . . 5.71 110.023 176.188 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.36 -71.92 2.41 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.976 -0.631 . . . . 3.45 112.216 -179.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 10.4 p -122.5 140.21 53.02 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 110.247 -0.279 . . . . 2.44 110.247 178.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.719 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 7.3 mt-10 -61.32 134.75 57.29 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.184 0.516 . . . . 1.64 111.926 178.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.523 HG21 ' HG3' ' A' ' 88' ' ' LYS . 8.1 p -114.53 -12.83 11.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 115.405 -0.816 . . . . 0.93 109.596 174.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.491 ' HB3' ' ND2' ' A' ' 92' ' ' ASN . 66.9 p -163.7 141.8 7.57 Favored 'General case' 0 N--CA 1.439 -0.993 0 CA-C-N 114.893 -1.049 . . . . 1.61 109.21 179.179 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.459 ' HB3' ' CB ' ' A' ' 31' ' ' LYS . 39.1 t-20 -148.05 124.77 5.49 Favored Pre-proline 0 C--N 1.316 -0.86 0 CA-C-N 116.261 -0.427 . . . . 1.6 110.099 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -68.19 -40.13 9.19 Favored 'Trans proline' 0 N--CA 1.472 0.244 0 C-N-CA 123.093 2.529 . . . . 1.87 112.685 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.6 m -77.46 -22.68 51.0 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 116.054 -0.521 . . . . 2.18 110.363 -177.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.459 ' CB ' ' HB3' ' A' ' 28' ' ' ASN . 5.3 tttp -83.52 131.4 52.68 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 115.512 -0.767 . . . . 2.75 110.232 177.115 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.436 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 40.9 Cg_endo -68.3 140.5 48.87 Favored 'Trans proline' 0 N--CA 1.463 -0.3 0 C-N-CA 122.758 2.306 . . . . 1.38 112.702 177.77 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -142.45 121.58 1.8 Allowed Glycine 0 N--CA 1.446 -0.635 0 N-CA-C 110.491 -1.043 . . . . 0.97 110.491 177.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.444 ' HE ' ' CD ' ' A' ' 146' ' ' GLU . 0.3 OUTLIER -129.38 173.03 10.91 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 117.052 0.426 . . . . 1.93 110.877 -174.452 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -110.33 100.97 9.74 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.778 -0.646 . . . . 2.64 110.778 177.472 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.404 ' HA ' ' HA ' ' A' ' 146' ' ' GLU . 4.7 p -108.66 164.25 12.54 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 120.781 -0.368 . . . . 0.68 110.58 175.682 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.465 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 0.1 OUTLIER -65.72 -35.87 81.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.931 -0.577 . . . . 1.47 110.647 -179.666 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -67.43 -36.27 80.88 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-O 120.748 0.308 . . . . 1.04 110.505 178.162 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.43 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.6 OUTLIER -63.1 -53.7 49.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.991 -0.55 . . . . 0.8 110.648 178.971 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -68.51 -30.36 69.16 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.985 -0.552 . . . . 1.75 110.617 -179.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.465 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 43.3 t80 -57.9 -63.2 1.33 Allowed 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 115.846 -0.616 . . . . 0.64 110.781 176.417 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.468 ' HG2' HG21 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -60.23 -31.87 70.59 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.749 0.309 . . . . 1.13 110.915 -172.945 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.428 ' HA ' ' CG1' ' A' ' 47' ' ' VAL . 11.1 tt0 -67.41 -48.2 68.01 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.88 -0.6 . . . . 1.3 110.978 -178.449 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 66.9 m-80 -85.81 -32.41 21.79 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 112.369 0.507 . . . . 0.5 112.369 -179.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 72.6 t -88.23 -57.4 4.28 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 N-CA-C 112.214 0.45 . . . . 0.3 112.214 -174.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.468 HG21 ' HG2' ' A' ' 42' ' ' MET . 78.6 t -82.6 -66.22 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 C-N-CA 120.695 -0.402 . . . . 0.26 111.864 -170.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.459 HG12 ' O ' ' A' ' 42' ' ' MET . 1.4 p -64.54 -36.79 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 C-N-CA 120.431 -0.508 . . . . 0.83 111.669 -174.026 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.38 -36.97 79.3 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.848 0.356 . . . . 2.4 111.037 177.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 56.3 m -77.88 -34.31 51.66 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.59 -0.277 . . . . 0.55 110.948 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.718 HD23 HD11 ' A' ' 132' ' ' ILE . 0.0 OUTLIER -65.47 -42.63 92.05 Favored 'General case' 0 C--N 1.332 -0.196 0 N-CA-C 109.654 -0.499 . . . . 0.33 109.654 175.275 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 21.2 t-105 -61.9 -38.54 88.74 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.743 -0.662 . . . . 0.39 111.006 178.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -84.42 15.37 3.71 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.018 0.377 . . . . 2.24 112.018 -175.31 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -87.3 134.47 33.55 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.557 -0.535 . . . . 0.39 109.557 175.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -74.9 -4.54 38.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.896 0.379 . . . . 1.91 111.782 -175.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.466 ' CD2' ' HG2' ' A' ' 125' ' ' MET . 3.0 m-30 -105.38 1.64 28.03 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.118 0.485 . . . . 0.93 110.202 177.065 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.727 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -101.24 12.78 36.89 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.173 -0.467 . . . . 0.28 111.05 -178.612 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.489 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 55.6 p-90 -65.62 -34.62 9.61 Favored Pre-proline 0 CA--C 1.546 0.822 0 N-CA-C 113.507 0.929 . . . . 0.58 113.507 -175.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.489 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 4.7 Cg_exo -75.01 -1.84 11.76 Favored 'Trans proline' 0 C--N 1.364 1.357 0 CA-C-N 120.924 1.366 . . . . 0.47 112.136 178.617 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -106.9 10.59 30.53 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.019 -0.537 . . . . 1.11 110.405 -179.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 11.7 m-30 -79.57 -13.25 59.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.894 -0.593 . . . . 0.63 111.317 -178.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -113.55 136.55 21.97 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 116.267 -0.424 . . . . 1.63 110.712 -174.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.586 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 37.1 Cg_endo -67.1 140.81 55.31 Favored 'Trans proline' 0 C--O 1.239 0.532 0 C-N-CA 122.765 2.31 . . . . 0.87 112.592 -179.474 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.414 HG11 ' CD2' ' A' ' 73' ' ' TYR . 47.4 t -83.97 86.03 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 CA-C-O 122.373 1.082 . . . . 0.88 109.408 178.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.534 ' OD1' ' HB2' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -103.18 17.1 24.87 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 114.259 -1.337 . . . . 1.85 108.612 177.26 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . 78.21 -66.08 0.22 Allowed 'General case' 0 C--O 1.215 -0.719 0 CA-C-N 113.379 -1.737 . . . . 1.29 111.254 -176.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 55.7 mt -75.53 -37.5 37.36 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 N-CA-C 112.173 0.435 . . . . 1.89 112.173 -171.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.534 ' HB2' ' OD1' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -57.67 -50.03 74.53 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.044 0.387 . . . . 2.99 112.044 -177.311 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 68' ' ' LEU . 9.9 tp -95.37 -2.63 48.71 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.289 0.566 . . . . 1.66 110.151 178.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . 0.458 ' O ' HD13 ' A' ' 70' ' ' LEU . 1.2 t-20 63.57 56.98 1.51 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 114.95 -1.023 . . . . 1.74 112.168 178.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.458 HD13 ' O ' ' A' ' 69' ' ' ASN . 1.1 mm? -122.23 78.79 43.96 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.17 -0.923 . . . . 1.61 108.89 172.281 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.18 -32.85 26.23 Favored 'Trans proline' 0 C--O 1.233 0.269 0 C-N-CA 122.336 2.024 . . . . 1.3 113.198 -172.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.12 7.21 46.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.438 -0.346 . . . . 1.97 111.202 -174.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.484 ' OH ' ' HB3' ' A' ' 111' ' ' ASN . 1.0 OUTLIER -59.16 -42.81 91.65 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.321 -0.4 . . . . 1.13 110.25 179.437 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -77.29 0.9 20.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.857 -0.61 . . . . 0.91 111.315 -175.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 5.9 mttp -97.99 -39.05 9.14 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.212 0.529 . . . . 2.86 110.327 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.6 mt -99.09 -39.73 8.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.941 -0.572 . . . . 1.0 110.766 -178.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 50.0 mm -97.3 124.89 50.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.893 -0.594 . . . . 0.75 110.171 -178.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.38 -17.24 30.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.342 -0.39 . . . . 1.99 111.262 -176.494 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 12.0 m-80 -128.32 87.28 55.67 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-O 120.841 0.353 . . . . 2.05 110.343 177.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -71.36 90.51 0.68 Allowed 'Trans proline' 0 CA--C 1.528 0.203 0 C-N-CA 122.976 2.451 . . . . 0.89 111.938 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 4.0 mmt -122.33 150.49 42.31 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 121.471 0.653 . . . . 0.82 110.527 -178.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.586 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 1.0 OUTLIER -128.45 -119.69 0.24 Allowed 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 114.589 -1.187 . . . . 1.42 109.03 -177.255 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -134.03 -17.68 2.12 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.941 0.4 . . . . 0.8 110.628 174.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -86.99 -30.77 19.47 Favored Glycine 0 CA--C 1.502 -0.749 0 N-CA-C 109.72 -1.352 . . . . 0.32 109.72 -178.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.3 m -74.17 -26.87 60.54 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.662 -0.769 . . . . 0.95 110.159 172.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.6 mm -66.19 -57.41 10.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.856 -0.611 . . . . 0.97 109.766 175.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.16 -24.46 66.31 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.554 -0.748 . . . . 1.15 110.886 179.049 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.523 ' HG3' HG21 ' A' ' 26' ' ' VAL . 4.3 tppt? -63.17 -48.09 79.87 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 120.703 0.287 . . . . 2.46 110.565 178.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 11.7 mtp180 -67.77 -29.54 68.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.973 0.416 . . . . 1.16 110.818 -179.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 9.4 mt -72.07 -51.38 21.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.855 -0.611 . . . . 0.49 111.182 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -73.72 -19.86 60.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.819 0.342 . . . . 1.39 111.252 -176.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.491 ' ND2' ' HB3' ' A' ' 27' ' ' SER . 17.6 t30 -95.06 0.83 54.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.369 -0.378 . . . . 1.3 111.371 -179.087 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 56.25 65.7 1.37 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.394 0.616 . . . . 1.75 110.874 -179.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . 0.719 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 26.6 t80 -80.41 -47.51 14.28 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 116.122 -0.49 . . . . 0.96 111.382 178.682 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.421 ' HB3' ' OE1' ' A' ' 100' ' ' GLU . 0.0 OUTLIER -106.32 -173.95 2.42 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.664 0.745 . . . . 1.28 111.835 -174.311 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . 0.436 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 2.1 t90 -83.11 -45.29 14.14 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.298 -1.319 . . . . 1.05 110.159 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 46.1 t -149.49 173.67 13.34 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 115.47 -0.786 . . . . 1.0 110.002 -173.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.43 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -70.84 -8.55 53.43 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.398 -0.365 . . . . 0.66 111.264 -176.639 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -37.36 76.58 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.762 -0.654 . . . . 0.85 111.005 179.433 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.44 ' O ' ' HB3' ' A' ' 103' ' ' GLN . 3.1 tt0 -81.6 -30.7 32.84 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.05 -0.523 . . . . 2.44 110.718 -178.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 13.7 t -65.19 -22.74 66.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.205 0.526 . . . . 0.95 110.834 -178.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.26 -24.1 66.15 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.121 -0.49 . . . . 1.13 110.224 176.589 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.588 ' HG2' ' N ' ' A' ' 104' ' ' ASP . 0.0 OUTLIER -72.06 -51.38 21.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 2.96 110.445 179.158 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . 0.588 ' N ' ' HG2' ' A' ' 103' ' ' GLN . 0.0 OUTLIER -70.63 -36.45 73.44 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.269 -0.423 . . . . 1.87 110.475 -177.491 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.698 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -60.58 -51.47 69.29 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.946 -0.57 . . . . 0.38 110.485 174.859 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -58.97 -41.27 87.14 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.891 -0.595 . . . . 0.97 110.766 179.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 71.1 m -56.41 -48.5 76.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.88 -0.6 . . . . 0.43 110.943 179.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.46 -42.9 61.92 Favored 'General case' 0 C--N 1.329 -0.3 0 O-C-N 123.439 0.462 . . . . 0.88 111.5 178.324 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -72.34 -45.04 61.62 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.43 -0.35 . . . . 0.29 111.159 -176.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -62.71 -36.16 82.07 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.132 0.492 . . . . 0.66 110.55 178.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . 0.484 ' HB3' ' OH ' ' A' ' 73' ' ' TYR . 25.1 m-20 -53.08 -51.91 60.31 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.314 -0.857 . . . . 1.84 111.05 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 43.8 t -60.26 -40.65 91.07 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.829 -0.623 . . . . 0.63 111.379 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -71.18 -26.84 63.14 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.475 -0.329 . . . . 0.81 111.528 -176.077 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 56.0 mt -92.65 -53.67 8.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.875 0.369 . . . . 0.55 111.708 -177.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -71.03 -35.49 72.02 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.294 -0.412 . . . . 1.22 111.355 -174.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 50.3 m-20 -101.42 166.0 10.97 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.925 0.393 . . . . 1.04 110.705 -174.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 1.7 mmpt? -78.68 140.86 59.44 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-N 115.947 -0.569 . . . . 3.47 110.188 178.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . 0.638 ' HA ' HG11 ' A' ' 123' ' ' VAL . 28.2 Cg_endo -65.49 -8.63 19.64 Favored 'Trans proline' 0 CA--C 1.531 0.361 0 C-N-CA 122.357 2.038 . . . . 0.96 112.541 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -103.01 4.18 37.03 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.375 -0.375 . . . . 1.23 111.251 177.516 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -76.5 154.45 34.63 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 109.628 -0.508 . . . . 1.34 109.628 178.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . 0.428 ' HB3' ' HB3' ' B' ' 315' ' ' ALY . 2.5 t70 -67.97 -33.29 74.36 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.972 -0.558 . . . . 1.44 110.205 -178.159 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.9 tp -63.27 -36.52 76.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.156 0 CA-C-N 116.339 -0.391 . . . . 0.42 110.519 177.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.638 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.6 t -73.18 -43.31 57.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 N-CA-C 109.778 -0.453 . . . . 0.35 109.778 178.139 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.521 ' HA ' ' OE1' ' A' ' 127' ' ' GLN . 0.2 OUTLIER -61.63 -29.77 70.27 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.001 -0.545 . . . . 0.52 110.008 -179.466 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . 0.466 ' HG2' ' CD2' ' A' ' 55' ' ' PHE . 46.7 mtt -80.63 -35.43 33.99 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.565 -0.743 . . . . 0.62 110.565 176.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -59.33 -36.81 76.34 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.021 -0.536 . . . . 0.31 111.592 -179.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . 0.521 ' OE1' ' HA ' ' A' ' 124' ' ' LEU . 18.9 mt-30 -61.22 -45.96 92.41 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.687 0.28 . . . . 1.94 110.638 179.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -67.85 -41.34 83.06 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.102 -0.499 . . . . 0.32 110.598 178.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.727 HD21 ' HA ' ' A' ' 56' ' ' ALA . 2.5 mp -58.78 -46.19 88.09 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.687 -0.688 . . . . 0.33 110.211 177.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -66.48 -30.05 70.29 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.672 -0.695 . . . . 1.47 111.061 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.1 OUTLIER -64.28 -43.33 95.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.221 -0.445 . . . . 2.24 110.285 -177.068 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.718 HD11 HD23 ' A' ' 50' ' ' LEU . 5.5 pt -79.93 -26.89 12.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 116.305 -0.407 . . . . 1.23 110.45 177.364 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.483 ' O ' HG23 ' A' ' 137' ' ' VAL . 37.7 t80 -59.57 -61.59 2.51 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.595 -0.275 . . . . 0.46 110.598 175.415 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 2.8 pp -65.03 -22.16 66.95 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.112 0.482 . . . . 0.64 110.442 -178.096 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.526 ' O ' ' HG3' ' A' ' 139' ' ' GLN . 0.8 OUTLIER -66.07 -54.09 30.17 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.596 -0.729 . . . . 1.61 109.979 177.572 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 4.7 mmtm -65.03 -33.71 76.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.61 -0.723 . . . . 1.52 110.692 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.485 ' O ' ' HB2' ' A' ' 140' ' ' MET . 78.7 t -67.16 -31.66 54.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.037 -0.529 . . . . 0.35 110.566 178.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.29 -19.52 64.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.058 0.456 . . . . 0.5 110.565 178.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . 0.526 ' HG3' ' O ' ' A' ' 135' ' ' GLN . 6.9 mt-30 -100.52 0.08 38.84 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.675 -0.693 . . . . 1.76 110.703 -178.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . 0.485 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 0.2 OUTLIER -66.14 147.62 98.77 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-N 115.965 -0.561 . . . . 0.86 111.115 -179.411 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.416 ' C ' ' H ' ' A' ' 143' ' ' GLU . 59.9 Cg_endo -71.35 107.01 2.05 Favored 'Trans proline' 0 N--CA 1.463 -0.289 0 C-N-CA 122.557 2.171 . . . . 0.67 112.01 -176.192 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.04 14.93 0.46 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.172 0.511 . . . . 2.91 111.372 -178.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.416 ' H ' ' C ' ' A' ' 141' ' ' PRO . 0.5 OUTLIER -95.2 -40.22 9.69 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 115.74 -0.664 . . . . 2.7 109.774 178.082 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 52.8 tt0 55.24 70.06 0.67 Allowed 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.025 -0.989 . . . . 2.34 110.776 -179.045 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 1.7 t -94.6 132.34 38.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 116.111 -0.495 . . . . 0.99 110.241 -177.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.444 ' CD ' ' HE ' ' A' ' 34' ' ' ARG . 26.8 tt0 -78.21 146.0 35.22 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.739 0.304 . . . . 1.53 110.191 178.236 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 82.5 mt . . . . . 0 C--O 1.247 0.934 0 CA-C-O 118.626 -0.702 . . . . 1.57 110.118 -179.315 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.783 0 N-CA-C 111.618 -0.593 . . . . 2.17 111.618 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 125.68 -60.94 0.62 Allowed Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.785 -0.721 . . . . 1.97 111.415 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 179.06 115.0 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.198 -0.667 . . . . 3.58 109.198 175.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 315' ' ' ALY . . . . . 0.428 ' HB3' ' HB3' ' A' ' 121' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 11.2 mtmt . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.42 -0.8 . . . . 4.6 110.245 -177.94 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.476 0.451 0 N-CA-C 110.371 -0.665 . . . . 6.18 110.371 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.401 ' HG ' ' H ' ' A' ' 22' ' ' LEU . 0.3 OUTLIER -73.79 -167.27 0.45 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.42 -0.355 . . . . 5.71 111.08 179.682 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -75.97 77.52 1.31 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 121.016 -0.611 . . . . 3.45 112.892 -177.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 78.2 p -93.59 131.35 38.95 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 110.2 -0.296 . . . . 2.44 110.2 175.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.67 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 6.9 mt-10 -63.78 125.43 24.32 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.255 0.55 . . . . 1.64 111.812 -179.375 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 9.8 p -108.61 -16.97 8.39 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.269 -0.878 . . . . 0.93 109.879 176.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 33.7 m -161.55 138.26 8.4 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.369 -0.832 . . . . 1.61 109.263 -178.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -134.43 121.07 15.06 Favored Pre-proline 0 C--N 1.322 -0.615 0 N-CA-C 110.113 -0.328 . . . . 1.6 110.113 178.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -74.86 -37.28 2.2 Favored 'Trans proline' 0 N--CA 1.473 0.305 0 C-N-CA 123.414 2.743 . . . . 1.87 112.843 -178.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 16.3 m -69.46 -25.14 63.95 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 121.795 0.807 . . . . 2.18 109.64 179.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.4 ttmm -82.85 134.16 47.46 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 114.685 -1.143 . . . . 2.75 109.496 174.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.487 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 11.4 Cg_endo -56.06 133.76 60.01 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.02 1.813 . . . . 1.38 111.115 175.484 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -124.57 69.35 0.48 Allowed Glycine 0 N--CA 1.444 -0.818 0 CA-C-N 115.644 -0.707 . . . . 0.97 111.887 -171.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.424 ' HE ' ' CD ' ' A' ' 146' ' ' GLU . 0.9 OUTLIER -101.35 -179.13 3.94 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.307 -0.627 . . . . 1.93 109.307 178.37 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.51 ' O ' ' HG2' ' A' ' 35' ' ' LYS . 0.0 OUTLIER -143.32 137.53 28.86 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.89 -0.411 . . . . 2.64 109.89 178.271 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.54 HG22 ' HG3' ' A' ' 146' ' ' GLU . 2.1 p -120.64 174.59 6.48 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 116.311 -0.404 . . . . 0.68 110.251 179.296 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 56.7 t-20 -50.34 -44.65 54.54 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.705 0.628 . . . . 1.47 110.158 175.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.434 ' HG2' ' SD ' ' A' ' 140' ' ' MET . 3.3 mt-30 -60.63 -43.1 97.9 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 116.227 -0.442 . . . . 1.04 110.836 179.204 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.41 ' HB2' ' H ' ' A' ' 36' ' ' THR . 1.9 tm? -55.02 -56.88 14.85 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.528 -0.76 . . . . 0.8 110.856 -178.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -70.88 -31.03 67.56 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.84 -0.618 . . . . 1.75 111.105 -178.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.528 ' CZ ' HG11 ' A' ' 45' ' ' VAL . 58.9 t80 -58.34 -63.72 1.17 Allowed 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.814 -0.63 . . . . 0.64 111.42 -179.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.607 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.3 OUTLIER -60.1 -30.69 69.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.618 0.247 . . . . 1.13 111.039 -172.427 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -62.29 -53.17 58.99 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.038 -0.528 . . . . 1.3 111.317 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.469 ' O ' ' HB2' ' A' ' 48' ' ' LYS . 50.3 m-80 -87.94 -29.49 20.77 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.932 0.396 . . . . 0.5 112.048 -177.579 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.528 HG11 ' CZ ' ' A' ' 41' ' ' TYR . 92.7 t -89.26 -58.66 3.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 N-CA-C 112.559 0.578 . . . . 0.3 112.559 -175.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.673 HG22 ' HB3' ' A' ' 136' ' ' LYS . 61.3 t -77.54 -65.12 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 C-N-CA 120.977 -0.289 . . . . 0.26 111.579 -169.246 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.474 HG12 ' O ' ' A' ' 42' ' ' MET . 1.6 p -66.51 -34.19 68.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 C-N-CA 120.512 -0.475 . . . . 0.83 111.546 -174.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 44' ' ' ASN . 0.0 OUTLIER -62.86 -35.46 80.05 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 120.559 -0.457 . . . . 2.4 111.457 177.826 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 22.8 m -77.35 -39.28 48.11 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.858 -0.337 . . . . 0.55 110.79 177.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.648 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -60.72 -37.97 83.49 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.221 0.534 . . . . 0.33 109.699 176.24 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 16.6 t-105 -63.78 -30.18 71.31 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.231 -0.895 . . . . 0.39 111.626 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.9 mttm -83.16 -5.94 59.3 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.197 0.443 . . . . 2.24 112.197 -173.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.405 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 3.7 t-80 -74.73 131.72 41.06 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.546 -0.539 . . . . 0.39 109.546 176.19 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -76.79 -11.87 59.9 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.591 -0.277 . . . . 1.91 111.397 -175.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.405 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 1.5 m-30 -92.87 -2.54 55.78 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.11 0.481 . . . . 0.93 110.14 176.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.781 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -96.78 14.26 25.76 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.111 -0.495 . . . . 0.28 110.596 179.245 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.52 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 47.6 p-90 -66.37 -33.2 6.29 Favored Pre-proline 0 CA--C 1.546 0.811 0 N-CA-C 114.016 1.117 . . . . 0.58 114.016 -174.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.52 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 11.7 Cg_exo -71.94 -2.05 10.92 Favored 'Trans proline' 0 C--N 1.361 1.228 0 C-N-CA 121.443 1.429 . . . . 0.47 112.328 178.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -111.19 15.73 21.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.272 -0.422 . . . . 1.11 110.632 -178.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.45 ' CE2' ' HA ' ' A' ' 57' ' ' TRP . 18.3 m-30 -83.21 -12.07 57.22 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.051 -0.522 . . . . 0.63 110.699 179.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.71 135.28 27.11 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.205 -0.452 . . . . 1.63 110.306 -177.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -71.47 147.3 51.9 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 122.718 2.279 . . . . 0.87 112.599 -177.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.419 HG21 ' CZ ' ' A' ' 73' ' ' TYR . 2.6 t -70.38 105.92 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.525 0 CA-C-O 121.931 0.872 . . . . 0.88 110.326 176.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.458 ' HB3' ' HB3' ' A' ' 67' ' ' LYS . 12.0 t70 -116.07 131.1 57.04 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 107.601 -1.259 . . . . 1.85 107.601 166.348 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.14 -16.11 61.18 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.317 -0.401 . . . . 1.29 111.462 -173.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 4.9 mt -97.42 -44.08 12.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.031 0.443 . . . . 1.89 110.663 177.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.458 ' HB3' ' HB3' ' A' ' 64' ' ' ASP . 14.8 tptm -66.0 -48.41 71.29 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.729 -0.669 . . . . 2.99 111.587 -177.019 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -101.8 1.74 37.53 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.502 -0.317 . . . . 1.66 110.701 -177.137 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 47.7 t30 58.23 55.06 5.32 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.868 -0.605 . . . . 1.74 111.332 178.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.0 mt -123.37 70.67 44.7 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 115.892 -0.595 . . . . 1.61 111.269 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.98 -19.78 22.77 Favored 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.158 1.905 . . . . 1.3 111.441 178.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -77.46 -16.44 58.76 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.322 -0.854 . . . . 1.97 110.557 -179.756 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.419 ' CZ ' HG21 ' A' ' 63' ' ' VAL . 0.8 OUTLIER -61.27 -38.17 85.77 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.371 -0.831 . . . . 1.13 111.732 -176.412 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 8.1 m-70 -83.43 -0.79 51.58 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.083 -0.508 . . . . 0.91 111.303 -169.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.5 mtpt -93.02 -21.51 19.7 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.141 0.496 . . . . 2.86 109.815 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 4.3 mt -114.53 -49.28 5.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.51 -0.768 . . . . 1.0 111.001 -178.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.452 HG22 ' H ' ' A' ' 79' ' ' ASN . 33.9 mm -99.87 123.12 52.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.058 0.456 . . . . 0.75 110.44 -178.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.37 -9.25 51.05 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.985 -0.552 . . . . 1.99 110.891 -177.463 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.452 ' H ' HG22 ' A' ' 77' ' ' ILE . 0.2 OUTLIER -134.6 80.31 51.04 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.9 -0.591 . . . . 2.05 110.743 -179.414 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -70.7 94.7 0.61 Allowed 'Trans proline' 0 CA--C 1.529 0.26 0 C-N-CA 122.478 2.119 . . . . 0.89 112.219 179.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -128.13 159.78 34.07 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.167 0.508 . . . . 0.82 110.981 -176.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.2 p-10 -135.93 -126.45 0.15 Allowed 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.929 -1.032 . . . . 1.42 109.742 -175.021 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.4 ttm -122.76 -18.1 6.64 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.43 -0.581 . . . . 0.8 109.43 177.116 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.432 ' HA2' ' HG2' ' A' ' 87' ' ' LYS . . . -82.13 -35.74 20.15 Favored Glycine 0 N--CA 1.44 -1.036 0 N-CA-C 109.808 -1.317 . . . . 0.32 109.808 179.484 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.8 m -72.36 -31.64 65.78 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.236 -0.482 . . . . 0.95 110.621 174.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.5 HD12 ' HB2' ' A' ' 104' ' ' ASP . 0.2 OUTLIER -64.67 -53.29 44.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 109.145 -0.687 . . . . 0.97 109.145 177.454 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.432 ' HG2' ' HA2' ' A' ' 84' ' ' GLY . 0.2 OUTLIER -65.39 -26.18 67.88 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.896 -0.593 . . . . 1.15 110.737 179.384 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.01 -47.21 81.19 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-O 120.81 0.338 . . . . 2.46 110.54 179.124 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 9.5 mtp180 -67.81 -31.59 71.55 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.23 -0.441 . . . . 1.16 110.619 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 7.3 mt -68.43 -52.27 34.57 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.061 -0.518 . . . . 0.49 111.254 178.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -75.66 -18.82 59.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.36 -0.382 . . . . 1.39 111.822 -175.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -95.27 0.05 53.44 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.749 0.309 . . . . 1.3 110.411 178.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 56.58 66.48 1.18 Allowed 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 115.614 -0.721 . . . . 1.75 110.921 -179.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . 0.67 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 11.3 t80 -70.76 -57.76 4.32 Favored 'General case' 0 CA--C 1.512 -0.483 0 CA-C-O 121.765 0.793 . . . . 0.96 110.725 175.44 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -103.7 -177.88 3.5 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 114.268 -1.333 . . . . 1.28 112.074 -173.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . 0.487 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 2.3 t-105 -79.89 -44.61 20.12 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.444 -1.253 . . . . 1.05 110.647 -177.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 14.5 t -146.68 175.37 10.65 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.994 -0.548 . . . . 1.0 110.971 -173.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.15 -14.54 60.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.253 -0.43 . . . . 0.66 111.083 -176.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.12 -31.22 68.74 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.479 0.657 . . . . 0.85 109.869 174.469 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.64 -39.31 45.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.365 -0.834 . . . . 2.44 110.228 177.012 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 31.7 t -62.85 -22.62 66.8 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.595 -0.729 . . . . 0.95 110.586 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 5.4 mtt -58.97 -21.1 57.99 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.89 -0.595 . . . . 1.13 110.646 175.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -76.27 -55.94 5.1 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 116.38 -0.373 . . . . 2.96 110.328 177.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . 0.5 ' HB2' HD12 ' A' ' 86' ' ' ILE . 0.1 OUTLIER -67.07 -40.62 87.07 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.361 -0.381 . . . . 1.87 111.224 -176.21 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.648 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -59.24 -45.32 91.45 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.129 0.49 . . . . 0.38 110.548 176.623 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -64.72 -43.96 91.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.847 -0.615 . . . . 0.97 110.336 178.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . 0.467 ' O ' ' HB3' ' A' ' 111' ' ' ASN . 57.3 m -53.98 -46.58 71.73 Favored 'General case' 0 C--N 1.332 -0.157 0 O-C-N 123.76 0.663 . . . . 0.43 111.31 -178.403 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -52.83 -40.29 63.21 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.12 -0.491 . . . . 0.88 111.07 178.195 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 24.9 m-85 -74.85 -50.53 16.72 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.303 -0.408 . . . . 0.29 111.512 -177.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -63.28 -43.47 97.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.926 0.393 . . . . 0.66 111.058 -177.041 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . 0.467 ' HB3' ' O ' ' A' ' 107' ' ' THR . 0.1 OUTLIER -51.76 -44.31 63.31 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.386 -0.825 . . . . 1.84 111.252 179.229 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -64.83 -36.01 82.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.402 -0.363 . . . . 0.63 110.842 -178.535 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -71.85 -24.32 61.67 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.252 -0.431 . . . . 0.81 111.395 -178.006 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 25.2 mt -89.84 -49.11 14.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.361 -0.381 . . . . 0.55 111.226 -177.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 88.0 t80 -69.22 -32.11 71.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.229 -0.442 . . . . 1.22 111.461 -175.005 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 54.1 m-80 -108.15 169.62 8.51 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.126 0.489 . . . . 1.04 111.531 -173.016 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 11.2 mmtt -82.53 149.45 61.02 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.672 -0.694 . . . . 3.47 109.969 177.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . 0.568 ' HA ' HG11 ' A' ' 123' ' ' VAL . 34.2 Cg_endo -66.23 -9.6 24.26 Favored 'Trans proline' 0 CA--C 1.53 0.319 0 C-N-CA 122.576 2.184 . . . . 0.96 112.848 -177.557 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -111.53 27.67 9.46 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.822 0.344 . . . . 1.23 111.269 179.605 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.471 ' OD2' HG22 ' A' ' 122' ' ' ILE . 8.6 t70 -99.85 164.58 11.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 1.34 110.705 178.255 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -64.26 -49.16 72.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.834 -0.621 . . . . 1.44 110.417 -178.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.471 HG22 ' OD2' ' A' ' 120' ' ' ASP . 3.4 tp -61.45 -35.95 70.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.12 -0.491 . . . . 0.42 111.054 -175.517 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.568 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.4 t -70.4 -47.1 67.95 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 121.001 0.429 . . . . 0.35 110.157 177.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.2 mt -60.91 -35.25 76.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.726 -0.67 . . . . 0.52 110.238 -179.052 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 29.6 mtt -73.2 -43.36 61.46 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.757 -0.656 . . . . 0.62 110.619 179.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.97 -35.22 68.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.239 -0.437 . . . . 0.31 111.491 -179.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -62.89 -42.65 99.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.275 -0.42 . . . . 1.94 111.007 179.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -77.06 -39.73 48.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 0.32 110.518 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.781 HD21 ' HA ' ' A' ' 56' ' ' ALA . 2.3 mp -57.49 -39.74 77.09 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.483 -0.78 . . . . 0.33 110.757 178.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.6 -26.63 68.48 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.706 -0.679 . . . . 1.47 111.527 -177.68 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.498 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 27.6 mttt -64.9 -35.97 82.87 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.887 -0.412 . . . . 2.24 109.887 -179.64 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.464 ' H ' HG13 ' A' ' 132' ' ' ILE . 2.5 mt -74.77 -30.51 24.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.735 -0.666 . . . . 1.23 110.393 178.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.476 ' O ' HG23 ' A' ' 137' ' ' VAL . 49.5 t80 -59.29 -61.84 2.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.88 -0.6 . . . . 0.46 110.153 177.434 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.02 -30.07 71.32 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.102 0.477 . . . . 0.64 110.534 -178.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.498 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -59.49 -31.6 69.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.469 -0.787 . . . . 1.61 112.173 -180.0 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . 0.673 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -99.72 -22.32 15.43 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.072 0.463 . . . . 1.52 110.444 -179.504 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.648 ' O ' ' HB2' ' A' ' 140' ' ' MET . 56.1 t -77.92 -31.9 17.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.63 -0.714 . . . . 0.35 110.436 -179.329 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -68.24 -18.27 64.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.167 0.508 . . . . 0.5 110.419 178.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . 0.471 ' HB2' ' OH ' ' A' ' 41' ' ' TYR . 1.9 mt-30 -98.18 2.8 48.82 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 115.633 -0.712 . . . . 1.76 110.324 179.487 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . 0.648 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 1.6 mtt -67.39 147.68 98.81 Favored Pre-proline 0 C--O 1.233 0.219 0 CA-C-N 115.874 -0.603 . . . . 0.86 110.667 177.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.31 105.7 2.09 Favored 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.222 1.948 . . . . 0.67 111.508 175.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.04 8.37 2.61 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.083 0.468 . . . . 2.91 111.487 -174.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -91.06 -38.82 12.55 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.846 -0.616 . . . . 2.7 109.864 178.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 61.8 91.31 0.06 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 114.647 -1.161 . . . . 2.34 110.641 -177.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 10.3 t -111.08 126.27 68.46 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 115.897 -0.592 . . . . 0.99 109.532 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.54 ' HG3' HG22 ' A' ' 36' ' ' THR . 4.1 tt0 -71.64 149.23 45.77 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.993 0.425 . . . . 1.53 111.135 -177.443 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 16.0 mt . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.881 -0.58 . . . . 1.57 110.555 -178.245 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.772 0 N-CA-C 111.725 -0.55 . . . . 2.17 111.725 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 118.41 -47.98 0.98 Allowed Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.806 -0.712 . . . . 1.97 111.735 178.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 1.8 tpmp? -157.23 123.73 4.96 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.845 0.355 . . . . 3.58 110.222 177.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 315' ' ' ALY . . . . . 0.422 ' NZ ' ' HB3' ' A' ' 58' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 8.2 mmtm . . . . . 0 C--O 1.244 0.766 0 CA-C-O 118.547 -0.74 . . . . 4.6 109.993 -179.082 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo . . . . . 0 N--CA 1.479 0.646 0 N-CA-C 110.202 -0.73 . . . . 6.18 110.202 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.436 ' H ' ' HG ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -106.83 111.99 24.75 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.002 0.43 . . . . 5.71 110.614 179.129 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.85 -88.58 1.06 Allowed Glycine 0 N--CA 1.452 -0.293 0 CA-C-N 115.77 -0.65 . . . . 3.45 112.16 179.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 6.8 p -137.69 141.74 41.09 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.516 -0.549 . . . . 2.44 109.516 176.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.658 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 5.2 mt-10 -49.31 116.28 1.65 Allowed 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 121.415 0.626 . . . . 1.64 112.144 178.157 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 3.3 p -101.94 -6.23 9.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 115.461 -0.79 . . . . 0.93 109.522 176.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 70.8 m -160.83 145.85 14.22 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 114.963 -1.017 . . . . 1.61 109.73 178.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.479 ' HB3' ' HB2' ' A' ' 31' ' ' LYS . 24.8 t-20 -146.57 126.85 6.93 Favored Pre-proline 0 C--N 1.316 -0.852 0 N-CA-C 108.765 -0.828 . . . . 1.6 108.765 175.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -61.81 -46.13 14.72 Favored 'Trans proline' 0 N--CA 1.474 0.374 0 C-N-CA 123.241 2.628 . . . . 1.87 113.305 -175.024 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 6.1 m -77.55 -22.74 50.56 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.212 0.529 . . . . 2.18 110.927 -177.045 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.479 ' HB2' ' HB3' ' A' ' 28' ' ' ASN . 9.3 tttm -77.22 124.77 87.12 Favored Pre-proline 0 C--N 1.321 -0.665 0 CA-C-N 115.393 -0.821 . . . . 2.75 111.231 -177.624 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.403 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 6.0 Cg_exo -76.09 151.57 34.87 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 122.538 2.159 . . . . 1.38 111.975 175.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -136.85 136.06 8.09 Favored Glycine 0 N--CA 1.443 -0.86 0 N-CA-C 110.366 -1.094 . . . . 0.97 110.366 177.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.98 166.19 22.96 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.187 0.517 . . . . 1.93 111.361 -176.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -115.23 70.13 0.74 Allowed 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.32 -0.854 . . . . 2.64 109.483 -179.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.68 HG22 ' HG3' ' A' ' 146' ' ' GLU . 2.6 p -89.0 170.02 11.02 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.84 -0.344 . . . . 0.68 110.726 -177.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.506 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 67.2 t30 -59.55 -47.34 85.95 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 115.939 -0.573 . . . . 1.47 110.406 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -56.0 -46.58 78.68 Favored 'General case' 0 C--O 1.233 0.231 0 O-C-N 123.296 0.373 . . . . 1.04 110.821 179.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.91 -59.61 5.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.103 -0.498 . . . . 0.8 111.355 -178.248 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -65.55 -28.26 69.03 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.088 -0.505 . . . . 1.75 110.613 -177.289 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.561 ' CE1' ' HG2' ' A' ' 140' ' ' MET . 36.3 t80 -60.89 -63.34 1.33 Allowed 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 116.172 -0.467 . . . . 0.64 110.974 176.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.526 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.2 OUTLIER -63.82 -28.45 69.87 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.736 -0.385 . . . . 1.13 110.648 -172.436 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.651 ' HB2' HD22 ' A' ' 90' ' ' LEU . 4.1 tt0 -66.08 -50.58 63.62 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.86 -0.609 . . . . 1.3 110.743 178.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.9 m-80 -86.53 -31.1 21.45 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 111.99 0.367 . . . . 0.5 111.99 -177.52 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 99.4 t -89.34 -58.47 3.47 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.924 0 N-CA-C 112.446 0.536 . . . . 0.3 112.446 -176.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.69 HG22 ' HB3' ' A' ' 136' ' ' LYS . 71.3 t -77.23 -66.14 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.337 -0.392 . . . . 0.26 111.685 -169.15 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.452 HG11 HD13 ' A' ' 90' ' ' LEU . 1.8 p -65.83 -36.05 76.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 C-N-CA 120.531 -0.468 . . . . 0.83 111.588 -175.185 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 7.8 mttt -63.05 -39.61 95.25 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.343 -0.543 . . . . 2.4 111.496 178.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.605 HG21 ' HE2' ' A' ' 136' ' ' LYS . 90.2 m -69.75 -39.33 76.8 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 120.729 0.299 . . . . 0.55 110.801 177.554 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.639 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -64.28 -40.29 95.65 Favored 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 109.724 -0.473 . . . . 0.33 109.724 176.391 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . 0.427 ' CE3' ' HE3' ' A' ' 83' ' ' MET . 15.5 t-105 -62.87 -35.91 81.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.541 -0.754 . . . . 0.39 111.025 177.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -81.68 9.59 7.51 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.412 -0.358 . . . . 2.24 111.873 -177.21 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.401 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 10.8 t-80 -90.05 126.46 35.78 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.299 -0.63 . . . . 0.39 109.299 173.276 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -81.97 15.46 2.28 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 112.114 0.412 . . . . 1.91 112.114 -173.279 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.401 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.3 OUTLIER -111.43 -5.3 14.62 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.205 -0.665 . . . . 0.93 109.205 171.524 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.634 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -95.57 16.93 15.83 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.579 -0.737 . . . . 0.28 110.613 179.681 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.517 ' CG ' ' HD3' ' A' ' 58' ' ' PRO . 57.9 p-90 -67.28 -35.16 8.07 Favored Pre-proline 0 CA--C 1.54 0.593 0 N-CA-C 113.527 0.936 . . . . 0.58 113.527 -175.366 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.517 ' HD3' ' CG ' ' A' ' 57' ' ' TRP . 2.9 Cg_exo -76.17 2.82 6.77 Favored 'Trans proline' 0 C--N 1.361 1.223 0 C-N-CA 121.445 1.43 . . . . 0.47 111.425 175.314 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -107.2 -4.85 18.34 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.396 -0.82 . . . . 1.11 110.687 -178.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.0 m-30 -71.15 -29.1 64.8 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.315 -0.402 . . . . 0.63 111.748 -176.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.75 123.39 45.88 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-N 116.269 -0.423 . . . . 1.63 111.203 -172.512 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.683 ' HB3' HG23 ' A' ' 85' ' ' THR . 25.0 Cg_exo -61.56 144.65 97.88 Favored 'Trans proline' 0 C--O 1.238 0.481 0 C-N-CA 122.686 2.258 . . . . 0.87 112.314 178.164 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 4.0 t -80.69 111.49 17.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-O 121.661 0.743 . . . . 0.88 110.633 -179.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.451 ' HB3' ' HG2' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -111.51 -0.09 16.31 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.043 -0.98 . . . . 1.85 109.478 177.488 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.498 ' HB2' ' NE2' ' A' ' 74' ' ' HIS . . . 78.38 -55.66 0.48 Allowed 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 114.762 -1.108 . . . . 1.29 111.5 -177.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.7 mp -80.41 -44.32 21.99 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 O-C-N 122.177 -0.327 . . . . 1.89 111.749 -173.142 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.451 ' HG2' ' HB3' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -64.03 -31.04 72.09 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.594 0.22 . . . . 2.99 111.594 -177.424 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.451 ' HB3' HD22 ' A' ' 70' ' ' LEU . 5.0 tp -109.81 3.61 20.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.643 0.258 . . . . 1.66 111.601 -176.482 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 58.85 59.52 2.81 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.361 0.6 . . . . 1.74 111.236 179.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.451 HD22 ' HB3' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -124.7 72.96 62.12 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 115.222 -0.899 . . . . 1.61 109.625 178.051 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -74.49 -58.83 0.05 OUTLIER 'Trans proline' 0 CA--C 1.531 0.34 0 C-N-CA 121.952 1.768 . . . . 1.3 112.928 -174.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -79.83 6.77 10.15 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.387 0.613 . . . . 1.97 111.019 -176.445 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -61.04 -38.42 86.08 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.233 -0.894 . . . . 1.13 110.613 177.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.498 ' NE2' ' HB2' ' A' ' 65' ' ' ALA . 5.1 m-70 -80.25 -0.4 36.24 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.461 -0.79 . . . . 0.91 111.404 -175.764 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.2 mmtp -94.47 -44.24 7.98 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.658 -0.497 . . . . 2.86 109.658 -179.032 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 14.0 mt -82.99 -47.18 18.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.807 -0.633 . . . . 1.0 110.807 179.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 28.6 mm -93.53 133.64 33.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 116.167 -0.47 . . . . 0.75 110.056 -178.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.55 -36.28 24.12 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.136 -0.484 . . . . 1.99 110.54 -177.161 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -119.56 88.88 39.82 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 115.771 -0.65 . . . . 2.05 110.279 -179.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -74.46 80.57 2.24 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 122.857 2.371 . . . . 0.89 112.297 -178.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -117.63 176.52 5.14 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.358 0.599 . . . . 0.82 111.158 -178.442 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.571 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 4.4 p-10 -154.32 -129.08 0.03 OUTLIER 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 114.763 -1.108 . . . . 1.42 108.96 -172.254 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . 0.469 ' SD ' HD13 ' A' ' 50' ' ' LEU . 6.7 ttp -124.69 -16.8 6.12 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.245 0.545 . . . . 0.8 110.242 -177.875 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -90.05 -29.47 15.09 Favored Glycine 0 N--CA 1.44 -1.044 0 N-CA-C 110.455 -1.058 . . . . 0.32 110.455 -178.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.683 HG23 ' HB3' ' A' ' 62' ' ' PRO . 0.7 OUTLIER -70.06 -42.65 72.55 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-O 121.258 0.552 . . . . 0.95 110.373 177.185 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 48.8 mt -61.95 -44.1 98.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.249 -0.887 . . . . 0.97 109.944 175.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.73 -34.56 76.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.838 -0.619 . . . . 1.15 111.44 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 3.0 mtpt -62.1 -49.09 77.31 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.393 0.616 . . . . 2.46 110.518 179.345 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 32.5 mtp180 -66.69 -29.38 69.36 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.382 -0.827 . . . . 1.16 111.314 -179.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.651 HD22 ' HB2' ' A' ' 43' ' ' GLN . 6.3 mt -70.18 -51.67 29.35 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.297 -0.41 . . . . 0.49 110.883 177.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -73.68 -17.45 61.14 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.142 -0.481 . . . . 1.39 111.695 -175.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 14.4 t30 -100.94 1.32 39.69 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 121.028 -0.269 . . . . 1.3 110.825 178.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 54.77 58.92 4.41 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.937 -0.574 . . . . 1.75 111.184 178.149 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . 0.658 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 43.5 t80 -76.51 -28.56 56.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.167 -0.47 . . . . 0.96 111.283 -178.603 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -117.36 179.76 3.95 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.119 0.485 . . . . 1.28 111.217 -177.537 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . 0.403 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 2.1 t-105 -81.34 -44.47 17.57 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.282 -0.872 . . . . 1.05 110.771 -177.071 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 36.5 t -148.12 -179.6 7.04 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.034 -0.53 . . . . 1.0 111.166 -172.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.45 -18.05 60.7 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.067 -0.515 . . . . 0.66 111.196 -176.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.38 -29.43 67.7 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.319 0.581 . . . . 0.85 110.195 177.322 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -82.34 -24.64 34.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.508 -0.769 . . . . 2.44 110.265 -179.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 9.6 t -83.42 -30.57 27.2 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.528 -0.76 . . . . 0.95 110.876 -178.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 8.8 ttm -59.01 -33.8 71.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.802 -0.635 . . . . 1.13 111.532 -177.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.48 -45.51 87.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.165 -0.471 . . . . 2.96 110.611 -179.54 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.26 -38.05 71.9 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.328 -0.396 . . . . 1.87 110.316 -179.422 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.639 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -57.97 -43.97 86.81 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.856 -0.611 . . . . 0.38 110.802 178.466 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 31.0 t30 -66.53 -46.29 76.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.973 -0.558 . . . . 0.97 110.08 176.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 94.2 m -57.14 -41.38 79.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.787 -0.642 . . . . 0.43 111.859 -179.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -54.25 -35.09 62.13 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 120.792 0.33 . . . . 0.88 111.141 177.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -78.97 -49.58 12.53 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 116.233 -0.439 . . . . 0.29 110.753 -177.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.77 -42.85 89.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.352 -0.385 . . . . 0.66 110.876 179.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -51.6 -47.1 63.73 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.589 -0.732 . . . . 1.84 111.002 178.017 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 4.4 t -62.32 -44.82 95.6 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 120.765 0.316 . . . . 0.63 110.938 177.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -65.41 -34.2 77.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.295 -0.411 . . . . 0.81 111.613 -177.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 54.4 mt -80.48 -52.77 13.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.468 -0.333 . . . . 0.55 111.701 -176.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 93.0 t80 -64.77 -35.49 81.25 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.865 0.364 . . . . 1.22 111.156 -175.179 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 59.7 m-80 -99.8 -175.98 3.13 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 116.084 -0.507 . . . . 1.04 110.552 -175.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.578 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 0.2 OUTLIER -93.33 150.73 39.5 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 109.469 -0.567 . . . . 3.47 109.469 176.161 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . 0.403 ' HA ' HG11 ' A' ' 123' ' ' VAL . 38.2 Cg_exo -62.9 -15.35 46.81 Favored 'Trans proline' 0 N--CA 1.471 0.174 0 C-N-CA 122.29 1.993 . . . . 0.96 112.141 177.463 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.88 16.63 24.89 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.6 -0.727 . . . . 1.23 110.927 177.474 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.578 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 0.2 OUTLIER -80.04 159.01 26.34 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 120.884 0.373 . . . . 1.34 110.569 -178.752 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . 0.432 ' HB2' ' O ' ' B' ' 313' ' ' GLY . 4.9 m-20 -68.01 -46.72 70.47 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.726 -0.67 . . . . 1.44 110.666 -177.856 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -62.69 -37.83 80.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.123 -0.489 . . . . 0.42 110.634 179.232 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.403 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.3 t -66.12 -42.19 90.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 121.009 0.433 . . . . 0.35 110.252 178.703 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.16 -33.38 72.1 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.843 -0.617 . . . . 0.52 109.878 179.909 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . 0.458 ' O ' HD13 ' A' ' 129' ' ' LEU . 11.9 mtt -75.06 -47.47 28.73 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.403 -0.817 . . . . 0.62 110.515 177.001 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -55.9 -37.91 69.51 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.11 -0.495 . . . . 0.31 111.358 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.03 -41.4 87.73 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.979 -0.555 . . . . 1.94 111.043 178.268 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -76.17 -38.89 56.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.027 0.442 . . . . 0.32 110.602 178.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.634 HD21 ' HA ' ' A' ' 56' ' ' ALA . 2.3 mp -57.31 -41.76 80.49 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.566 -0.743 . . . . 0.33 110.399 177.787 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -61.27 -26.28 67.66 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.281 -0.872 . . . . 1.47 112.106 -176.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.534 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 49.4 mttm -62.64 -45.78 91.27 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 120.751 0.31 . . . . 2.24 110.38 -175.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.443 HD12 HD23 ' A' ' 50' ' ' LEU . 0.0 OUTLIER -77.48 -21.89 14.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.185 -0.462 . . . . 1.23 110.903 -179.601 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.544 ' O ' HG23 ' A' ' 137' ' ' VAL . 22.0 t80 -63.43 -61.98 1.98 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.652 -0.249 . . . . 0.46 110.516 177.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.0 -27.2 67.95 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.115 0.484 . . . . 0.64 110.219 -178.386 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.534 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -58.87 -56.74 18.34 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 115.173 -0.922 . . . . 1.61 110.865 174.384 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . 0.69 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -66.67 -30.29 70.51 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.92 -0.582 . . . . 1.52 110.867 -177.761 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 133' ' ' PHE . 83.2 t -66.53 -34.8 72.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.146 -0.479 . . . . 0.35 110.229 176.311 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -70.84 -15.32 62.63 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.163 -0.472 . . . . 0.5 111.019 179.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . 0.479 ' HG3' ' O ' ' A' ' 135' ' ' GLN . 11.1 mt-30 -98.25 -6.38 31.24 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.398 -0.364 . . . . 1.76 110.596 177.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . 0.561 ' HG2' ' CE1' ' A' ' 41' ' ' TYR . 0.0 OUTLIER -66.12 159.21 72.7 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 116.086 -0.507 . . . . 0.86 110.453 -179.927 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -74.65 116.95 4.77 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 121.479 1.452 . . . . 0.67 110.366 174.707 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 5.7 mp0 -71.34 -2.78 17.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.514 0.673 . . . . 2.91 110.391 -178.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.6 -130.92 0.21 Allowed 'General case' 0 N--CA 1.432 -1.371 0 CA-C-N 114.768 -1.105 . . . . 2.7 108.861 179.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 178.8 132.5 0.08 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.08 -0.711 . . . . 2.34 109.08 169.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 2.4 t -131.66 114.45 25.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.305 -0.407 . . . . 0.99 110.118 -179.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.68 ' HG3' HG22 ' A' ' 36' ' ' THR . 15.8 tt0 -76.09 134.21 40.09 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 110.221 -0.288 . . . . 1.53 110.221 179.397 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 4.3 mt . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.647 -0.692 . . . . 1.57 110.346 -179.195 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.666 0 N-CA-C 111.076 -0.809 . . . . 2.17 111.076 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 313' ' ' GLY . . . . . 0.432 ' O ' ' HB2' ' A' ' 121' ' ' ASP . . . 102.9 -76.41 0.3 Allowed Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.517 -0.849 . . . . 1.97 112.425 178.564 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -94.6 120.56 35.02 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.812 0.339 . . . . 3.58 110.565 -174.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.961 0 N-CA-C 109.225 -0.658 . . . . 4.6 109.225 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo . . . . . 0 N--CA 1.481 0.736 0 N-CA-C 109.457 -1.017 . . . . 6.18 109.457 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.53 73.56 5.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.264 0.554 . . . . 5.71 109.976 176.708 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 167.04 79.71 0.04 OUTLIER Glycine 0 N--CA 1.444 -0.79 0 CA-C-N 115.554 -0.748 . . . . 3.45 111.353 -177.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 3.1 m -117.82 134.53 54.83 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 121.129 0.49 . . . . 2.44 110.783 179.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.459 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 2.7 mt-10 -64.5 152.79 40.83 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.288 -0.869 . . . . 1.64 112.319 -178.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 4.1 p -122.94 -2.69 7.2 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 114.911 -1.04 . . . . 0.93 109.329 174.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.2 m -169.87 143.37 2.58 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.706 -1.134 . . . . 1.61 108.514 178.441 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 -151.91 140.21 13.33 Favored Pre-proline 0 C--N 1.323 -0.553 0 CA-C-O 120.555 0.216 . . . . 1.6 110.527 -178.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -70.76 -45.15 1.12 Allowed 'Trans proline' 0 N--CA 1.475 0.439 0 C-N-CA 123.193 2.595 . . . . 1.87 113.323 177.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.7 m -74.8 -28.34 60.68 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 121.206 0.527 . . . . 2.18 110.389 -176.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -86.31 114.84 59.61 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 115.488 -0.778 . . . . 2.75 109.015 174.347 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.498 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 5.9 Cg_exo -66.66 148.11 82.64 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 121.651 1.567 . . . . 1.38 111.812 -176.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -144.81 119.51 1.26 Allowed Glycine 0 N--CA 1.44 -1.045 0 N-CA-C 110.638 -0.985 . . . . 0.97 110.638 -179.194 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.3 mmm-85 -134.52 171.51 14.21 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.861 -0.422 . . . . 1.93 109.861 -176.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.472 ' HA ' HD22 ' A' ' 39' ' ' LEU . 26.7 ttpt -111.1 98.56 7.62 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.649 -0.5 . . . . 2.64 109.649 -179.124 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.695 HG22 ' HG3' ' A' ' 146' ' ' GLU . 2.8 p -106.15 167.25 9.94 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 120.748 0.309 . . . . 0.68 111.366 -178.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.572 ' HB3' ' O ' ' A' ' 145' ' ' VAL . 0.1 OUTLIER -66.78 -35.52 80.26 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.096 -0.502 . . . . 1.47 110.781 -179.582 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -70.32 -38.87 75.02 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.894 0.378 . . . . 1.04 110.34 176.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.827 ' HA ' ' HB2' ' A' ' 98' ' ' ALA . 0.5 OUTLIER -62.88 -52.63 62.37 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.003 -0.544 . . . . 0.8 110.339 178.253 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.95 -20.88 65.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.008 -0.542 . . . . 1.75 111.134 -179.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.57 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 43.4 t80 -68.31 -63.47 1.05 Allowed 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.741 -0.663 . . . . 0.64 111.33 179.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.551 ' HA ' HG23 ' A' ' 46' ' ' VAL . 1.5 ttm -60.37 -33.85 73.04 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 111.978 0.362 . . . . 1.13 111.978 -170.101 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.557 ' HG2' ' O ' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -63.01 -48.91 76.75 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.154 0.502 . . . . 1.3 110.585 -175.423 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.544 ' O ' ' HB2' ' A' ' 48' ' ' LYS . 69.7 m-80 -85.79 -31.29 22.41 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.835 -0.621 . . . . 0.5 111.537 -178.312 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 88.3 t -89.01 -59.72 2.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 112.878 0.695 . . . . 0.3 112.878 -175.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.691 HG22 ' HB3' ' A' ' 136' ' ' LYS . 21.9 t -79.14 -51.82 16.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 C-N-CA 120.992 -0.283 . . . . 0.26 110.669 -171.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.55 HG23 ' O ' ' A' ' 42' ' ' MET . 14.7 t -58.34 -47.61 87.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.912 -0.586 . . . . 0.83 111.083 -178.03 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.544 ' HB2' ' O ' ' A' ' 44' ' ' ASN . 3.6 mttt -63.34 -29.9 71.13 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.214 0.449 . . . . 2.4 112.214 -177.474 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.489 HG21 ' HD3' ' A' ' 136' ' ' LYS . 25.5 m -73.99 -42.05 60.99 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.77 -0.372 . . . . 0.55 110.129 177.376 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.608 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -61.82 -42.18 98.71 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.609 0.719 . . . . 0.33 109.43 174.824 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 8.1 t-105 -58.48 -35.02 71.56 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 114.664 -1.153 . . . . 0.39 111.99 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 10.9 mtpp -91.36 12.99 18.68 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.301 0.482 . . . . 2.24 112.301 -173.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.419 ' ND1' ' HB2' ' A' ' 55' ' ' PHE . 15.3 t-80 -85.94 138.81 31.73 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.104 -0.332 . . . . 0.39 110.104 176.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 11.3 mm-40 -75.45 0.99 15.17 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 112.049 0.388 . . . . 1.91 112.049 -174.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.419 ' HB2' ' ND1' ' A' ' 53' ' ' HIS . 0.5 OUTLIER -111.56 -1.87 15.66 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.951 0.405 . . . . 0.93 110.638 178.238 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.449 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -100.95 16.31 25.7 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.014 0.435 . . . . 0.28 110.764 -178.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.539 ' CG ' ' HD3' ' A' ' 58' ' ' PRO . 63.7 p-90 -64.91 -36.34 16.12 Favored Pre-proline 0 CA--C 1.545 0.775 0 N-CA-C 113.742 1.016 . . . . 0.58 113.742 -174.204 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.539 ' HD3' ' CG ' ' A' ' 57' ' ' TRP . 60.5 Cg_endo -84.25 9.34 4.17 Favored 'Trans proline' 0 C--N 1.359 1.103 0 CA-C-N 120.873 1.347 . . . . 0.47 111.881 178.256 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.431 ' CZ ' HH32 ' B' ' 312' ' ' ALY . 0.3 OUTLIER -112.75 21.17 15.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.636 -0.711 . . . . 1.11 110.777 -177.978 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 18.2 m-30 -91.64 -16.68 26.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.481 -0.327 . . . . 0.63 111.482 -176.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.483 ' HB2' HD13 ' A' ' 68' ' ' LEU . 37.3 mt-30 -114.96 133.25 22.67 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 116.559 -0.291 . . . . 1.63 110.897 -173.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.618 ' HA ' ' OD1' ' A' ' 82' ' ' ASP . 27.3 Cg_endo -63.28 142.73 87.27 Favored 'Trans proline' 0 C--O 1.237 0.474 0 C-N-CA 122.539 2.16 . . . . 0.87 112.191 179.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 40.0 t -71.64 93.09 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-O 122.137 0.97 . . . . 0.88 110.466 178.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.42 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.0 OUTLIER -98.65 -3.08 36.87 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.653 -1.158 . . . . 1.85 108.978 175.272 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.42 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 81.38 -35.52 0.11 Allowed 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 114.155 -1.384 . . . . 1.29 111.703 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 42.9 mt -95.04 -48.52 12.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 120.676 0.274 . . . . 1.89 110.355 179.346 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.41 -38.04 58.09 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.736 -0.666 . . . . 2.99 112.074 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.483 HD13 ' HB2' ' A' ' 61' ' ' GLN . 6.8 tp -109.96 6.69 23.37 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.555 -0.293 . . . . 1.66 111.394 -175.459 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 59.24 51.45 6.87 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.265 0.555 . . . . 1.74 111.374 178.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 17.6 mt -126.97 71.7 75.59 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.83 -0.623 . . . . 1.61 110.402 179.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -72.47 -40.99 1.89 Allowed 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.338 2.025 . . . . 1.3 113.051 -174.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -92.41 26.29 2.66 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.31 0.576 . . . . 1.97 111.085 -176.016 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -70.04 -53.87 15.67 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.584 -0.734 . . . . 1.13 111.814 -178.855 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -73.96 4.99 4.6 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.796 -0.638 . . . . 0.91 112.252 -171.089 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 8.0 mttp -88.26 -21.82 24.27 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.591 -0.522 . . . . 2.86 109.591 179.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.502 HD13 ' CE1' ' A' ' 115' ' ' TYR . 2.7 mp -122.82 -48.33 2.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.692 -0.685 . . . . 1.0 110.443 -179.424 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.483 HD11 ' HB2' ' A' ' 115' ' ' TYR . 41.5 mm -83.26 124.42 39.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 120.898 0.38 . . . . 0.75 110.209 -179.698 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 10.9 mmtt -77.49 -44.88 27.36 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.88 -0.6 . . . . 1.99 110.903 -176.519 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 41.4 m-20 -113.39 97.76 44.34 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 116.197 -0.456 . . . . 2.05 110.284 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -75.12 79.4 2.7 Favored 'Trans proline' 0 CA--C 1.528 0.213 0 C-N-CA 122.9 2.4 . . . . 0.89 112.197 -178.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 4.0 mmt -119.25 151.57 38.17 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.281 0.562 . . . . 0.82 110.755 -177.326 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.618 ' OD1' ' HA ' ' A' ' 62' ' ' PRO . 3.2 p-10 -132.64 -112.84 0.23 Allowed 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 114.885 -1.052 . . . . 1.42 109.485 -174.094 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 2.6 ttm -131.66 -21.89 2.45 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 122.141 -0.349 . . . . 0.8 110.639 175.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -81.95 -33.08 27.74 Favored Glycine 0 N--CA 1.442 -0.902 0 N-CA-C 110.322 -1.111 . . . . 0.32 110.322 179.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -70.02 -35.08 74.07 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-O 121.134 0.492 . . . . 0.95 110.113 175.358 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 47.4 mm -56.28 -61.37 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.257 -0.883 . . . . 0.97 110.044 175.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.554 ' O ' ' HG3' ' A' ' 91' ' ' GLU . 0.3 OUTLIER -62.09 -28.68 69.79 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.428 -0.806 . . . . 1.15 111.609 -179.292 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 65.1 tttt -63.76 -42.65 97.78 Favored 'General case' 0 C--O 1.226 -0.154 0 C-N-CA 120.675 -0.41 . . . . 2.46 110.411 -179.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 6.5 mtm-85 -74.45 -24.27 59.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.93 0.395 . . . . 1.16 110.755 -177.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.481 HD11 ' SD ' ' A' ' 42' ' ' MET . 3.2 mt -75.32 -53.46 8.72 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.787 -0.642 . . . . 0.49 110.645 177.286 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.554 ' HG3' ' O ' ' A' ' 87' ' ' LYS . 13.2 mt-10 -69.56 -37.1 76.87 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.957 -0.565 . . . . 1.39 110.948 -176.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -78.55 -11.03 59.94 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.393 -0.367 . . . . 1.3 110.824 179.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 63.01 69.06 0.6 Allowed 'General case' 0 N--CA 1.462 0.172 0 O-C-N 123.844 0.715 . . . . 1.75 111.427 176.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . 0.459 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 11.4 t80 -80.1 -47.32 14.99 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.818 -0.628 . . . . 0.96 111.145 179.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -117.42 -174.23 2.57 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.958 0.408 . . . . 1.28 110.999 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . 0.498 ' CE3' ' HB2' ' A' ' 32' ' ' PRO . 1.9 t-105 -67.07 -68.4 0.38 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.368 -0.833 . . . . 1.05 112.005 -175.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 75.3 m -121.2 168.18 11.88 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.002 -0.545 . . . . 1.0 111.582 -171.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.827 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . . . -68.32 -16.87 64.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.763 -0.653 . . . . 0.66 111.352 -179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . 0.462 ' O ' ' HB2' ' A' ' 102' ' ' MET . 0.3 OUTLIER -61.15 -26.37 67.64 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.265 -0.425 . . . . 0.85 110.993 179.409 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -38.65 64.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.208 0.528 . . . . 2.44 110.147 176.595 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.438 ' HB3' ' HE1' ' A' ' 42' ' ' MET . 0.0 OUTLIER -69.47 -21.52 63.7 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.488 -0.778 . . . . 0.95 110.367 179.679 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.751 ' HE1' HG22 ' A' ' 137' ' ' VAL . 8.5 mmt -57.23 -33.26 67.36 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.021 -0.536 . . . . 1.13 110.131 175.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.414 HE21 ' HB3' ' A' ' 103' ' ' GLN . 0.3 OUTLIER -72.52 -39.66 67.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.494 -0.776 . . . . 2.96 110.039 178.945 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -70.68 -38.06 73.71 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.856 -0.611 . . . . 1.87 110.323 -178.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.608 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.1 OUTLIER -57.47 -48.53 78.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.661 -0.699 . . . . 0.38 109.919 174.26 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -59.69 -41.15 90.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.716 -0.674 . . . . 0.97 110.106 176.126 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 86.5 m -58.33 -45.97 87.11 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.672 -0.695 . . . . 0.43 111.455 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -54.47 -47.18 73.26 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.001 0.429 . . . . 0.88 110.738 176.092 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -66.19 -40.95 90.79 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.813 -0.631 . . . . 0.29 111.23 -177.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.82 -43.07 80.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.742 0.306 . . . . 0.66 110.247 178.457 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -49.85 -48.56 51.04 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.651 -0.704 . . . . 1.84 110.669 176.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . 0.428 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 1.5 t -62.48 -41.05 98.52 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.186 -0.461 . . . . 0.63 110.859 178.351 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.452 ' HD1' HG22 ' A' ' 123' ' ' VAL . 12.1 m-85 -70.79 -27.11 63.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.413 -0.358 . . . . 0.81 111.625 -177.61 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 59.4 mt -85.22 -50.15 14.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-O 120.779 0.323 . . . . 0.55 111.395 -177.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.502 ' CE1' HD13 ' A' ' 76' ' ' ILE . 1.1 t80 -86.25 36.25 0.68 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.416 0.627 . . . . 1.22 111.738 -174.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . 0.428 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 51.6 m-80 -157.59 -172.85 4.13 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.142 -0.936 . . . . 1.04 109.703 -179.078 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 2.5 mttp -96.39 150.06 36.64 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 109.539 -0.541 . . . . 3.47 109.539 174.276 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -59.68 -19.97 55.96 Favored 'Trans proline' 0 N--CA 1.475 0.389 0 C-N-CA 122.564 2.176 . . . . 0.96 112.798 -179.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -118.67 30.7 7.05 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.913 -0.585 . . . . 1.23 110.618 177.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.429 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 1.5 t0 -84.24 173.36 11.06 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.055 0.455 . . . . 1.34 111.886 -175.425 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . 0.421 ' HB2' ' HA ' ' B' ' 314' ' ' LYS . 1.3 t0 -67.23 -56.66 8.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.267 -0.879 . . . . 1.44 111.736 -173.195 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.437 ' O ' HG13 ' A' ' 122' ' ' ILE . 1.0 OUTLIER -69.17 -29.37 42.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 120.978 0.418 . . . . 0.42 110.542 -179.546 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.452 HG22 ' HD1' ' A' ' 113' ' ' TYR . 2.1 t -64.44 -43.62 96.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.268 -0.424 . . . . 0.35 110.178 177.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.0 mt -56.28 -35.69 67.76 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 115.628 -0.715 . . . . 0.52 109.817 176.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . 0.467 ' O ' HD13 ' A' ' 129' ' ' LEU . 30.7 mtt -73.38 -43.81 59.85 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 115.015 -0.993 . . . . 0.62 110.654 -178.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -55.1 -36.57 65.83 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.831 0.348 . . . . 0.31 111.048 178.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.53 -44.36 97.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.865 -0.607 . . . . 1.94 111.211 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.44 -35.29 60.96 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.082 0.468 . . . . 0.32 110.474 178.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.467 HD13 ' O ' ' A' ' 125' ' ' MET . 1.8 mp -62.27 -44.98 95.3 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.532 -0.758 . . . . 0.33 110.914 179.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -70.8 -22.28 62.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.48 -0.327 . . . . 1.47 111.727 -176.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 37.2 mttm -70.34 -41.73 72.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.812 0.339 . . . . 2.24 110.126 -177.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 129' ' ' LEU . 1.6 pt -79.88 -21.24 12.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.401 -0.363 . . . . 1.23 110.332 176.221 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.559 ' O ' HG23 ' A' ' 137' ' ' VAL . 25.1 t80 -61.58 -61.79 2.27 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.224 -0.444 . . . . 0.46 110.258 173.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.4 pp -64.38 -25.29 67.96 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 121.028 0.442 . . . . 0.64 110.462 -177.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.459 ' HB2' ' HA ' ' A' ' 132' ' ' ILE . 0.0 OUTLIER -55.75 -47.71 76.5 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.395 -0.82 . . . . 1.61 111.117 176.373 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . 0.691 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -82.44 -24.27 34.38 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.939 -0.573 . . . . 1.52 110.786 -178.112 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.751 HG22 ' HE1' ' A' ' 102' ' ' MET . 95.6 t -66.61 -35.87 75.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 121.299 0.571 . . . . 0.35 110.066 176.46 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -67.97 -17.58 64.48 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.808 -0.633 . . . . 0.5 110.606 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -101.82 3.82 39.73 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-N 115.969 -0.559 . . . . 1.76 110.811 178.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . 0.472 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 24.0 mtp -72.84 146.07 87.45 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 116.343 -0.39 . . . . 0.86 109.973 175.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -68.1 116.29 4.25 Favored 'Trans proline' 0 N--CA 1.464 -0.255 0 C-N-CA 122.409 2.073 . . . . 0.67 112.291 -178.461 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -78.01 15.05 0.96 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.273 0.559 . . . . 2.91 110.615 177.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -99.74 -47.82 4.93 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-N 115.731 -0.668 . . . . 2.7 110.186 -178.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 61.99 89.13 0.08 Allowed 'General case' 0 C--O 1.237 0.395 0 CA-C-N 115.015 -0.993 . . . . 2.34 110.41 -174.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . 0.572 ' O ' ' HB3' ' A' ' 37' ' ' ASN . 2.8 t -104.4 115.3 46.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.461 -0.791 . . . . 0.99 109.654 178.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.695 ' HG3' HG22 ' A' ' 36' ' ' THR . 3.8 tt0 -68.4 147.15 52.48 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.546 -0.297 . . . . 1.53 110.887 -177.867 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 12.1 mt . . . . . 0 C--O 1.248 0.989 0 CA-C-O 118.186 -0.912 . . . . 1.57 110.922 -177.705 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.705 0 N-CA-C 111.551 -0.619 . . . . 2.17 111.551 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 312' ' ' ALY . . . . . 0.431 HH32 ' CZ ' ' A' ' 59' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 83.06 -138.41 17.92 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.849 -0.691 . . . . 1.97 111.994 -179.566 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 314' ' ' LYS . . . . . 0.421 ' HA ' ' HB2' ' A' ' 121' ' ' ASP . 0.0 OUTLIER -88.97 138.33 31.5 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.968 0.413 . . . . 3.58 110.337 178.72 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.87 -0.586 . . . . 4.6 109.471 178.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo . . . . . 0 N--CA 1.479 0.64 0 N-CA-C 110.7 -0.539 . . . . 6.18 110.7 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -121.61 136.69 54.94 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.505 -0.554 . . . . 5.71 109.505 178.46 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 68.22 59.46 6.31 Favored Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 120.879 -0.677 . . . . 3.45 112.485 -178.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 26.6 p -69.61 172.92 6.65 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 110.495 -0.187 . . . . 2.44 110.495 177.453 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.58 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 5.2 mt-10 -49.75 116.36 1.75 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.357 0.598 . . . . 1.64 112.449 -178.687 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 2.2 p -103.7 -13.6 8.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 115.263 -0.88 . . . . 0.93 109.956 178.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.6 m -165.78 147.59 7.21 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.31 -0.859 . . . . 1.61 109.415 179.288 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.524 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 23.0 t-20 -148.83 125.99 5.53 Favored Pre-proline 0 C--N 1.317 -0.824 0 CA-C-N 115.972 -0.558 . . . . 1.6 109.605 177.789 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -66.44 -43.32 8.23 Favored 'Trans proline' 0 N--CA 1.474 0.374 0 C-N-CA 123.375 2.717 . . . . 1.87 113.282 -175.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 2.0 m -75.4 -26.53 58.5 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-O 121.451 0.643 . . . . 2.18 110.468 -176.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.524 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 11.1 tttm -82.77 121.93 77.99 Favored Pre-proline 0 C--N 1.318 -0.775 0 CA-C-N 115.179 -0.918 . . . . 2.75 109.985 178.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.466 ' HB2' ' CZ3' ' A' ' 96' ' ' TRP . 23.1 Cg_endo -64.96 132.33 31.86 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.027 1.818 . . . . 1.38 112.116 -179.898 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -138.38 77.7 0.33 Allowed Glycine 0 N--CA 1.445 -0.707 0 CA-C-N 115.119 -0.946 . . . . 0.97 110.947 -178.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -85.98 148.96 25.51 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.02 0.438 . . . . 1.93 111.08 -173.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -87.79 102.56 14.78 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.955 -0.566 . . . . 2.64 110.045 176.274 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.587 HG22 ' HG3' ' A' ' 146' ' ' GLU . 1.3 p -110.51 167.23 10.37 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.911 0.386 . . . . 0.68 111.004 176.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.415 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 62.3 t30 -63.12 -39.92 96.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.806 -0.634 . . . . 1.47 111.264 -179.096 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.404 ' O ' ' HB3' ' A' ' 41' ' ' TYR . 9.2 tt0 -64.6 -42.86 95.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.559 -0.291 . . . . 1.04 110.521 178.262 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.479 ' O ' ' HG2' ' A' ' 43' ' ' GLN . 0.5 OUTLIER -59.01 -52.31 66.3 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.272 -0.422 . . . . 0.8 110.641 -179.754 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.442 ' O ' ' HG3' ' A' ' 43' ' ' GLN . 1.4 mt-30 -70.1 -19.98 63.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.04 -0.527 . . . . 1.75 111.186 -179.586 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.415 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 57.2 t80 -64.83 -63.34 1.14 Allowed 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.966 -0.561 . . . . 0.64 111.307 178.299 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.54 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -58.84 -34.84 72.02 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 111.879 0.326 . . . . 1.13 111.879 -170.922 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' A' ' 39' ' ' LEU . 0.5 OUTLIER -63.81 -49.59 72.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.208 0.528 . . . . 1.3 110.398 -176.192 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -85.46 -29.89 23.95 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.894 -0.594 . . . . 0.5 111.943 -177.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 87.8 t -89.37 -58.54 3.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 112.491 0.552 . . . . 0.3 112.491 -177.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.603 HG22 ' HB3' ' A' ' 136' ' ' LYS . 43.8 t -78.4 -66.06 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 120.645 0.26 . . . . 0.26 111.305 -172.055 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.491 HG13 ' O ' ' A' ' 42' ' ' MET . 2.0 m -64.17 -33.75 64.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.366 -0.379 . . . . 0.83 111.8 -173.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.5 mttp -69.5 -31.98 70.57 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.848 -0.341 . . . . 2.4 111.467 -178.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 25.1 m -77.22 -38.57 51.0 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.785 -0.366 . . . . 0.55 110.386 177.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.666 HD23 HD12 ' A' ' 132' ' ' ILE . 0.0 OUTLIER -64.43 -35.72 81.84 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 109.409 -0.589 . . . . 0.33 109.409 175.132 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 13.7 t-105 -62.79 -34.2 76.77 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.635 -0.711 . . . . 0.39 111.209 178.049 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.5 mttt -84.28 5.68 25.79 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.944 -0.302 . . . . 2.24 111.763 -175.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.481 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 14.3 t-80 -84.96 134.17 34.25 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.57 -0.53 . . . . 0.39 109.57 175.379 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -85.19 12.41 7.99 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.827 0.346 . . . . 1.91 111.829 -173.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.481 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.6 OUTLIER -111.97 -1.08 15.54 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.338 0.59 . . . . 0.93 109.42 172.364 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.65 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -100.9 20.21 15.83 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.647 -0.706 . . . . 0.28 110.534 179.45 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.559 ' CG ' ' HD3' ' A' ' 58' ' ' PRO . 40.5 p-90 -73.13 -35.41 2.76 Favored Pre-proline 0 CA--C 1.541 0.623 0 N-CA-C 113.025 0.75 . . . . 0.58 113.025 -175.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.559 ' HD3' ' CG ' ' A' ' 57' ' ' TRP . 2.9 Cg_exo -75.82 -1.13 11.01 Favored 'Trans proline' 0 C--N 1.361 1.208 0 C-N-CA 121.475 1.45 . . . . 0.47 110.703 174.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 13.3 m-85 -102.98 -7.95 21.03 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 114.778 -1.101 . . . . 1.11 110.537 -178.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 9.0 m-30 -65.35 -50.67 64.71 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.947 -0.57 . . . . 0.63 111.365 -176.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -85.15 127.33 64.61 Favored Pre-proline 0 C--N 1.32 -0.686 0 CA-C-N 115.425 -0.807 . . . . 1.63 110.549 -174.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.61 ' HA ' ' CG ' ' A' ' 82' ' ' ASP . 37.8 Cg_endo -67.94 150.07 77.93 Favored 'Trans proline' 0 C--O 1.237 0.469 0 C-N-CA 122.766 2.311 . . . . 0.87 112.799 -177.355 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 4.0 t -72.02 97.97 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 122.19 0.995 . . . . 0.88 109.958 175.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -109.44 13.47 24.08 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.524 -1.217 . . . . 1.85 109.385 176.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.506 ' HB2' ' NE2' ' A' ' 74' ' ' HIS . . . 65.71 -73.77 0.06 Allowed 'General case' 0 C--O 1.225 -0.22 0 CA-C-N 114.791 -1.095 . . . . 1.29 111.453 -175.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.5 mt -65.5 -39.91 86.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 120.8 0.333 . . . . 1.89 111.282 -174.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.1 -29.1 68.37 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.021 -0.536 . . . . 2.99 112.176 -177.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.446 HD13 ' HA ' ' A' ' 68' ' ' LEU . 0.2 OUTLIER -120.18 7.11 10.75 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.941 -0.304 . . . . 1.66 111.785 -176.47 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 66.1 t30 61.84 48.82 5.14 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.292 0.568 . . . . 1.74 111.04 -179.428 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 5.3 mt -126.04 71.4 69.18 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 116.047 -0.524 . . . . 1.61 111.673 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -75.7 -27.62 8.76 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 121.928 1.752 . . . . 1.3 111.83 176.183 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.0 -4.97 59.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.257 -0.429 . . . . 1.97 110.882 -179.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -59.53 -49.6 77.16 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.805 -0.634 . . . . 1.13 110.494 179.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.557 ' HD1' ' HG3' ' A' ' 80' ' ' PRO . 72.1 m-70 -77.98 8.28 4.93 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.51 -0.768 . . . . 0.91 111.457 -175.311 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 24.3 mttt -99.3 -19.96 16.79 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.453 0.644 . . . . 2.86 109.595 177.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.0 mt -114.93 -50.31 4.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.731 -0.668 . . . . 1.0 109.99 177.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 24.0 mm -95.48 103.38 14.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.826 -0.625 . . . . 0.75 109.767 179.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.0 mttt -83.08 -11.78 57.7 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.954 -0.567 . . . . 1.99 110.48 -178.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 16.1 m-80 -123.93 73.05 55.0 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.67 -0.696 . . . . 2.05 109.756 174.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.557 ' HG3' ' HD1' ' A' ' 74' ' ' HIS . 73.4 Cg_endo -80.76 102.15 1.36 Allowed 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.534 2.156 . . . . 0.89 112.759 -175.053 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 7.5 mmt -130.64 152.93 49.47 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.953 -0.567 . . . . 0.82 110.292 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.61 ' CG ' ' HA ' ' A' ' 62' ' ' PRO . 1.1 p30 -139.36 -116.23 0.14 Allowed 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.061 -0.972 . . . . 1.42 109.607 -174.603 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -125.22 -27.09 3.55 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.053 0.454 . . . . 0.8 110.189 177.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.505 ' O ' ' HG3' ' A' ' 88' ' ' LYS . . . -84.28 -31.75 24.55 Favored Glycine 0 N--CA 1.441 -0.999 0 N-CA-C 110.799 -0.92 . . . . 0.32 110.799 -177.712 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -70.51 -40.85 73.29 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.928 0.394 . . . . 0.95 110.503 177.264 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.542 HG23 ' SG ' ' A' ' 101' ' ' CYS . 34.7 mt -63.81 -42.51 96.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.657 -0.701 . . . . 0.97 109.938 176.047 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.87 -33.14 72.62 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.034 -0.53 . . . . 1.15 111.147 178.081 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' A' ' 84' ' ' GLY . 35.8 mttt -62.09 -50.48 71.76 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-O 121.115 0.483 . . . . 2.46 110.628 179.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 16.3 mtp180 -69.69 -32.93 71.81 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.676 -0.693 . . . . 1.16 111.415 -176.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 8.7 mt -66.53 -54.34 24.89 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.175 -0.466 . . . . 0.49 111.316 -179.556 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -69.59 -23.33 63.52 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.258 -0.428 . . . . 1.39 111.642 -175.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.424 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 0.5 OUTLIER -89.37 -2.46 58.43 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.653 -0.249 . . . . 1.3 110.895 -179.01 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 59.73 54.41 4.43 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.242 0.544 . . . . 1.75 111.164 -179.345 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . 0.58 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 78.0 t80 -80.35 -27.33 38.32 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.056 -0.52 . . . . 0.96 110.54 178.402 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.655 ' CD1' ' HB3' ' A' ' 100' ' ' GLU . 8.2 m-85 -96.88 178.32 5.33 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-O 121.844 0.831 . . . . 1.28 111.432 -178.496 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . 0.466 ' CZ3' ' HB2' ' A' ' 32' ' ' PRO . 2.2 t-105 -94.19 -56.12 2.95 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 113.703 -1.589 . . . . 1.05 108.872 170.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 67.3 m -129.19 167.98 16.83 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 114.919 -1.037 . . . . 1.0 109.597 -177.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -70.79 -12.29 61.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.774 0.321 . . . . 0.66 111.647 -177.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -21.49 66.31 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.068 -0.515 . . . . 0.85 110.591 177.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.655 ' HB3' ' CD1' ' A' ' 95' ' ' TYR . 2.0 tt0 -77.03 -33.22 57.41 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 116.054 -0.521 . . . . 2.44 109.922 179.445 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.542 ' SG ' HG23 ' A' ' 86' ' ' ILE . 0.1 OUTLIER -75.81 -22.08 56.7 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.383 -0.826 . . . . 0.95 110.724 -177.446 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 5.0 ttm -59.01 -30.95 68.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.084 -0.507 . . . . 1.13 110.454 178.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.07 -43.26 74.95 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.674 -0.694 . . . . 2.96 110.115 178.071 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -67.87 -43.39 79.51 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.756 -0.656 . . . . 1.87 110.82 -177.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.549 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.7 OUTLIER -60.42 -44.4 95.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.101 -0.5 . . . . 0.38 110.445 178.055 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 39.4 t30 -60.7 -39.64 89.29 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.048 -0.524 . . . . 0.97 110.301 177.438 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 85.3 m -68.53 -44.16 75.16 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.563 -0.744 . . . . 0.43 111.463 179.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.09 -44.09 70.91 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.174 -0.466 . . . . 0.88 111.08 178.29 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -70.3 -43.83 69.57 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.12 -0.491 . . . . 0.29 111.026 -177.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -66.33 -37.26 84.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.813 0.34 . . . . 0.66 110.665 -178.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -50.27 -51.58 43.59 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.481 -0.781 . . . . 1.84 110.901 176.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 2.0 t -60.86 -36.43 79.13 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.548 -0.296 . . . . 0.63 111.194 178.121 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -69.79 -27.65 65.08 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.434 -0.348 . . . . 0.81 111.536 -177.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 29.0 mt -92.13 -51.05 12.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.923 0.392 . . . . 0.55 111.618 -176.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -67.39 -38.25 84.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.28 0.562 . . . . 1.22 110.726 -177.152 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 38.8 m-20 -101.7 -172.12 2.1 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.88 -0.6 . . . . 1.04 109.669 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -123.31 147.28 51.82 Favored Pre-proline 0 C--N 1.32 -0.681 0 N-CA-C 110.213 -0.292 . . . . 3.47 110.213 -179.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . 0.821 ' HA ' HG11 ' A' ' 123' ' ' VAL . 52.0 Cg_exo -57.7 -20.13 41.29 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 123.013 2.475 . . . . 0.96 112.86 -179.452 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.0 21.11 2.83 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.802 -0.635 . . . . 1.23 111.687 -179.711 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.582 ' OD1' ' HA ' ' B' ' 314' ' ' LYS . 4.4 t70 -118.5 165.73 13.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.166 0.508 . . . . 1.34 111.763 177.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . 0.419 ' HB2' ' O ' ' B' ' 315' ' ' ALY . 0.1 OUTLIER -67.49 -36.25 80.74 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.052 -0.976 . . . . 1.44 110.588 -179.683 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 1.1 tp -61.03 -40.56 86.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.184 0 CA-C-N 116.491 -0.322 . . . . 0.42 111.312 -177.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.821 HG11 ' HA ' ' A' ' 118' ' ' PRO . 2.2 t -70.18 -39.6 77.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 C-N-CA 120.57 -0.452 . . . . 0.35 110.011 177.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.0 -35.34 74.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.857 -0.61 . . . . 0.52 109.409 178.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . 0.43 ' O ' HD13 ' A' ' 129' ' ' LEU . 38.0 mtt -68.67 -50.46 50.91 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.038 -0.983 . . . . 0.62 110.613 176.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -55.05 -38.57 68.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.361 -0.381 . . . . 0.31 111.106 179.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -60.35 -41.05 92.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.895 -0.593 . . . . 1.94 111.193 178.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -77.93 -39.17 43.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.997 0.427 . . . . 0.32 110.505 179.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.65 HD21 ' HA ' ' A' ' 56' ' ' ALA . 1.9 mp -58.99 -40.56 85.21 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.605 -0.725 . . . . 0.33 110.444 179.02 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -57.64 -29.71 64.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.294 -0.866 . . . . 1.47 111.996 -178.033 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.506 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -63.29 -39.34 94.32 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.829 0.347 . . . . 2.24 110.328 -176.778 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.666 HD12 HD23 ' A' ' 50' ' ' LEU . 11.1 mt -70.07 -28.31 35.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.981 -0.554 . . . . 1.23 110.851 -178.519 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.428 ' O ' HG23 ' A' ' 137' ' ' VAL . 26.9 t80 -62.48 -63.06 1.34 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.118 -0.492 . . . . 0.46 110.779 -179.374 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . 0.445 ' HG ' ' H ' ' A' ' 134' ' ' LEU . 0.0 OUTLIER -65.46 -26.53 67.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.172 0.511 . . . . 0.64 110.422 -179.102 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.506 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.94 -41.96 97.28 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.538 -0.756 . . . . 1.61 111.281 179.353 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . 0.603 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -92.82 -24.91 18.35 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.246 -0.434 . . . . 1.52 110.897 -177.41 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 133' ' ' PHE . 37.1 t -70.73 -33.64 53.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.316 -0.402 . . . . 0.35 110.833 -179.749 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -69.3 -12.55 61.76 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.13 0.491 . . . . 0.5 110.759 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 3.0 mm-40 -103.98 0.0 29.43 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.999 -0.546 . . . . 1.76 110.695 178.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . 0.408 ' HB2' ' O ' ' A' ' 137' ' ' VAL . 0.0 OUTLIER -59.89 146.84 80.88 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.109 -0.496 . . . . 0.86 110.812 178.465 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -74.47 94.61 0.92 Allowed 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 121.985 1.79 . . . . 0.67 111.034 178.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 8.9 mm-40 -84.77 31.86 0.53 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.456 0.646 . . . . 2.91 111.26 -175.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -116.41 -35.67 4.22 Favored 'General case' 0 N--CA 1.435 -1.22 0 CA-C-N 114.901 -1.045 . . . . 2.7 108.508 173.445 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 74.18 138.37 0.06 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 113.882 -1.508 . . . . 2.34 111.468 177.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 45.3 t -144.32 102.27 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.185 -0.916 . . . . 0.99 109.831 -177.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.587 ' HG3' HG22 ' A' ' 36' ' ' THR . 1.0 OUTLIER -67.15 138.29 56.92 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.665 -0.495 . . . . 1.53 109.665 176.576 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 6.5 mt . . . . . 0 C--O 1.251 1.135 0 CA-C-O 118.524 -0.75 . . . . 1.57 110.745 -176.786 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.777 0 N-CA-C 112.254 -0.338 . . . . 2.17 112.254 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 128.13 -22.02 5.42 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 120.669 -0.776 . . . . 1.97 111.578 -178.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 314' ' ' LYS . . . . . 0.582 ' HA ' ' OD1' ' A' ' 120' ' ' ASP . 0.1 OUTLIER -146.67 94.5 2.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.97 0.414 . . . . 3.58 109.967 176.949 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 315' ' ' ALY . . . . . 0.419 ' O ' ' HB2' ' A' ' 121' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 3.5 ptmt . . . . . 0 C--O 1.246 0.896 0 CA-C-O 118.667 -0.682 . . . . 4.6 109.493 177.707 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo . . . . . 0 N--CA 1.477 0.523 0 N-CA-C 110.285 -0.698 . . . . 6.18 110.285 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -125.66 141.14 52.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.599 -0.273 . . . . 5.71 110.353 179.153 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.69 -80.83 1.79 Allowed Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.916 -0.659 . . . . 3.45 112.378 177.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -145.41 155.12 42.95 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 110.034 -0.358 . . . . 2.44 110.034 -178.108 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.649 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 4.9 mt-10 -50.44 118.81 3.25 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 123.548 0.53 . . . . 1.64 111.533 176.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 1.2 p -98.36 -17.4 6.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-O 121.671 0.748 . . . . 0.93 108.991 177.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 54.0 m -167.42 146.55 5.02 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.425 -1.261 . . . . 1.61 108.745 178.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.528 ' HB3' ' HB3' ' A' ' 31' ' ' LYS . 18.4 t-20 -135.49 129.72 18.69 Favored Pre-proline 0 C--N 1.317 -0.82 0 N-CA-C 108.879 -0.785 . . . . 1.6 108.879 176.709 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -59.79 -48.5 12.55 Favored 'Trans proline' 0 N--CA 1.472 0.264 0 C-N-CA 123.368 2.712 . . . . 1.87 113.361 -174.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 5.7 m -81.83 -28.31 33.16 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.854 0.359 . . . . 2.18 111.337 -174.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.528 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 0.4 OUTLIER -77.38 116.58 58.95 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.106 -0.497 . . . . 2.75 110.387 178.708 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.473 ' HB2' ' CZ3' ' A' ' 96' ' ' TRP . 6.8 Cg_exo -71.53 151.51 58.97 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.224 1.949 . . . . 1.38 112.18 179.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -148.66 77.69 0.23 Allowed Glycine 0 N--CA 1.444 -0.793 0 CA-C-N 115.345 -0.843 . . . . 0.97 111.111 178.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 21.3 mtm-85 -80.32 132.77 35.86 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.699 0.285 . . . . 1.93 110.247 -177.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -72.1 109.97 6.25 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.211 -0.449 . . . . 2.64 110.285 -177.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.963 HG22 ' HG3' ' A' ' 146' ' ' GLU . 5.3 p -107.81 166.86 10.38 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.661 -0.416 . . . . 0.68 110.513 177.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 34.2 t30 -60.26 -43.92 95.73 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 116.22 -0.446 . . . . 1.47 110.739 -179.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -58.53 -40.19 82.27 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.658 0.266 . . . . 1.04 110.973 -179.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.43 ' HB2' ' HA ' ' A' ' 97' ' ' SER . 0.6 OUTLIER -62.62 -57.57 10.6 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.081 -0.509 . . . . 0.8 110.956 -179.164 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 5.8 mm-40 -65.85 -29.61 70.1 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 115.986 -0.552 . . . . 1.75 110.848 -179.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 53.0 t80 -59.04 -63.89 1.14 Allowed 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.904 -0.589 . . . . 0.64 110.48 177.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.566 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -58.73 -33.77 70.6 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 121.124 -0.23 . . . . 1.13 110.755 -174.896 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -57.57 -55.38 35.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.006 0.431 . . . . 1.3 110.885 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 51.3 m-80 -85.99 -29.93 23.12 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.067 -0.515 . . . . 0.5 111.805 -176.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 99.1 t -88.4 -56.89 4.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 N-CA-C 112.284 0.476 . . . . 0.3 112.284 -174.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.704 HG22 ' HB3' ' A' ' 136' ' ' LYS . 41.5 t -82.22 -66.57 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 111.814 0.301 . . . . 0.26 111.814 -172.096 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.447 HG13 ' O ' ' A' ' 42' ' ' MET . 1.3 m -63.37 -34.62 68.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 N-CA-C 111.604 0.224 . . . . 0.83 111.604 -173.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.35 -36.26 81.04 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.752 -0.379 . . . . 2.4 111.496 -179.301 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.4 m -76.06 -36.77 58.89 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.782 -0.367 . . . . 0.55 110.467 177.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.601 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -62.13 -42.48 99.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.29 0.566 . . . . 0.33 109.547 174.451 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 22.1 t-105 -55.91 -36.14 67.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.984 -1.007 . . . . 0.39 111.292 178.215 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 9.8 mmtp -90.57 22.02 3.68 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 112.445 0.535 . . . . 2.24 112.445 -172.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 34.3 t-80 -88.57 148.25 24.19 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 110.077 -0.342 . . . . 0.39 110.077 174.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -73.25 -16.15 61.41 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.315 -0.402 . . . . 1.91 111.931 -175.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 19.1 m-30 -106.72 3.24 26.44 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.924 0.392 . . . . 0.93 110.764 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.664 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -92.43 5.45 50.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.136 0.493 . . . . 0.28 111.003 -178.143 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.525 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 56.3 p-90 -63.84 -36.0 18.94 Favored Pre-proline 0 CA--C 1.548 0.897 0 N-CA-C 114.214 1.19 . . . . 0.58 114.214 -173.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.525 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 19.4 Cg_endo -79.99 -9.6 14.18 Favored 'Trans proline' 0 C--N 1.359 1.097 0 CA-C-N 121.407 1.538 . . . . 0.47 112.289 -178.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -98.19 9.09 43.77 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.058 -0.519 . . . . 1.11 110.347 -179.349 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 5.3 m-30 -70.96 -37.37 72.78 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.751 -0.659 . . . . 0.63 111.36 -178.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -101.95 134.36 20.15 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.898 -0.592 . . . . 1.63 110.846 -172.497 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.65 ' HA ' ' OD1' ' A' ' 82' ' ' ASP . 34.8 Cg_exo -57.62 147.73 77.7 Favored 'Trans proline' 0 C--O 1.239 0.54 0 C-N-CA 122.674 2.249 . . . . 0.87 112.099 176.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 3.8 t -68.19 106.67 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-O 121.785 0.802 . . . . 0.88 111.307 -178.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -114.92 130.19 56.86 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.716 -1.129 . . . . 1.85 108.071 168.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -71.17 -2.17 14.97 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 112.265 0.468 . . . . 1.29 112.265 -171.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 12.1 mt -113.74 -52.0 5.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.495 0.188 . . . . 1.89 111.012 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.6 tttp -59.37 -51.06 71.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.929 0.395 . . . . 2.99 111.211 -179.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.25 -7.83 50.12 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.25 -0.432 . . . . 1.66 110.298 179.252 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 56.51 63.26 2.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.267 -0.879 . . . . 1.74 110.667 -176.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.425 HD12 ' HA ' ' A' ' 70' ' ' LEU . 0.3 OUTLIER -114.62 72.02 2.56 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 115.542 -0.754 . . . . 1.61 109.804 178.315 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -77.85 -51.09 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.467 2.111 . . . . 1.3 112.979 -173.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -72.87 -13.07 61.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.369 0.604 . . . . 1.97 110.538 -178.244 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -58.98 -39.99 83.44 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.084 -0.962 . . . . 1.13 110.899 178.529 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 2.4 m-70 -75.27 -2.42 28.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.691 -0.686 . . . . 0.91 111.755 -175.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -104.59 -53.59 2.67 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.072 0.463 . . . . 2.86 110.443 -177.265 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.1 mp -76.55 -38.82 32.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.733 -0.667 . . . . 1.0 110.752 -177.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.474 HD11 ' HB2' ' A' ' 115' ' ' TYR . 47.8 mm -94.51 125.77 47.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 109.941 -0.392 . . . . 0.75 109.941 179.355 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.68 -28.24 33.61 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.278 -0.419 . . . . 1.99 111.128 -175.39 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 18.9 m-80 -132.83 81.07 59.38 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.433 -0.349 . . . . 2.05 110.431 178.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -68.65 95.34 0.46 Allowed 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 123.028 2.485 . . . . 0.89 111.863 179.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 5.8 mmt -127.46 160.82 30.31 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-O 121.39 0.614 . . . . 0.82 110.313 -178.364 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.65 ' OD1' ' HA ' ' A' ' 62' ' ' PRO . 2.5 p-10 -136.62 -134.27 0.14 Allowed 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 114.65 -1.159 . . . . 1.42 109.61 -170.472 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -123.36 -14.75 7.35 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.172 0.511 . . . . 0.8 109.849 -177.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -89.54 -32.39 10.34 Favored Glycine 0 N--CA 1.442 -0.916 0 N-CA-C 109.65 -1.38 . . . . 0.32 109.65 -179.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 94.5 m -67.19 -42.33 84.36 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 114.916 -0.642 . . . . 0.95 110.823 174.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 43.4 mt -62.22 -45.79 97.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.031 0.443 . . . . 0.97 110.116 177.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.491 ' HG3' ' N ' ' A' ' 88' ' ' LYS . 0.0 OUTLIER -64.81 -31.66 72.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.133 -0.485 . . . . 1.15 110.712 178.316 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.491 ' N ' ' HG3' ' A' ' 87' ' ' LYS . 16.5 tttp -63.62 -43.31 97.21 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 121.278 0.561 . . . . 2.46 110.755 179.232 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 10.2 mtp180 -76.22 -31.03 58.17 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.812 -0.631 . . . . 1.16 111.1 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 4.5 mt -64.8 -51.46 62.05 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.028 -0.533 . . . . 0.49 111.011 177.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -66.83 -31.25 71.74 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.873 -0.603 . . . . 1.39 111.597 -177.109 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -92.68 5.08 52.35 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.923 -0.311 . . . . 1.3 111.455 -177.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 60.41 55.13 3.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.906 -0.588 . . . . 1.75 111.8 175.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . 0.649 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 63.4 t80 -82.08 -22.39 36.32 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.338 0.59 . . . . 0.96 110.133 175.509 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . 0.6 ' CD1' ' HB3' ' A' ' 100' ' ' GLU . 46.5 m-85 -99.02 169.52 9.36 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.723 0.773 . . . . 1.28 112.151 -174.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . 0.473 ' CZ3' ' HB2' ' A' ' 32' ' ' PRO . 2.0 t90 -96.72 -38.1 10.04 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-N 113.994 -1.457 . . . . 1.05 108.688 169.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.43 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 8.6 t -155.88 168.54 26.88 Favored 'General case' 0 N--CA 1.442 -0.827 0 CA-C-N 115.544 -0.753 . . . . 1.0 110.166 -175.711 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -72.67 -9.4 58.58 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.481 -0.327 . . . . 0.66 111.634 -175.322 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.15 -21.76 65.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.1 0.476 . . . . 0.85 109.89 175.094 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.6 ' HB3' ' CD1' ' A' ' 95' ' ' TYR . 1.0 OUTLIER -78.16 -42.57 31.27 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 108.757 -0.831 . . . . 2.44 108.757 175.341 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 29.9 m -61.91 -34.84 76.79 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.054 -0.975 . . . . 0.95 110.627 177.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 3.2 ttm -58.35 -35.27 71.68 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.604 -0.725 . . . . 1.13 110.582 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -70.73 -41.21 72.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.884 -0.598 . . . . 2.96 110.123 179.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 75.0 m-20 -68.83 -43.73 74.91 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.753 -0.658 . . . . 1.87 110.47 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.601 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.6 OUTLIER -58.31 -46.04 86.89 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.026 -0.534 . . . . 0.38 110.058 176.421 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 14.6 t30 -56.71 -45.25 81.98 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.682 -0.69 . . . . 0.97 110.018 176.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 91.4 m -64.77 -45.99 84.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.974 -0.557 . . . . 0.43 111.504 179.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.06 -42.68 77.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.85 0.357 . . . . 0.88 110.66 178.233 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -72.89 -50.31 24.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.021 -0.536 . . . . 0.29 110.526 -178.013 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . 0.41 ' O ' HG13 ' A' ' 114' ' ' ILE . 5.0 p -59.86 -35.98 75.91 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 116.373 -0.376 . . . . 0.66 111.047 -178.175 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -52.65 -42.9 65.1 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.136 -0.484 . . . . 1.84 110.679 178.571 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . 0.611 ' O ' ' HB2' ' A' ' 116' ' ' ASN . 0.0 OUTLIER -73.81 -26.9 60.85 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.869 -0.605 . . . . 0.63 110.875 -179.207 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -85.47 -15.87 41.49 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.862 0.363 . . . . 0.81 111.194 -179.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.41 HG13 ' O ' ' A' ' 110' ' ' THR . 70.0 mt -89.19 -57.66 4.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.211 -0.45 . . . . 0.55 110.744 178.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . 0.474 ' HB2' HD11 ' A' ' 77' ' ' ILE . 45.4 t80 -67.55 -51.59 48.87 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.853 -0.612 . . . . 1.22 110.563 -176.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . 0.611 ' HB2' ' O ' ' A' ' 112' ' ' CYS . 28.6 m120 -79.59 176.3 9.83 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.592 -0.731 . . . . 1.04 110.707 -178.194 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.422 ' O ' ' HB2' ' A' ' 120' ' ' ASP . 0.0 OUTLIER -101.1 153.24 37.87 Favored Pre-proline 0 C--N 1.321 -0.654 0 N-CA-C 109.329 -0.619 . . . . 3.47 109.329 177.786 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . 0.583 ' HA ' HG11 ' A' ' 123' ' ' VAL . 28.7 Cg_endo -64.44 2.74 1.06 Allowed 'Trans proline' 0 CA--C 1.535 0.548 0 C-N-CA 122.584 2.189 . . . . 0.96 112.686 178.168 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.31 5.03 13.51 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.165 -0.47 . . . . 1.23 110.609 177.299 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.422 ' HB2' ' O ' ' A' ' 117' ' ' LYS . 0.9 OUTLIER -75.5 164.08 26.73 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.215 0.531 . . . . 1.34 111.923 -173.407 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.7 -55.52 22.74 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.994 -1.003 . . . . 1.44 110.603 -178.134 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.406 ' H ' HG22 ' A' ' 122' ' ' ILE . 0.9 OUTLIER -62.78 -34.48 65.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.569 -0.741 . . . . 0.42 111.114 -179.627 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.583 HG11 ' HA ' ' A' ' 118' ' ' PRO . 1.5 t -64.75 -40.07 87.8 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-O 121.004 0.431 . . . . 0.35 110.312 178.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.1 -29.39 68.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.292 0.567 . . . . 0.52 110.055 176.736 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . 0.44 ' O ' HD13 ' A' ' 129' ' ' LEU . 10.4 mtt -80.4 -48.04 13.5 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.591 -0.731 . . . . 0.62 110.438 178.563 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -53.91 -39.08 65.5 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.151 -0.477 . . . . 0.31 111.387 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -56.72 -42.87 79.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.31 -0.405 . . . . 1.94 111.301 178.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -75.99 -41.79 50.17 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.023 -0.535 . . . . 0.32 110.95 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.664 HD21 ' HA ' ' A' ' 56' ' ' ALA . 8.5 mp -57.88 -44.51 86.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.649 -0.705 . . . . 0.33 110.41 177.636 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -57.78 -26.96 62.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.116 -0.947 . . . . 1.47 111.902 -177.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.452 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -68.24 -41.46 81.16 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.648 -0.251 . . . . 2.24 110.479 -176.878 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . . . . . . . . . 15.5 mt -69.24 -31.99 51.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.884 0.373 . . . . 1.23 110.17 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.413 ' O ' HG23 ' A' ' 137' ' ' VAL . 39.4 t80 -60.28 -61.94 2.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.776 -0.647 . . . . 0.46 110.599 178.347 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 1.8 pp -64.87 -28.12 69.33 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-O 120.907 0.384 . . . . 0.64 110.638 -177.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.452 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.7 OUTLIER -59.73 -56.58 20.08 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.688 -0.687 . . . . 1.61 110.778 178.726 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . 0.704 ' HB3' HG22 ' A' ' 46' ' ' VAL . 1.2 mptp? -76.75 -20.46 56.46 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.768 -0.651 . . . . 1.52 111.138 -176.793 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.513 ' HA ' ' HG3' ' A' ' 140' ' ' MET . 23.1 t -73.97 -32.27 32.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.848 0.356 . . . . 0.35 110.289 178.445 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -65.13 -20.28 66.39 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.093 0.473 . . . . 0.5 110.14 176.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -97.24 -0.64 46.37 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.767 -0.651 . . . . 1.76 110.954 -178.323 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . 0.513 ' HG3' ' HA ' ' A' ' 137' ' ' VAL . 0.6 OUTLIER -68.54 151.31 97.31 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.258 -0.428 . . . . 0.86 111.397 -178.967 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -72.87 106.56 2.16 Favored 'Trans proline' 0 C--O 1.235 0.329 0 C-N-CA 122.583 2.189 . . . . 0.67 111.207 177.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -87.45 27.52 1.08 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.196 0.522 . . . . 2.91 111.726 -173.331 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -115.2 -38.93 3.72 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 115.383 -0.826 . . . . 2.7 109.536 176.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 71.78 95.76 0.07 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 114.986 -1.007 . . . . 2.34 111.106 176.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . . . . . . . . . 1.7 t -112.4 139.09 38.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.847 -0.615 . . . . 0.99 109.959 178.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.963 ' HG3' HG22 ' A' ' 36' ' ' THR . 1.2 mt-10 -80.06 146.45 31.93 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.791 0.329 . . . . 1.53 110.825 179.192 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . . . . . . . . . 51.3 mt . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.575 -0.726 . . . . 1.57 110.689 -178.736 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.681 0 N-CA-C 111.394 -0.682 . . . . 2.17 111.394 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 312' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 79.33 -114.82 3.97 Favored Glycine 0 N--CA 1.445 -0.718 0 C-N-CA 120.849 -0.691 . . . . 1.97 112.52 175.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.05 138.78 31.34 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 120.943 0.401 . . . . 3.58 110.839 -175.595 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.93 0 CA-C-O 118.241 -0.885 . . . . 4.6 109.823 179.195 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.423 ' HB2' ' O ' ' A' ' 24' ' ' SER . 6.1 Cg_endo . . . . . 0 N--CA 1.477 0.545 0 N-CA-C 110.378 -0.662 . . . . 6.18 110.378 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -76.98 89.64 3.54 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.999 0.428 . . . . 5.71 110.514 179.699 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.62 -78.59 2.0 Allowed Glycine 0 N--CA 1.45 -0.431 0 CA-C-N 115.889 -0.596 . . . . 3.45 112.182 179.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.423 ' O ' ' HB2' ' A' ' 21' ' ' PRO . 27.8 p -119.24 -177.4 3.34 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 110.449 -0.204 . . . . 2.44 110.449 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.422 ' HB3' ' CE1' ' A' ' 94' ' ' TYR . 4.2 mt-10 -51.93 144.55 11.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.275 -0.42 . . . . 1.64 110.818 172.598 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -119.81 -15.48 7.82 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-O 121.093 0.473 . . . . 0.93 110.165 174.732 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 3.3 m -166.3 135.61 3.13 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.624 -0.717 . . . . 1.61 110.086 -179.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -140.69 123.7 9.98 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 115.782 -0.645 . . . . 1.6 110.019 -179.008 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -79.91 -30.05 2.44 Favored 'Trans proline' 0 N--CA 1.475 0.41 0 C-N-CA 123.354 2.703 . . . . 1.87 112.8 177.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.4 t -76.43 -20.69 56.82 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.465 0.65 . . . . 2.18 109.571 -178.355 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.4 tttm -105.26 136.17 19.23 Favored Pre-proline 0 C--N 1.316 -0.865 0 CA-C-N 115.165 -0.925 . . . . 2.75 109.345 177.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.467 ' HB2' ' CE3' ' A' ' 96' ' ' TRP . 19.7 Cg_endo -60.21 137.87 77.78 Favored 'Trans proline' 0 C--O 1.239 0.53 0 C-N-CA 122.417 2.078 . . . . 1.38 112.274 178.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -141.12 78.04 0.29 Allowed Glycine 0 N--CA 1.446 -0.685 0 CA-C-N 115.089 -0.959 . . . . 0.97 110.869 -179.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.502 ' HG3' ' CE2' ' A' ' 96' ' ' TRP . 0.3 OUTLIER -93.86 174.26 7.26 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 110.291 -0.263 . . . . 1.93 110.291 -177.04 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.4 ttpp -120.53 107.02 12.35 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.821 0.344 . . . . 2.64 110.507 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.456 ' HB ' ' O ' ' A' ' 145' ' ' VAL . 7.3 p -107.5 165.39 11.44 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.689 -0.404 . . . . 0.68 110.232 177.188 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.474 ' O ' ' HB2' ' A' ' 41' ' ' TYR . 62.5 t30 -58.15 -38.93 77.54 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.917 -0.583 . . . . 1.47 110.684 179.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -65.14 -39.53 93.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.03 -0.532 . . . . 1.04 110.996 -178.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.475 ' HB2' ' HA ' ' A' ' 97' ' ' SER . 0.9 OUTLIER -60.19 -58.84 6.78 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 116.216 -0.447 . . . . 0.8 110.809 -178.89 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 20.8 mt-30 -66.82 -26.51 66.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.961 -0.563 . . . . 1.75 110.981 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.474 ' HB2' ' O ' ' A' ' 37' ' ' ASN . 56.6 t80 -60.25 -63.69 1.21 Allowed 'General case' 0 C--O 1.22 -0.498 0 CA-C-N 116.182 -0.463 . . . . 0.64 110.378 176.216 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.52 ' HA ' HG23 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -60.24 -28.56 68.13 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 116.593 -0.276 . . . . 1.13 111.0 -174.47 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.481 ' O ' HG13 ' A' ' 47' ' ' VAL . 6.0 tt0 -62.71 -55.9 22.51 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.034 0.445 . . . . 1.3 111.288 177.687 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 68.9 m-80 -86.56 -26.44 24.5 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.857 0.361 . . . . 0.5 111.963 -176.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 94.7 t -88.8 -57.59 4.12 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 N-CA-C 111.928 0.344 . . . . 0.3 111.928 -177.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.708 HG22 ' HB3' ' A' ' 136' ' ' LYS . 58.5 t -81.97 -64.45 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 112.33 0.493 . . . . 0.26 112.33 -169.243 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.481 HG13 ' O ' ' A' ' 43' ' ' GLN . 0.7 OUTLIER -66.81 -30.81 50.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 C-N-CA 120.21 -0.596 . . . . 0.83 110.967 -175.162 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -62.37 -42.25 99.27 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 120.919 -0.312 . . . . 2.4 111.304 177.555 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.441 HG21 ' HE2' ' A' ' 136' ' ' LYS . 2.8 p -69.42 -33.57 73.17 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-O 120.807 0.337 . . . . 0.55 110.876 179.513 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.611 HD12 ' HE1' ' A' ' 105' ' ' PHE . 0.2 OUTLIER -67.8 -41.48 83.11 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.997 -0.547 . . . . 0.33 109.698 176.439 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 15.0 t-105 -59.02 -36.78 75.54 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.153 -0.931 . . . . 0.39 111.538 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 4.8 mttm -82.98 7.69 14.86 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.025 0.38 . . . . 2.24 112.025 -174.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.444 ' CE1' ' HB2' ' A' ' 55' ' ' PHE . 13.1 t-80 -89.12 131.53 35.22 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.927 -0.397 . . . . 0.39 109.927 176.386 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -80.1 21.58 0.57 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.289 -0.414 . . . . 1.91 111.702 -175.257 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.444 ' HB2' ' CE1' ' A' ' 53' ' ' HIS . 0.2 OUTLIER -126.07 -6.43 6.64 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.3 0.571 . . . . 0.93 109.629 174.432 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.669 ' HA ' HD21 ' A' ' 129' ' ' LEU . . . -97.61 10.63 39.42 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.456 0.646 . . . . 0.28 110.264 179.514 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.467 ' CD1' ' HD3' ' A' ' 58' ' ' PRO . 57.4 p-90 -68.67 -31.68 3.14 Favored Pre-proline 0 CA--C 1.545 0.78 0 N-CA-C 113.954 1.094 . . . . 0.58 113.954 -175.608 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.467 ' HD3' ' CD1' ' A' ' 57' ' ' TRP . 16.7 Cg_exo -68.52 -13.19 36.8 Favored 'Trans proline' 0 C--N 1.363 1.335 0 CA-C-N 121.193 1.462 . . . . 0.47 112.103 178.246 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.479 ' CE2' HD11 ' A' ' 122' ' ' ILE . 2.4 m-85 -104.19 11.64 34.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.272 -0.422 . . . . 1.11 110.964 -178.546 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.417 ' CD1' ' HA ' ' A' ' 57' ' ' TRP . 2.6 m-30 -66.08 -43.91 85.97 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.089 -0.505 . . . . 0.63 111.433 -178.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -95.7 133.49 25.51 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.873 -0.603 . . . . 1.63 110.432 -175.611 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.456 ' HA ' ' OD1' ' A' ' 82' ' ' ASP . 18.3 Cg_endo -61.11 133.33 46.38 Favored 'Trans proline' 0 C--O 1.237 0.448 0 C-N-CA 122.783 2.322 . . . . 0.87 112.232 -179.755 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 1.7 t -68.65 113.16 4.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.868 0.842 . . . . 0.88 110.784 179.34 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.434 ' O ' ' HB3' ' A' ' 65' ' ' ALA . 0.3 OUTLIER -109.97 -0.88 17.97 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.803 -1.09 . . . . 1.85 109.39 177.216 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.434 ' HB3' ' O ' ' A' ' 64' ' ' ASP . . . 78.03 -72.99 0.08 Allowed 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 114.631 -1.168 . . . . 1.29 110.054 -171.189 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 31.1 mm -68.22 -44.64 83.93 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 116.577 -0.283 . . . . 1.89 111.585 -173.069 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 3.2 tptp -63.51 -19.9 65.16 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.307 0.484 . . . . 2.99 112.307 -176.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.458 ' HB3' HD22 ' A' ' 70' ' ' LEU . 0.1 OUTLIER -114.02 10.16 17.47 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 122.19 -0.318 . . . . 1.66 111.173 -179.684 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 61.23 42.53 11.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.611 0.72 . . . . 1.74 110.637 179.241 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.633 HD21 ' HD3' ' B' ' 312' ' ' ALY . 0.2 OUTLIER -119.51 73.93 16.27 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 114.943 -1.026 . . . . 1.61 110.555 -175.618 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -79.51 -34.48 1.03 Allowed 'Trans proline' 0 N--CA 1.461 -0.417 0 C-N-CA 121.731 1.621 . . . . 1.3 112.967 -176.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -89.71 1.86 55.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.345 0.593 . . . . 1.97 110.785 -176.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.451 ' HB2' ' HB3' ' A' ' 70' ' ' LEU . 8.7 t80 -61.85 -50.47 72.12 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.473 -0.785 . . . . 1.13 111.029 -178.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 2.3 m-70 -75.75 2.9 10.91 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.536 -0.757 . . . . 0.91 111.529 -174.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 16.7 mttt -89.91 -25.23 21.06 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.317 0.58 . . . . 2.86 110.015 178.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.5 mt -111.91 -45.86 5.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.574 -0.739 . . . . 1.0 110.292 -178.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 35.1 mm -94.66 121.84 45.6 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-N 116.005 -0.543 . . . . 0.75 110.257 -178.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.513 ' O ' ' HD3' ' A' ' 80' ' ' PRO . 0.0 OUTLIER -88.87 -26.12 21.79 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.956 -0.565 . . . . 1.99 110.553 -177.654 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 68.0 m-80 -113.18 84.72 7.54 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 115.953 -0.567 . . . . 2.05 109.922 177.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.513 ' HD3' ' O ' ' A' ' 78' ' ' LYS . 6.4 Cg_exo -73.32 94.17 0.83 Allowed 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.98 2.453 . . . . 0.89 112.137 -177.188 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -130.62 155.79 45.97 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.274 0.559 . . . . 0.82 110.739 -178.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.456 ' OD1' ' HA ' ' A' ' 62' ' ' PRO . 1.7 p-10 -140.61 -119.78 0.12 Allowed 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.876 -1.057 . . . . 1.42 109.098 -175.793 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' MET . . . . . . . . . . . . . 5.2 ttp -130.21 -20.0 3.09 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.912 0.387 . . . . 0.8 110.547 177.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -85.63 -30.25 24.64 Favored Glycine 0 N--CA 1.44 -1.068 0 N-CA-C 110.442 -1.063 . . . . 0.32 110.442 -179.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.77 -47.44 62.93 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.504 -0.348 . . . . 0.95 110.363 175.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.543 HG23 ' SG ' ' A' ' 101' ' ' CYS . 58.4 mt -56.3 -46.97 81.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.61 -0.723 . . . . 0.97 110.126 176.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.466 ' O ' ' HG2' ' A' ' 91' ' ' GLU . 0.0 OUTLIER -67.74 -34.89 77.73 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 115.772 -0.649 . . . . 1.15 110.614 -178.508 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.431 ' O ' ' HB2' ' A' ' 92' ' ' ASN . 21.3 tptt -67.05 -34.77 78.39 Favored 'General case' 0 C--N 1.339 0.124 0 CA-C-O 120.828 0.347 . . . . 2.46 110.544 -178.567 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 7.4 mtp180 -73.25 -33.5 65.31 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.032 0.444 . . . . 1.16 110.468 177.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 9.3 mt -68.0 -51.34 48.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.901 -0.591 . . . . 0.49 111.239 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 87' ' ' LYS . 0.5 OUTLIER -66.13 -26.03 67.25 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.934 0.397 . . . . 1.39 111.101 -178.089 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.431 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 1.7 m-80 -90.95 5.98 46.54 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.261 -0.427 . . . . 1.3 111.012 -179.022 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 49.7 51.67 16.05 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 121.381 0.61 . . . . 1.75 111.351 -178.843 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . 0.422 ' CE1' ' HB3' ' A' ' 25' ' ' GLU . 69.5 t80 -74.32 -21.96 59.47 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.429 0.633 . . . . 0.96 110.657 177.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -102.7 170.24 8.13 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.862 0.839 . . . . 1.28 112.017 -174.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . 0.502 ' CE2' ' HG3' ' A' ' 34' ' ' ARG . 2.1 t90 -85.73 -42.11 14.52 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 113.538 -1.664 . . . . 1.05 108.805 168.411 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.475 ' HA ' ' HB2' ' A' ' 39' ' ' LEU . 23.2 t -155.79 176.3 12.81 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.754 -1.112 . . . . 1.0 109.944 -171.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.26 -15.37 61.42 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.869 0.366 . . . . 0.66 110.793 -177.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.48 -30.91 69.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.131 0.491 . . . . 0.85 110.508 176.12 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -75.88 -30.83 58.98 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.541 -0.754 . . . . 2.44 109.883 -179.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . 0.543 ' SG ' HG23 ' A' ' 86' ' ' ILE . 0.5 OUTLIER -81.81 -22.11 37.28 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.596 -0.729 . . . . 0.95 110.43 -177.994 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 7.5 mmt -53.33 -35.29 60.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.655 -0.702 . . . . 1.13 110.617 177.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.13 -50.32 48.99 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.552 -0.749 . . . . 2.96 110.072 -178.738 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -64.53 -40.44 95.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.946 -0.57 . . . . 1.87 110.809 -176.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.611 ' HE1' HD12 ' A' ' 50' ' ' LEU . 0.2 OUTLIER -61.8 -44.93 95.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.464 . . . . 0.38 110.629 177.791 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.13 -41.32 99.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.129 -0.487 . . . . 0.97 110.202 177.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 54.9 m -63.38 -47.68 81.04 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.722 -0.672 . . . . 0.43 111.71 -178.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.416 ' HG3' ' N ' ' A' ' 109' ' ' PHE . 0.0 OUTLIER -58.85 -35.72 73.39 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.601 0.239 . . . . 0.88 111.206 -177.907 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' PHE . . . . . 0.416 ' N ' ' HG3' ' A' ' 108' ' ' MET . 6.1 m-85 -72.3 -49.22 36.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.022 0.439 . . . . 0.29 110.802 -178.094 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -67.93 -33.36 74.53 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.099 -0.501 . . . . 0.66 110.792 -177.748 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -53.01 -42.79 65.97 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.382 -0.826 . . . . 1.84 111.023 177.582 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -67.61 -40.06 84.72 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.08 0.466 . . . . 0.63 110.419 179.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -69.38 -19.06 63.83 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.239 -0.437 . . . . 0.81 111.269 -178.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 69.5 mt -92.18 -49.64 12.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.26 -0.427 . . . . 0.55 110.847 179.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -68.55 -38.44 80.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.922 -0.581 . . . . 1.22 110.831 -176.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' ASN . . . . . 0.42 ' HB2' HG23 ' A' ' 123' ' ' VAL . 18.3 m120 -99.99 177.9 4.96 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.033 -0.531 . . . . 1.04 110.812 -176.611 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -104.37 158.33 32.18 Favored Pre-proline 0 C--N 1.322 -0.623 0 N-CA-C 109.252 -0.647 . . . . 3.47 109.252 175.527 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . 0.77 ' HA ' HG11 ' A' ' 123' ' ' VAL . 22.7 Cg_exo -63.11 -7.54 12.03 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.365 2.043 . . . . 0.96 112.681 178.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.56 5.37 47.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.048 -0.523 . . . . 1.23 111.284 177.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -91.54 146.99 23.34 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.088 0.47 . . . . 1.34 111.367 -174.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -57.34 -46.72 83.0 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.075 -0.966 . . . . 1.44 111.282 -176.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.479 HD11 ' CE2' ' A' ' 59' ' ' PHE . 0.9 OUTLIER -65.67 -32.16 56.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.132 -0.485 . . . . 0.42 111.075 -177.473 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.77 HG11 ' HA ' ' A' ' 118' ' ' PRO . 1.0 OUTLIER -66.1 -44.07 92.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.194 0.521 . . . . 0.35 109.686 176.192 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.81 -32.04 71.41 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.519 -0.764 . . . . 0.52 109.91 178.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' MET . . . . . 0.423 ' O ' HD13 ' A' ' 129' ' ' LEU . 23.3 mtt -73.13 -45.32 57.53 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.471 -0.786 . . . . 0.62 110.57 179.171 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -56.04 -36.1 67.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.894 0.378 . . . . 0.31 111.236 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . 0.418 ' O ' ' HD2' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.21 -49.17 78.69 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.063 -0.517 . . . . 1.94 111.099 178.618 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -70.57 -37.1 73.91 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.08 0.467 . . . . 0.32 110.516 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.669 HD21 ' HA ' ' A' ' 56' ' ' ALA . 1.8 mp -59.55 -45.49 91.64 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.352 -0.84 . . . . 0.33 111.247 -179.138 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -65.95 -22.05 66.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.287 -0.415 . . . . 1.47 111.917 -174.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.508 ' O ' ' HB2' ' A' ' 135' ' ' GLN . 0.6 OUTLIER -64.67 -39.81 94.32 Favored 'General case' 0 CA--C 1.518 -0.255 0 N-CA-C 109.789 -0.449 . . . . 2.24 109.789 179.858 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' ILE . . . . . 0.449 HD12 HD23 ' A' ' 50' ' ' LEU . 2.7 mt -73.74 -34.0 39.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.701 -0.682 . . . . 1.23 110.023 177.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.512 ' O ' HG23 ' A' ' 137' ' ' VAL . 37.0 t80 -57.92 -62.19 1.99 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.627 -0.715 . . . . 0.46 110.556 178.619 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.36 -28.19 69.53 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.8 0.334 . . . . 0.64 110.755 -177.554 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.508 ' HB2' ' O ' ' A' ' 131' ' ' LYS . 0.0 OUTLIER -60.65 -51.24 70.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.793 -0.639 . . . . 1.61 111.337 178.055 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' LYS . . . . . 0.708 ' HB3' HG22 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -76.16 -29.01 57.59 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.912 -0.586 . . . . 1.52 110.786 -178.417 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 133' ' ' PHE . 53.9 t -70.8 -29.38 37.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.118 -0.492 . . . . 0.35 110.753 179.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -69.25 -17.57 63.77 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.095 0.474 . . . . 0.5 110.549 177.614 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -106.18 6.47 30.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.118 -0.492 . . . . 1.76 110.949 179.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' MET . . . . . 0.512 ' HG3' ' HA ' ' A' ' 137' ' ' VAL . 0.4 OUTLIER -70.15 149.33 96.11 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.082 -0.508 . . . . 0.86 110.322 177.214 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' PRO . . . . . 0.459 ' C ' ' H ' ' A' ' 143' ' ' GLU . 71.8 Cg_endo -75.9 102.96 1.66 Allowed 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 121.959 1.772 . . . . 0.67 111.753 -178.375 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -78.12 25.33 0.22 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.389 0.614 . . . . 2.91 110.39 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.459 ' H ' ' C ' ' A' ' 141' ' ' PRO . 3.4 mm-40 -101.4 -34.17 9.7 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 115.085 -0.961 . . . . 2.7 108.822 176.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 60.15 74.81 0.43 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 114.275 -1.329 . . . . 2.34 110.029 -178.682 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' VAL . . . . . 0.456 ' O ' ' HB ' ' A' ' 36' ' ' THR . 21.9 t -97.14 139.48 19.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-N 115.364 -0.834 . . . . 0.99 109.055 -176.221 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . 0.443 ' HA ' ' HA ' ' A' ' 36' ' ' THR . 11.8 tt0 -86.1 153.15 22.3 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 120.593 -0.443 . . . . 1.53 110.253 179.038 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.453 HD11 ' HA ' ' A' ' 37' ' ' ASN . 89.5 mt . . . . . 0 C--O 1.251 1.168 0 CA-C-O 118.474 -0.774 . . . . 1.57 110.86 -176.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 311' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.745 0 N-CA-C 111.902 -0.479 . . . . 2.17 111.902 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 312' ' ' ALY . . . . . 0.633 ' HD3' HD21 ' A' ' 70' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 313' ' ' GLY . . . . . . . . . . . . . . . 153.49 -33.5 0.76 Allowed Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 111.036 -0.826 . . . . 1.97 111.036 -178.133 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 314' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.28 107.1 5.65 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.651 -0.5 . . . . 3.58 109.651 176.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 315' ' ' ALY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 316' ' ' LYS . . . . . . . . . . . . . 1.6 mttm . . . . . 0 C--O 1.246 0.913 0 CA-C-O 118.531 -0.747 . . . . 4.6 110.338 -178.09 . . . . . . . . 0 0 . 1 stop_ save_